NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
649433 |
6taz   |
34443 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
# Restraints file 2: unambig.tbl
ASSI { 1}
(( segid " " and resid 131 and name H ))
( segid " " and resid 130 and name HD1%)
4.000 2.000 2.000 peak 1 spectrum 1 weight 0.10000E+01 volume 0.12550E-02 ppm1 7.421 ppm2 0.941 CV 1
ASSI { 5}
(( segid " " and resid 102 and name H ))
(( segid " " and resid 102 and name HA ))
3.000 1.100 1.100 peak 5 spectrum 1 weight 0.10000E+01 volume 0.13768E-02 ppm1 8.595 ppm2 4.037 CV 1
ASSI { 7}
(( segid " " and resid 102 and name H ))
(( segid " " and resid 102 and name HG3 ))
4.200 2.200 1.800 peak 7 spectrum 1 weight 0.10000E+01 volume 0.12197E-02 ppm1 8.598 ppm2 2.590 CV 1
ASSI { 8}
(( segid " " and resid 102 and name H ))
(( segid " " and resid 102 and name HB2 ))
2.900 1.100 1.100 peak 8 spectrum 1 weight 0.10000E+01 volume 0.25329E-02 ppm1 8.594 ppm2 2.154 CV 1
OR { 8}
(( segid " " and resid 102 and name H ))
( segid " " and resid 102 and name HE% )
OR { 8}
(( segid " " and resid 102 and name H ))
(( segid " " and resid 102 and name HB3 ))
ASSI { 9}
(( segid " " and resid 4 and name H ))
(( segid " " and resid 4 and name HA ))
2.800 1.000 1.000 peak 9 spectrum 1 weight 0.10000E+01 volume 0.32181E-02 ppm1 8.256 ppm2 4.328 CV 1
ASSI { 10}
(( segid " " and resid 4 and name H ))
(( segid " " and resid 4 and name HB2 ))
2.600 0.800 0.800 peak 10 spectrum 1 weight 0.10000E+01 volume 0.30630E-02 ppm1 8.257 ppm2 1.793 CV 1
ASSI { 11}
(( segid " " and resid 4 and name H ))
(( segid " " and resid 4 and name HG3 ))
3.100 1.200 1.200 peak 11 spectrum 1 weight 0.10000E+01 volume 0.29095E-02 ppm1 8.259 ppm2 1.698 CV 1
OR { 11}
(( segid " " and resid 4 and name H ))
(( segid " " and resid 4 and name HG2 ))
ASSI { 12}
(( segid " " and resid 4 and name H ))
(( segid " " and resid 3 and name HB3 ))
3.600 1.600 1.600 peak 12 spectrum 1 weight 0.10000E+01 volume 0.73999E-03 ppm1 8.255 ppm2 3.939 CV 1
ASSI { 13}
(( segid " " and resid 4 and name H ))
(( segid " " and resid 4 and name HD3 ))
4.600 2.700 1.400 peak 13 spectrum 1 weight 0.10000E+01 volume 0.47733E-03 ppm1 8.262 ppm2 3.234 CV 1
OR { 13}
(( segid " " and resid 4 and name H ))
(( segid " " and resid 4 and name HD2 ))
ASSI { 16}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 5 and name HB2 ))
2.300 0.700 0.700 peak 16 spectrum 1 weight 0.10000E+01 volume 0.52252E-02 ppm1 8.153 ppm2 1.745 CV 1
ASSI { 18}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 6 and name HA ))
3.000 1.100 1.100 peak 18 spectrum 1 weight 0.10000E+01 volume 0.20871E-02 ppm1 8.345 ppm2 4.571 CV 1
ASSI { 20}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HA ))
2.000 0.500 0.500 peak 20 spectrum 1 weight 0.10000E+01 volume 0.16597E-01 ppm1 8.345 ppm2 4.313 CV 1
ASSI { 21}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 8 and name HA ))
3.300 3.300 2.700 peak 21 spectrum 1 weight 0.10000E+01 volume 0.17583E-02 ppm1 8.345 ppm2 4.213 CV 1
OR { 21}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 8 and name HB ))
ASSI { 22}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HB3 ))
3.200 1.300 1.300 peak 22 spectrum 1 weight 0.10000E+01 volume 0.25187E-02 ppm1 8.346 ppm2 1.831 CV 1
ASSI { 23}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HG3 ))
3.200 1.300 1.300 peak 23 spectrum 1 weight 0.10000E+01 volume 0.23554E-02 ppm1 8.346 ppm2 1.641 CV 1
OR { 23}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HG2 ))
ASSI { 24}
(( segid " " and resid 6 and name H ))
( segid " " and resid 6 and name HB% )
2.300 0.700 0.700 peak 24 spectrum 1 weight 0.10000E+01 volume 0.91589E-02 ppm1 8.344 ppm2 1.339 CV 1
ASSI { 25}
(( segid " " and resid 6 and name H ))
( segid " " and resid 8 and name HG2%)
2.800 2.800 3.200 peak 25 spectrum 1 weight 0.10000E+01 volume 0.46093E-02 ppm1 8.345 ppm2 1.268 CV 1
ASSI { 26}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 7 and name HD2 ))
5.000 3.100 1.000 peak 26 spectrum 1 weight 0.10000E+01 volume 0.67800E-03 ppm1 8.342 ppm2 3.821 CV 1
ASSI { 27}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 7 and name HD3 ))
4.400 2.400 1.600 peak 27 spectrum 1 weight 0.10000E+01 volume 0.10247E-02 ppm1 8.343 ppm2 3.553 CV 1
ASSI { 29}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HB2 ))
3.500 1.600 1.600 peak 29 spectrum 1 weight 0.10000E+01 volume 0.29428E-02 ppm1 8.345 ppm2 1.743 CV 1
ASSI { 30}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name H ))
4.500 2.600 1.500 peak 30 spectrum 1 weight 0.10000E+01 volume 0.62539E-03 ppm1 8.344 ppm2 8.145 CV 1
ASSI { 31}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HD3 ))
2.500 2.500 3.500 peak 31 spectrum 1 weight 0.10000E+01 volume 0.63277E-03 ppm1 8.342 ppm2 3.197 CV 1
OR { 31}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 5 and name HD2 ))
ASSI { 32}
(( segid " " and resid 8 and name H ))
(( segid " " and resid 7 and name HA ))
2.100 0.500 0.500 peak 32 spectrum 1 weight 0.10000E+01 volume 0.12232E-01 ppm1 8.350 ppm2 4.463 CV 1
ASSI { 33}
(( segid " " and resid 8 and name H ))
(( segid " " and resid 8 and name HA ))
2.600 0.800 0.800 peak 33 spectrum 1 weight 0.10000E+01 volume 0.63143E-02 ppm1 8.350 ppm2 4.228 CV 1
OR { 33}
(( segid " " and resid 8 and name H ))
(( segid " " and resid 8 and name HB ))
ASSI { 35}
(( segid " " and resid 8 and name H ))
(( segid " " and resid 7 and name HB3 ))
3.100 1.200 1.200 peak 35 spectrum 1 weight 0.10000E+01 volume 0.21516E-02 ppm1 8.349 ppm2 2.239 CV 1
ASSI { 36}
(( segid " " and resid 8 and name H ))
( segid " " and resid 8 and name HG2%)
2.700 0.900 0.900 peak 36 spectrum 1 weight 0.10000E+01 volume 0.33698E-02 ppm1 8.348 ppm2 1.253 CV 1
ASSI { 37}
(( segid " " and resid 8 and name H ))
(( segid " " and resid 9 and name H ))
3.700 1.700 1.700 peak 37 spectrum 1 weight 0.10000E+01 volume 0.12148E-02 ppm1 8.350 ppm2 8.689 CV 1
ASSI { 38}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 9 and name HA ))
2.800 1.000 1.000 peak 38 spectrum 1 weight 0.10000E+01 volume 0.19211E-02 ppm1 8.689 ppm2 4.473 CV 1
ASSI { 39}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 8 and name HA ))
2.100 0.500 0.500 peak 39 spectrum 1 weight 0.10000E+01 volume 0.10962E-01 ppm1 8.689 ppm2 4.234 CV 1
OR { 39}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 8 and name HB ))
ASSI { 40}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 9 and name HB3 ))
2.700 0.900 0.900 peak 40 spectrum 1 weight 0.10000E+01 volume 0.42539E-02 ppm1 8.689 ppm2 2.889 CV 1
OR { 40}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 42}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 9 and name HE1 ))
4.700 2.800 1.300 peak 42 spectrum 1 weight 0.10000E+01 volume 0.62612E-03 ppm1 8.684 ppm2 0.101 CV 1
ASSI { 44}
(( segid " " and resid 9 and name H ))
(( segid " " and resid 9 and name HD1 ))
2.000 0.500 0.500 peak 44 spectrum 1 weight 0.10000E+01 volume 0.32605E-02 ppm1 8.688 ppm2 6.981 CV 1
ASSI { 45}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 8 and name HA ))
4.200 2.200 1.800 peak 45 spectrum 1 weight 0.10000E+01 volume 0.81429E-03 ppm1 9.901 ppm2 4.230 CV 1
ASSI { 51}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 53 and name H ))
4.700 2.800 1.300 peak 51 spectrum 1 weight 0.10000E+01 volume 0.57252E-03 ppm1 9.901 ppm2 8.143 CV 1
ASSI { 52}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 9 and name HD1 ))
2.000 0.500 0.500 peak 52 spectrum 1 weight 0.10000E+01 volume 0.15668E-01 ppm1 9.901 ppm2 6.968 CV 1
OR { 52}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 9 and name HZ2 ))
ASSI { 53}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 9 and name HH2 ))
4.000 2.000 2.000 peak 53 spectrum 1 weight 0.10000E+01 volume 0.12391E-02 ppm1 9.898 ppm2 6.729 CV 1
ASSI { 54}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 53 and name HD2 ))
3.100 1.200 1.200 peak 54 spectrum 1 weight 0.10000E+01 volume 0.54236E-03 ppm1 9.904 ppm2 5.783 CV 1
ASSI { 55}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 9 and name HA ))
2.300 0.700 0.700 peak 55 spectrum 1 weight 0.10000E+01 volume 0.70709E-02 ppm1 8.814 ppm2 4.491 CV 1
ASSI { 56}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 13 and name HA ))
4.000 2.000 2.000 peak 56 spectrum 1 weight 0.10000E+01 volume 0.96614E-03 ppm1 8.813 ppm2 4.243 CV 1
ASSI { 57}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 10 and name HB3 ))
2.900 1.100 1.100 peak 57 spectrum 1 weight 0.10000E+01 volume 0.27447E-02 ppm1 8.814 ppm2 4.060 CV 1
ASSI { 58}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 9 and name HB2 ))
3.100 1.200 1.200 peak 58 spectrum 1 weight 0.10000E+01 volume 0.19050E-02 ppm1 8.813 ppm2 2.889 CV 1
OR { 58}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 9 and name HB3 ))
ASSI { 59}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 13 and name HB3 ))
3.000 1.100 1.100 peak 59 spectrum 1 weight 0.10000E+01 volume 0.42607E-02 ppm1 8.814 ppm2 2.402 CV 1
OR { 59}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 13 and name HB2 ))
OR { 59}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 13 and name HG2 ))
ASSI { 61}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 13 and name H ))
3.600 1.600 1.600 peak 61 spectrum 1 weight 0.10000E+01 volume 0.66529E-03 ppm1 8.820 ppm2 8.037 CV 1
ASSI { 62}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 9 and name HE3 ))
4.600 2.600 1.400 peak 62 spectrum 1 weight 0.10000E+01 volume 0.89600E-03 ppm1 8.816 ppm2 7.072 CV 1
ASSI { 63}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 10 and name HA ))
3.000 1.100 1.100 peak 63 spectrum 1 weight 0.10000E+01 volume 0.16889E-02 ppm1 8.815 ppm2 4.931 CV 1
ASSI { 65}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HA ))
2.700 0.900 0.900 peak 65 spectrum 1 weight 0.10000E+01 volume 0.37176E-02 ppm1 8.972 ppm2 4.138 CV 1
ASSI { 68}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HB2 ))
2.500 0.800 0.800 peak 68 spectrum 1 weight 0.10000E+01 volume 0.46870E-02 ppm1 8.972 ppm2 2.122 CV 1
ASSI { 69}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HB3 ))
2.800 1.000 1.000 peak 69 spectrum 1 weight 0.10000E+01 volume 0.47588E-02 ppm1 8.973 ppm2 2.010 CV 1
ASSI { 70}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 14 and name H ))
3.800 1.800 1.800 peak 70 spectrum 1 weight 0.10000E+01 volume 0.50998E-03 ppm1 8.974 ppm2 8.724 CV 1
ASSI { 71}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 13 and name H ))
2.800 1.000 1.000 peak 71 spectrum 1 weight 0.10000E+01 volume 0.24080E-02 ppm1 8.972 ppm2 8.040 CV 1
ASSI { 72}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 13 and name HA ))
3.100 1.200 1.200 peak 72 spectrum 1 weight 0.10000E+01 volume 0.15023E-02 ppm1 8.042 ppm2 4.256 CV 1
ASSI { 73}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 12 and name HA ))
3.700 1.700 1.700 peak 73 spectrum 1 weight 0.10000E+01 volume 0.88681E-03 ppm1 8.043 ppm2 4.148 CV 1
ASSI { 74}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 13 and name HB2 ))
2.500 0.800 0.800 peak 74 spectrum 1 weight 0.10000E+01 volume 0.48534E-02 ppm1 8.043 ppm2 2.407 CV 1
OR { 74}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 13 and name HB3 ))
OR { 74}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 13 and name HG3 ))
OR { 74}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 13 and name HG2 ))
ASSI { 75}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 12 and name HB2 ))
3.400 1.400 1.400 peak 75 spectrum 1 weight 0.10000E+01 volume 0.18951E-02 ppm1 8.041 ppm2 2.142 CV 1
ASSI { 76}
(( segid " " and resid 13 and name H ))
(( segid " " and resid 12 and name HB3 ))
2.700 0.900 0.900 peak 76 spectrum 1 weight 0.10000E+01 volume 0.20877E-02 ppm1 8.046 ppm2 2.018 CV 1
ASSI { 79}
(( segid " " and resid 14 and name H ))
( segid " " and resid 15 and name HB% )
5.000 3.100 1.000 peak 79 spectrum 1 weight 0.10000E+01 volume 0.50127E-03 ppm1 8.714 ppm2 1.587 CV 1
ASSI { 80}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 11 and name HA ))
3.600 1.600 1.600 peak 80 spectrum 1 weight 0.10000E+01 volume 0.12310E-02 ppm1 8.720 ppm2 4.520 CV 1
ASSI { 82}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 14 and name HA ))
2.800 1.000 1.000 peak 82 spectrum 1 weight 0.10000E+01 volume 0.19720E-02 ppm1 8.723 ppm2 3.990 CV 1
ASSI { 85}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 14 and name HB3 ))
2.800 1.000 1.000 peak 85 spectrum 1 weight 0.10000E+01 volume 0.34498E-02 ppm1 8.723 ppm2 2.101 CV 1
OR { 85}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 14 and name HG3 ))
ASSI { 87}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 13 and name H ))
2.600 0.800 0.800 peak 87 spectrum 1 weight 0.10000E+01 volume 0.25613E-02 ppm1 8.721 ppm2 8.040 CV 1
ASSI { 88}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 11 and name HA ))
4.100 2.100 1.900 peak 88 spectrum 1 weight 0.10000E+01 volume 0.55611E-03 ppm1 8.274 ppm2 4.538 CV 1
ASSI { 90}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 14 and name HA ))
3.100 1.200 1.200 peak 90 spectrum 1 weight 0.10000E+01 volume 0.17225E-02 ppm1 8.276 ppm2 3.994 CV 1
ASSI { 91}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 16 and name HB2 ))
4.200 2.200 1.800 peak 91 spectrum 1 weight 0.10000E+01 volume 0.12941E-02 ppm1 8.274 ppm2 3.362 CV 1
OR { 91}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 16 and name HB3 ))
ASSI { 94}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 14 and name HB3 ))
3.100 1.200 1.200 peak 94 spectrum 1 weight 0.10000E+01 volume 0.31631E-02 ppm1 8.276 ppm2 2.088 CV 1
ASSI { 95}
(( segid " " and resid 15 and name H ))
( segid " " and resid 15 and name HB% )
2.200 0.600 0.600 peak 95 spectrum 1 weight 0.10000E+01 volume 0.10261E-01 ppm1 8.277 ppm2 1.572 CV 1
ASSI { 96}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 16 and name H ))
2.300 0.700 0.700 peak 96 spectrum 1 weight 0.10000E+01 volume 0.52648E-02 ppm1 8.277 ppm2 7.991 CV 1
ASSI { 97}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 12 and name H ))
4.200 2.200 1.800 peak 97 spectrum 1 weight 0.10000E+01 volume 0.41074E-03 ppm1 8.276 ppm2 8.981 CV 1
ASSI { 98}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 14 and name H ))
2.400 0.700 0.700 peak 98 spectrum 1 weight 0.10000E+01 volume 0.47295E-02 ppm1 8.276 ppm2 8.727 CV 1
ASSI { 99}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 16 and name HA ))
2.700 0.900 0.900 peak 99 spectrum 1 weight 0.10000E+01 volume 0.21020E-02 ppm1 7.987 ppm2 4.740 CV 1
ASSI { 101}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 19 and name HA ))
4.700 2.800 1.300 peak 101 spectrum 1 weight 0.10000E+01 volume 0.71000E-03 ppm1 7.991 ppm2 4.036 CV 1
ASSI { 102}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 16 and name HB2 ))
2.500 0.800 0.800 peak 102 spectrum 1 weight 0.10000E+01 volume 0.47551E-02 ppm1 7.986 ppm2 3.368 CV 1
OR { 102}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 16 and name HB3 ))
ASSI { 104}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 19 and name HB2 ))
3.800 1.800 1.800 peak 104 spectrum 1 weight 0.10000E+01 volume 0.12243E-02 ppm1 7.991 ppm2 2.309 CV 1
ASSI { 105}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 14 and name HB3 ))
4.100 2.100 1.900 peak 105 spectrum 1 weight 0.10000E+01 volume 0.10769E-02 ppm1 7.988 ppm2 2.120 CV 1
OR { 105}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 14 and name HG3 ))
ASSI { 106}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 17 and name HB2 ))
4.600 2.600 1.400 peak 106 spectrum 1 weight 0.10000E+01 volume 0.73167E-03 ppm1 7.983 ppm2 1.787 CV 1
ASSI { 107}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 18 and name HG2 ))
3.400 1.500 1.500 peak 107 spectrum 1 weight 0.10000E+01 volume 0.17110E-02 ppm1 7.984 ppm2 1.653 CV 1
ASSI { 109}
(( segid " " and resid 16 and name H ))
( segid " " and resid 17 and name HD1%)
4.900 3.000 1.100 peak 109 spectrum 1 weight 0.10000E+01 volume 0.81093E-03 ppm1 8.000 ppm2 1.050 CV 1
ASSI { 112}
(( segid " " and resid 16 and name H ))
( segid " " and resid 57 and name HE% )
3.900 1.900 1.900 peak 112 spectrum 1 weight 0.10000E+01 volume 0.70275E-03 ppm1 7.987 ppm2 1.986 CV 1
ASSI { 117}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 16 and name HB2 ))
2.900 1.000 1.000 peak 117 spectrum 1 weight 0.10000E+01 volume 0.23557E-02 ppm1 8.774 ppm2 3.369 CV 1
OR { 117}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 16 and name HB3 ))
ASSI { 118}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 17 and name HB3 ))
2.600 0.800 0.800 peak 118 spectrum 1 weight 0.10000E+01 volume 0.23798E-02 ppm1 8.775 ppm2 2.218 CV 1
ASSI { 119}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 17 and name HB2 ))
2.600 0.800 0.800 peak 119 spectrum 1 weight 0.10000E+01 volume 0.25815E-02 ppm1 8.775 ppm2 1.780 CV 1
ASSI { 120}
(( segid " " and resid 17 and name H ))
( segid " " and resid 15 and name HB% )
4.300 2.300 1.700 peak 120 spectrum 1 weight 0.10000E+01 volume 0.11294E-02 ppm1 8.775 ppm2 1.546 CV 1
ASSI { 121}
(( segid " " and resid 17 and name H ))
( segid " " and resid 17 and name HD1%)
3.800 1.800 1.800 peak 121 spectrum 1 weight 0.10000E+01 volume 0.19280E-02 ppm1 8.775 ppm2 1.051 CV 1
ASSI { 123}
(( segid " " and resid 17 and name H ))
( segid " " and resid 59 and name HD1%)
4.600 2.600 1.400 peak 123 spectrum 1 weight 0.10000E+01 volume 0.10053E-02 ppm1 8.770 ppm2 0.829 CV 1
ASSI { 124}
(( segid " " and resid 17 and name H ))
( segid " " and resid 17 and name HD2%)
4.300 2.300 1.700 peak 124 spectrum 1 weight 0.10000E+01 volume 0.12064E-02 ppm1 8.778 ppm2 0.743 CV 1
ASSI { 126}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 16 and name H ))
2.500 0.800 0.800 peak 126 spectrum 1 weight 0.10000E+01 volume 0.30139E-02 ppm1 8.776 ppm2 7.990 CV 1
ASSI { 127}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 15 and name HA ))
3.800 1.800 1.800 peak 127 spectrum 1 weight 0.10000E+01 volume 0.10433E-02 ppm1 8.313 ppm2 4.205 CV 1
ASSI { 129}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 18 and name HA ))
2.600 0.800 0.800 peak 129 spectrum 1 weight 0.10000E+01 volume 0.22621E-02 ppm1 8.316 ppm2 3.801 CV 1
ASSI { 130}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 18 and name HD3 ))
4.100 2.100 1.900 peak 130 spectrum 1 weight 0.10000E+01 volume 0.12992E-02 ppm1 8.315 ppm2 3.323 CV 1
OR { 130}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 18 and name HD2 ))
ASSI { 134}
(( segid " " and resid 18 and name H ))
( segid " " and resid 59 and name HD1%)
3.800 1.800 1.800 peak 134 spectrum 1 weight 0.10000E+01 volume 0.13686E-02 ppm1 8.315 ppm2 0.828 CV 1
ASSI { 135}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 19 and name H ))
2.400 0.700 0.700 peak 135 spectrum 1 weight 0.10000E+01 volume 0.33072E-02 ppm1 8.314 ppm2 7.991 CV 1
ASSI { 136}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 17 and name H ))
2.600 0.900 0.900 peak 136 spectrum 1 weight 0.10000E+01 volume 0.19199E-02 ppm1 8.315 ppm2 8.772 CV 1
ASSI { 137}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 16 and name HA ))
3.700 1.700 1.700 peak 137 spectrum 1 weight 0.10000E+01 volume 0.56037E-03 ppm1 7.991 ppm2 4.726 CV 1
ASSI { 138}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 15 and name HA ))
4.300 2.300 1.700 peak 138 spectrum 1 weight 0.10000E+01 volume 0.73603E-03 ppm1 7.991 ppm2 4.200 CV 1
ASSI { 139}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 19 and name HA ))
2.700 0.900 0.900 peak 139 spectrum 1 weight 0.10000E+01 volume 0.29070E-02 ppm1 7.992 ppm2 4.028 CV 1
ASSI { 140}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 18 and name HA ))
3.400 1.400 1.400 peak 140 spectrum 1 weight 0.10000E+01 volume 0.74869E-03 ppm1 7.991 ppm2 3.814 CV 1
ASSI { 141}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 19 and name HB2 ))
2.300 0.600 0.600 peak 141 spectrum 1 weight 0.10000E+01 volume 0.51275E-02 ppm1 7.991 ppm2 2.280 CV 1
OR { 141}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 19 and name HB3 ))
ASSI { 143}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 18 and name HG2 ))
2.800 0.900 0.900 peak 143 spectrum 1 weight 0.10000E+01 volume 0.17157E-02 ppm1 7.989 ppm2 1.673 CV 1
OR { 143}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 18 and name HG3 ))
ASSI { 147}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 19 and name HG2 ))
4.000 2.000 2.000 peak 147 spectrum 1 weight 0.10000E+01 volume 0.19713E-02 ppm1 7.991 ppm2 2.464 CV 1
ASSI { 148}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 20 and name H ))
2.600 0.900 0.900 peak 148 spectrum 1 weight 0.10000E+01 volume 0.19007E-02 ppm1 7.991 ppm2 8.677 CV 1
ASSI { 151}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 20 and name HB2 ))
2.400 0.700 0.700 peak 151 spectrum 1 weight 0.10000E+01 volume 0.19827E-02 ppm1 8.674 ppm2 1.138 CV 1
ASSI { 152}
(( segid " " and resid 20 and name H ))
( segid " " and resid 20 and name HD1%)
3.800 1.800 1.800 peak 152 spectrum 1 weight 0.10000E+01 volume 0.31168E-02 ppm1 8.672 ppm2 0.680 CV 1
ASSI { 158}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 18 and name HA ))
3.200 1.300 1.300 peak 158 spectrum 1 weight 0.10000E+01 volume 0.72997E-03 ppm1 8.936 ppm2 3.806 CV 1
ASSI { 159}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HB3 ))
2.400 0.700 0.700 peak 159 spectrum 1 weight 0.10000E+01 volume 0.27839E-02 ppm1 8.942 ppm2 3.041 CV 1
OR { 159}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HB2 ))
ASSI { 162}
(( segid " " and resid 21 and name H ))
( segid " " and resid 20 and name HD1%)
4.300 2.300 1.700 peak 162 spectrum 1 weight 0.10000E+01 volume 0.74547E-03 ppm1 8.940 ppm2 0.658 CV 1
ASSI { 163}
(( segid " " and resid 21 and name H ))
( segid " " and resid 20 and name HD2%)
4.800 2.800 1.200 peak 163 spectrum 1 weight 0.10000E+01 volume 0.74102E-03 ppm1 8.943 ppm2 0.611 CV 1
ASSI { 164}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 20 and name H ))
2.700 0.900 0.900 peak 164 spectrum 1 weight 0.10000E+01 volume 0.16459E-02 ppm1 8.943 ppm2 8.675 CV 1
ASSI { 165}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 22 and name H ))
2.900 1.000 1.000 peak 165 spectrum 1 weight 0.10000E+01 volume 0.16369E-02 ppm1 8.941 ppm2 8.561 CV 1
ASSI { 166}
(( segid " " and resid 21 and name H ))
( segid " " and resid 21 and name HD% )
4.200 2.200 1.800 peak 166 spectrum 1 weight 0.10000E+01 volume 0.11282E-02 ppm1 8.938 ppm2 6.907 CV 1
ASSI { 168}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 22 and name HA ))
2.900 1.100 1.100 peak 168 spectrum 1 weight 0.10000E+01 volume 0.85014E-03 ppm1 8.561 ppm2 3.711 CV 1
ASSI { 169}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 21 and name HB2 ))
2.500 0.800 0.800 peak 169 spectrum 1 weight 0.10000E+01 volume 0.13888E-02 ppm1 8.557 ppm2 3.043 CV 1
OR { 169}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 21 and name HB3 ))
ASSI { 170}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 22 and name HG ))
2.300 0.700 0.700 peak 170 spectrum 1 weight 0.10000E+01 volume 0.19693E-02 ppm1 8.558 ppm2 2.052 CV 1
ASSI { 171}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 22 and name HB2 ))
3.000 1.100 1.100 peak 171 spectrum 1 weight 0.10000E+01 volume 0.19496E-02 ppm1 8.558 ppm2 1.947 CV 1
ASSI { 173}
(( segid " " and resid 22 and name H ))
( segid " " and resid 22 and name HD2%)
2.800 1.000 1.000 peak 173 spectrum 1 weight 0.10000E+01 volume 0.30092E-02 ppm1 8.557 ppm2 0.948 CV 1
OR { 173}
(( segid " " and resid 22 and name H ))
( segid " " and resid 22 and name HD1%)
ASSI { 175}
(( segid " " and resid 22 and name H ))
( segid " " and resid 21 and name HD% )
3.400 1.400 1.400 peak 175 spectrum 1 weight 0.10000E+01 volume 0.76915E-03 ppm1 8.563 ppm2 6.901 CV 1
ASSI { 178}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 23 and name HA ))
2.600 0.900 0.900 peak 178 spectrum 1 weight 0.10000E+01 volume 0.50197E-02 ppm1 7.846 ppm2 4.241 CV 1
ASSI { 179}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 22 and name HA ))
3.200 1.300 1.300 peak 179 spectrum 1 weight 0.10000E+01 volume 0.10394E-02 ppm1 7.848 ppm2 3.732 CV 1
ASSI { 180}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 24 and name HB2 ))
4.100 2.100 1.900 peak 180 spectrum 1 weight 0.10000E+01 volume 0.97946E-03 ppm1 7.847 ppm2 2.477 CV 1
ASSI { 181}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 22 and name HG ))
3.600 1.600 1.600 peak 181 spectrum 1 weight 0.10000E+01 volume 0.14707E-02 ppm1 7.849 ppm2 2.051 CV 1
ASSI { 182}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 22 and name HB2 ))
2.700 0.900 0.900 peak 182 spectrum 1 weight 0.10000E+01 volume 0.22300E-02 ppm1 7.848 ppm2 1.937 CV 1
ASSI { 183}
(( segid " " and resid 23 and name H ))
( segid " " and resid 23 and name HB% )
2.300 0.600 0.600 peak 183 spectrum 1 weight 0.10000E+01 volume 0.11226E-01 ppm1 7.846 ppm2 1.438 CV 1
ASSI { 184}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 25 and name HG2 ))
3.800 1.800 1.800 peak 184 spectrum 1 weight 0.10000E+01 volume 0.99832E-03 ppm1 7.850 ppm2 1.170 CV 1
OR { 184}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 25 and name HB3 ))
OR { 184}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 186}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 24 and name HD22))
4.900 3.000 1.100 peak 186 spectrum 1 weight 0.10000E+01 volume 0.87836E-03 ppm1 7.840 ppm2 7.493 CV 1
ASSI { 187}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 24 and name H ))
2.500 0.800 0.800 peak 187 spectrum 1 weight 0.10000E+01 volume 0.42719E-02 ppm1 7.846 ppm2 7.283 CV 1
ASSI { 188}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 21 and name H ))
3.500 1.500 1.500 peak 188 spectrum 1 weight 0.10000E+01 volume 0.73951E-03 ppm1 7.842 ppm2 8.942 CV 1
ASSI { 189}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 22 and name H ))
2.400 0.700 0.700 peak 189 spectrum 1 weight 0.10000E+01 volume 0.33338E-02 ppm1 7.846 ppm2 8.559 CV 1
ASSI { 190}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 23 and name HA ))
3.600 1.600 1.600 peak 190 spectrum 1 weight 0.10000E+01 volume 0.11263E-02 ppm1 7.280 ppm2 4.242 CV 1
ASSI { 192}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 25 and name HA ))
4.100 2.100 1.900 peak 192 spectrum 1 weight 0.10000E+01 volume 0.69077E-03 ppm1 7.277 ppm2 3.860 CV 1
ASSI { 193}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 24 and name HB2 ))
2.500 0.800 0.800 peak 193 spectrum 1 weight 0.10000E+01 volume 0.32010E-02 ppm1 7.282 ppm2 2.517 CV 1
ASSI { 195}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 25 and name HG2 ))
3.900 1.900 1.900 peak 195 spectrum 1 weight 0.10000E+01 volume 0.10195E-02 ppm1 7.284 ppm2 1.235 CV 1
ASSI { 196}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 25 and name HB3 ))
3.500 1.500 1.500 peak 196 spectrum 1 weight 0.10000E+01 volume 0.18591E-02 ppm1 7.281 ppm2 1.125 CV 1
OR { 196}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 197}
(( segid " " and resid 24 and name H ))
( segid " " and resid 32 and name HG2%)
3.000 1.100 1.100 peak 197 spectrum 1 weight 0.10000E+01 volume 0.22872E-02 ppm1 7.280 ppm2 1.046 CV 1
ASSI { 198}
(( segid " " and resid 24 and name H ))
( segid " " and resid 21 and name HD% )
4.800 2.800 1.200 peak 198 spectrum 1 weight 0.10000E+01 volume 0.26940E-03 ppm1 7.286 ppm2 6.922 CV 1
ASSI { 199}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 24 and name HA ))
3.100 1.200 1.200 peak 199 spectrum 1 weight 0.10000E+01 volume 0.14640E-02 ppm1 7.281 ppm2 4.932 CV 1
ASSI { 200}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 30 and name HE21))
6.000 6.000 0.000 peak 200 spectrum 1 weight 0.10000E+01 volume 0.69849E-04 ppm1 7.276 ppm2 7.037 CV 1
ASSI { 202}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 25 and name H ))
2.300 0.700 0.700 peak 202 spectrum 1 weight 0.10000E+01 volume 0.49392E-02 ppm1 7.281 ppm2 8.054 CV 1
ASSI { 204}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 24 and name HD22))
4.300 2.300 1.700 peak 204 spectrum 1 weight 0.10000E+01 volume 0.13009E-02 ppm1 7.284 ppm2 7.486 CV 1
ASSI { 207}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HB2 ))
3.500 1.500 1.500 peak 207 spectrum 1 weight 0.10000E+01 volume 0.20844E-02 ppm1 8.047 ppm2 1.438 CV 1
ASSI { 208}
(( segid " " and resid 25 and name H ))
( segid " " and resid 32 and name HG2%)
3.000 1.100 1.100 peak 208 spectrum 1 weight 0.10000E+01 volume 0.29776E-02 ppm1 8.044 ppm2 1.038 CV 1
ASSI { 209}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HA ))
3.000 1.100 1.100 peak 209 spectrum 1 weight 0.10000E+01 volume 0.15861E-02 ppm1 8.046 ppm2 3.854 CV 1
ASSI { 210}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 22 and name HA ))
3.900 1.900 1.900 peak 210 spectrum 1 weight 0.10000E+01 volume 0.57300E-03 ppm1 8.041 ppm2 3.746 CV 1
ASSI { 211}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HD3 ))
3.900 1.900 1.900 peak 211 spectrum 1 weight 0.10000E+01 volume 0.23080E-02 ppm1 8.045 ppm2 1.336 CV 1
OR { 211}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HD2 ))
ASSI { 212}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HB3 ))
2.700 0.900 0.900 peak 212 spectrum 1 weight 0.10000E+01 volume 0.35855E-02 ppm1 8.044 ppm2 1.144 CV 1
OR { 212}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 220}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 26 and name HB2 ))
3.000 1.100 1.100 peak 220 spectrum 1 weight 0.10000E+01 volume 0.19952E-02 ppm1 8.544 ppm2 2.904 CV 1
ASSI { 221}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 26 and name HB3 ))
3.200 1.200 1.200 peak 221 spectrum 1 weight 0.10000E+01 volume 0.22856E-02 ppm1 8.543 ppm2 2.488 CV 1
ASSI { 222}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name HG2 ))
3.100 1.200 1.200 peak 222 spectrum 1 weight 0.10000E+01 volume 0.19375E-02 ppm1 8.544 ppm2 1.238 CV 1
ASSI { 223}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name HG3 ))
2.900 1.000 1.000 peak 223 spectrum 1 weight 0.10000E+01 volume 0.24705E-02 ppm1 8.541 ppm2 1.141 CV 1
OR { 223}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name HB3 ))
ASSI { 224}
(( segid " " and resid 26 and name H ))
( segid " " and resid 32 and name HG2%)
3.400 1.500 1.500 peak 224 spectrum 1 weight 0.10000E+01 volume 0.24284E-02 ppm1 8.543 ppm2 1.064 CV 1
ASSI { 225}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name H ))
3.000 1.100 1.100 peak 225 spectrum 1 weight 0.10000E+01 volume 0.11492E-02 ppm1 8.537 ppm2 8.043 CV 1
ASSI { 227}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 26 and name HA ))
2.800 1.000 1.000 peak 227 spectrum 1 weight 0.10000E+01 volume 0.36168E-02 ppm1 8.542 ppm2 4.820 CV 1
ASSI { 228}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 27 and name HA ))
2.800 1.000 1.000 peak 228 spectrum 1 weight 0.10000E+01 volume 0.26241E-02 ppm1 7.313 ppm2 3.889 CV 1
ASSI { 229}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 26 and name HB2 ))
4.300 2.300 1.700 peak 229 spectrum 1 weight 0.10000E+01 volume 0.60740E-03 ppm1 7.313 ppm2 2.899 CV 1
ASSI { 230}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 27 and name HB ))
2.800 1.000 1.000 peak 230 spectrum 1 weight 0.10000E+01 volume 0.34881E-02 ppm1 7.312 ppm2 2.112 CV 1
ASSI { 232}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 24 and name HB3 ))
4.600 2.700 1.400 peak 232 spectrum 1 weight 0.10000E+01 volume 0.63641E-03 ppm1 7.317 ppm2 2.543 CV 1
OR { 232}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 24 and name HB2 ))
ASSI { 234}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 24 and name HA ))
3.700 1.700 1.700 peak 234 spectrum 1 weight 0.10000E+01 volume 0.82388E-03 ppm1 7.328 ppm2 4.918 CV 1
ASSI { 235}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 26 and name HA ))
3.000 1.200 1.200 peak 235 spectrum 1 weight 0.10000E+01 volume 0.18919E-02 ppm1 7.313 ppm2 4.821 CV 1
ASSI { 236}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 26 and name H ))
2.500 0.800 0.800 peak 236 spectrum 1 weight 0.10000E+01 volume 0.33880E-02 ppm1 7.312 ppm2 8.546 CV 1
ASSI { 238}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 27 and name HA ))
2.300 0.600 0.600 peak 238 spectrum 1 weight 0.10000E+01 volume 0.78177E-02 ppm1 8.629 ppm2 3.893 CV 1
ASSI { 239}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 28 and name HG2 ))
3.800 1.800 1.800 peak 239 spectrum 1 weight 0.10000E+01 volume 0.17391E-02 ppm1 8.626 ppm2 2.309 CV 1
ASSI { 243}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 27 and name H ))
4.400 2.400 1.600 peak 243 spectrum 1 weight 0.10000E+01 volume 0.83294E-03 ppm1 8.628 ppm2 7.305 CV 1
ASSI { 244}
(( segid " " and resid 28 and name H ))
(( segid " " and resid 29 and name H ))
4.400 2.400 1.600 peak 244 spectrum 1 weight 0.10000E+01 volume 0.60866E-03 ppm1 8.627 ppm2 8.838 CV 1
ASSI { 245}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 28 and name HA ))
2.300 0.700 0.700 peak 245 spectrum 1 weight 0.10000E+01 volume 0.48629E-02 ppm1 8.851 ppm2 4.147 CV 1
ASSI { 247}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 29 and name HA3 ))
3.400 1.400 1.400 peak 247 spectrum 1 weight 0.10000E+01 volume 0.19560E-02 ppm1 8.852 ppm2 3.753 CV 1
ASSI { 248}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 28 and name HG2 ))
4.200 2.200 1.800 peak 248 spectrum 1 weight 0.10000E+01 volume 0.90209E-03 ppm1 8.852 ppm2 2.264 CV 1
ASSI { 249}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 28 and name HB2 ))
3.600 1.700 1.700 peak 249 spectrum 1 weight 0.10000E+01 volume 0.15598E-02 ppm1 8.851 ppm2 1.982 CV 1
OR { 249}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 28 and name HB3 ))
ASSI { 250}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 30 and name H ))
3.000 1.100 1.100 peak 250 spectrum 1 weight 0.10000E+01 volume 0.14869E-02 ppm1 8.851 ppm2 7.496 CV 1
ASSI { 252}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 30 and name HA ))
3.000 1.200 1.200 peak 252 spectrum 1 weight 0.10000E+01 volume 0.15540E-02 ppm1 7.495 ppm2 4.579 CV 1
ASSI { 254}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 29 and name HA3 ))
4.000 2.000 2.000 peak 254 spectrum 1 weight 0.10000E+01 volume 0.11304E-02 ppm1 7.498 ppm2 3.757 CV 1
ASSI { 255}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 30 and name HB2 ))
2.800 1.000 1.000 peak 255 spectrum 1 weight 0.10000E+01 volume 0.38542E-02 ppm1 7.495 ppm2 2.053 CV 1
ASSI { 256}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 30 and name HB3 ))
2.800 1.000 1.000 peak 256 spectrum 1 weight 0.10000E+01 volume 0.27890E-02 ppm1 7.495 ppm2 1.859 CV 1
ASSI { 258}
(( segid " " and resid 30 and name HE21))
(( segid " " and resid 24 and name HB2 ))
3.300 1.400 1.400 peak 258 spectrum 1 weight 0.10000E+01 volume 0.16075E-02 ppm1 7.038 ppm2 2.507 CV 1
ASSI { 259}
(( segid " " and resid 30 and name HE21))
(( segid " " and resid 30 and name HG2 ))
2.200 0.600 0.600 peak 259 spectrum 1 weight 0.10000E+01 volume 0.40815E-02 ppm1 7.038 ppm2 2.142 CV 1
ASSI { 261}
(( segid " " and resid 30 and name HE21))
( segid " " and resid 35 and name HB% )
2.700 0.900 0.900 peak 261 spectrum 1 weight 0.10000E+01 volume 0.16247E-02 ppm1 7.036 ppm2 1.413 CV 1
ASSI { 262}
(( segid " " and resid 30 and name HE21))
( segid " " and resid 27 and name HG1%)
2.800 1.000 1.000 peak 262 spectrum 1 weight 0.10000E+01 volume 0.26507E-02 ppm1 7.038 ppm2 0.972 CV 1
ASSI { 263}
(( segid " " and resid 30 and name HE21))
(( segid " " and resid 24 and name HA ))
4.700 2.700 1.300 peak 263 spectrum 1 weight 0.10000E+01 volume 0.61100E-03 ppm1 7.034 ppm2 4.929 CV 1
ASSI { 265}
(( segid " " and resid 30 and name HE22))
(( segid " " and resid 32 and name HA ))
4.300 2.300 1.700 peak 265 spectrum 1 weight 0.10000E+01 volume 0.11504E-02 ppm1 7.760 ppm2 3.964 CV 1
ASSI { 266}
(( segid " " and resid 30 and name HE22))
(( segid " " and resid 24 and name HB2 ))
3.400 1.500 1.500 peak 266 spectrum 1 weight 0.10000E+01 volume 0.21811E-02 ppm1 7.761 ppm2 2.504 CV 1
ASSI { 267}
(( segid " " and resid 30 and name HE22))
(( segid " " and resid 30 and name HG2 ))
2.900 1.000 1.000 peak 267 spectrum 1 weight 0.10000E+01 volume 0.76716E-02 ppm1 7.759 ppm2 2.143 CV 1
ASSI { 268}
(( segid " " and resid 30 and name HE22))
(( segid " " and resid 30 and name HB3 ))
3.700 1.700 1.700 peak 268 spectrum 1 weight 0.10000E+01 volume 0.14246E-02 ppm1 7.760 ppm2 1.851 CV 1
ASSI { 269}
(( segid " " and resid 30 and name HE22))
( segid " " and resid 35 and name HB% )
3.300 1.300 1.300 peak 269 spectrum 1 weight 0.10000E+01 volume 0.21970E-02 ppm1 7.758 ppm2 1.411 CV 1
ASSI { 270}
(( segid " " and resid 30 and name HE22))
( segid " " and resid 27 and name HG1%)
2.900 1.100 1.100 peak 270 spectrum 1 weight 0.10000E+01 volume 0.33484E-02 ppm1 7.759 ppm2 0.970 CV 1
ASSI { 271}
(( segid " " and resid 30 and name HE22))
( segid " " and resid 27 and name HG2%)
2.900 1.100 1.100 peak 271 spectrum 1 weight 0.10000E+01 volume 0.36081E-02 ppm1 7.759 ppm2 0.917 CV 1
ASSI { 272}
(( segid " " and resid 30 and name HE22))
(( segid " " and resid 24 and name H ))
4.000 2.000 2.000 peak 272 spectrum 1 weight 0.10000E+01 volume 0.11837E-02 ppm1 7.761 ppm2 7.303 CV 1
ASSI { 273}
(( segid " " and resid 30 and name HE22))
(( segid " " and resid 30 and name HE21))
1.400 0.200 0.800 peak 273 spectrum 1 weight 0.10000E+01 volume 0.42748E-01 ppm1 7.759 ppm2 7.036 CV 1
ASSI { 274}
(( segid " " and resid 30 and name HE22))
(( segid " " and resid 24 and name HA ))
4.300 2.300 1.700 peak 274 spectrum 1 weight 0.10000E+01 volume 0.77288E-03 ppm1 7.758 ppm2 4.921 CV 1
ASSI { 275}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 30 and name HA ))
2.700 0.900 0.900 peak 275 spectrum 1 weight 0.10000E+01 volume 0.22252E-02 ppm1 8.872 ppm2 4.582 CV 1
ASSI { 276}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 31 and name HB3 ))
3.900 1.900 1.900 peak 276 spectrum 1 weight 0.10000E+01 volume 0.13493E-02 ppm1 8.870 ppm2 2.856 CV 1
ASSI { 277}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 31 and name HB2 ))
2.600 0.900 0.900 peak 277 spectrum 1 weight 0.10000E+01 volume 0.16060E-02 ppm1 8.872 ppm2 2.677 CV 1
ASSI { 278}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 30 and name HG2 ))
3.100 1.200 1.200 peak 278 spectrum 1 weight 0.10000E+01 volume 0.13807E-02 ppm1 8.872 ppm2 2.134 CV 1
ASSI { 279}
(( segid " " and resid 31 and name H ))
(( segid " " and resid 30 and name HB3 ))
4.300 2.300 1.700 peak 279 spectrum 1 weight 0.10000E+01 volume 0.66999E-03 ppm1 8.872 ppm2 1.868 CV 1
ASSI { 280}
(( segid " " and resid 32 and name H ))
(( segid " " and resid 32 and name HA ))
3.200 1.300 1.300 peak 280 spectrum 1 weight 0.10000E+01 volume 0.11179E-02 ppm1 9.096 ppm2 3.971 CV 1
ASSI { 281}
(( segid " " and resid 32 and name H ))
(( segid " " and resid 32 and name HB ))
2.900 1.000 1.000 peak 281 spectrum 1 weight 0.10000E+01 volume 0.14194E-02 ppm1 9.099 ppm2 2.363 CV 1
ASSI { 283}
(( segid " " and resid 32 and name H ))
( segid " " and resid 32 and name HG2%)
4.500 2.500 1.500 peak 283 spectrum 1 weight 0.10000E+01 volume 0.84078E-03 ppm1 9.098 ppm2 1.045 CV 1
ASSI { 287}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 33 and name HA ))
2.900 1.100 1.100 peak 287 spectrum 1 weight 0.10000E+01 volume 0.80884E-03 ppm1 7.981 ppm2 3.583 CV 1
ASSI { 289}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 36 and name HG13))
3.800 1.800 1.800 peak 289 spectrum 1 weight 0.10000E+01 volume 0.11841E-02 ppm1 7.977 ppm2 2.141 CV 1
OR { 289}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 36 and name HB ))
ASSI { 290}
(( segid " " and resid 33 and name H ))
( segid " " and resid 35 and name HB% )
3.600 1.600 1.600 peak 290 spectrum 1 weight 0.10000E+01 volume 0.13644E-02 ppm1 7.979 ppm2 1.388 CV 1
ASSI { 293}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 32 and name H ))
3.300 1.400 1.400 peak 293 spectrum 1 weight 0.10000E+01 volume 0.82828E-03 ppm1 7.984 ppm2 9.097 CV 1
ASSI { 294}
(( segid " " and resid 34 and name H ))
(( segid " " and resid 34 and name HA ))
2.900 1.000 1.000 peak 294 spectrum 1 weight 0.10000E+01 volume 0.13965E-02 ppm1 8.011 ppm2 3.978 CV 1
ASSI { 295}
(( segid " " and resid 34 and name H ))
(( segid " " and resid 33 and name HA ))
3.500 1.500 1.500 peak 295 spectrum 1 weight 0.10000E+01 volume 0.44046E-03 ppm1 8.018 ppm2 3.588 CV 1
ASSI { 296}
(( segid " " and resid 34 and name H ))
(( segid " " and resid 34 and name HG2 ))
3.400 1.500 1.500 peak 296 spectrum 1 weight 0.10000E+01 volume 0.21789E-02 ppm1 8.008 ppm2 2.395 CV 1
ASSI { 297}
(( segid " " and resid 34 and name H ))
(( segid " " and resid 34 and name HB2 ))
2.400 0.700 0.700 peak 297 spectrum 1 weight 0.10000E+01 volume 0.36772E-02 ppm1 8.008 ppm2 2.228 CV 1
OR { 297}
(( segid " " and resid 34 and name H ))
(( segid " " and resid 34 and name HG3 ))
ASSI { 298}
(( segid " " and resid 34 and name H ))
( segid " " and resid 35 and name HB% )
4.400 2.400 1.600 peak 298 spectrum 1 weight 0.10000E+01 volume 0.73355E-03 ppm1 8.010 ppm2 1.393 CV 1
ASSI { 299}
(( segid " " and resid 34 and name H ))
( segid " " and resid 33 and name HG1%)
2.700 0.900 0.900 peak 299 spectrum 1 weight 0.10000E+01 volume 0.20752E-02 ppm1 8.010 ppm2 0.946 CV 1
OR { 299}
(( segid " " and resid 34 and name H ))
( segid " " and resid 33 and name HG2%)
ASSI { 301}
(( segid " " and resid 132 and name H ))
(( segid " " and resid 131 and name HA ))
2.300 0.600 0.600 peak 301 spectrum 1 weight 0.10000E+01 volume 0.73384E-02 ppm1 7.874 ppm2 4.757 CV 1
ASSI { 302}
(( segid " " and resid 132 and name H ))
(( segid " " and resid 132 and name HA ))
2.600 0.800 0.800 peak 302 spectrum 1 weight 0.10000E+01 volume 0.47334E-02 ppm1 7.873 ppm2 4.374 CV 1
ASSI { 303}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 35 and name HA ))
2.600 0.800 0.800 peak 303 spectrum 1 weight 0.10000E+01 volume 0.41214E-02 ppm1 7.876 ppm2 4.191 CV 1
ASSI { 305}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 33 and name HA ))
3.700 1.700 1.700 peak 305 spectrum 1 weight 0.10000E+01 volume 0.60993E-03 ppm1 7.874 ppm2 3.587 CV 1
ASSI { 306}
(( segid " " and resid 132 and name H ))
(( segid " " and resid 131 and name HB3 ))
3.400 1.400 1.400 peak 306 spectrum 1 weight 0.10000E+01 volume 0.20436E-02 ppm1 7.871 ppm2 3.289 CV 1
ASSI { 308}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 34 and name HG2 ))
3.800 1.800 1.800 peak 308 spectrum 1 weight 0.10000E+01 volume 0.17556E-02 ppm1 7.876 ppm2 2.387 CV 1
ASSI { 309}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 36 and name HG13))
2.900 1.100 1.100 peak 309 spectrum 1 weight 0.10000E+01 volume 0.48719E-02 ppm1 7.876 ppm2 2.137 CV 1
OR { 309}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 36 and name HB ))
ASSI { 310}
(( segid " " and resid 132 and name H ))
(( segid " " and resid 132 and name HB2 ))
2.200 0.600 0.600 peak 310 spectrum 1 weight 0.10000E+01 volume 0.99552E-02 ppm1 7.873 ppm2 1.846 CV 1
OR { 310}
(( segid " " and resid 132 and name H ))
(( segid " " and resid 132 and name HB3 ))
ASSI { 311}
(( segid " " and resid 35 and name H ))
( segid " " and resid 35 and name HB% )
2.200 0.600 0.600 peak 311 spectrum 1 weight 0.10000E+01 volume 0.94783E-02 ppm1 7.876 ppm2 1.421 CV 1
ASSI { 313}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 38 and name H ))
4.500 2.500 1.500 peak 313 spectrum 1 weight 0.10000E+01 volume 0.36611E-03 ppm1 7.877 ppm2 7.598 CV 1
ASSI { 316}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 37 and name H ))
4.000 2.000 2.000 peak 316 spectrum 1 weight 0.10000E+01 volume 0.77364E-03 ppm1 7.872 ppm2 8.591 CV 1
ASSI { 317}
(( segid " " and resid 132 and name H ))
(( segid " " and resid 133 and name H ))
3.400 1.500 1.500 peak 317 spectrum 1 weight 0.10000E+01 volume 0.17283E-02 ppm1 7.873 ppm2 8.490 CV 1
ASSI { 318}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 36 and name H ))
2.300 0.600 0.600 peak 318 spectrum 1 weight 0.10000E+01 volume 0.47193E-02 ppm1 7.877 ppm2 8.099 CV 1
ASSI { 319}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 34 and name H ))
2.100 0.600 0.600 peak 319 spectrum 1 weight 0.10000E+01 volume 0.76658E-02 ppm1 7.875 ppm2 7.990 CV 1
ASSI { 320}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 35 and name HA ))
4.000 2.000 2.000 peak 320 spectrum 1 weight 0.10000E+01 volume 0.39089E-03 ppm1 8.106 ppm2 4.194 CV 1
ASSI { 322}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 36 and name HA ))
2.800 1.000 1.000 peak 322 spectrum 1 weight 0.10000E+01 volume 0.14208E-02 ppm1 8.114 ppm2 3.657 CV 1
ASSI { 323}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 33 and name HA ))
2.900 1.000 1.000 peak 323 spectrum 1 weight 0.10000E+01 volume 0.13785E-02 ppm1 8.103 ppm2 3.603 CV 1
ASSI { 324}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 36 and name HB ))
2.200 0.600 0.600 peak 324 spectrum 1 weight 0.10000E+01 volume 0.38656E-02 ppm1 8.111 ppm2 2.107 CV 1
OR { 324}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 36 and name HG13))
ASSI { 325}
(( segid " " and resid 36 and name H ))
( segid " " and resid 35 and name HB% )
3.200 1.300 1.300 peak 325 spectrum 1 weight 0.10000E+01 volume 0.15690E-02 ppm1 8.105 ppm2 1.406 CV 1
ASSI { 326}
(( segid " " and resid 36 and name H ))
( segid " " and resid 32 and name HG1%)
4.000 2.000 2.000 peak 326 spectrum 1 weight 0.10000E+01 volume 0.11797E-02 ppm1 8.112 ppm2 1.341 CV 1
ASSI { 331}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 37 and name H ))
2.800 1.000 1.000 peak 331 spectrum 1 weight 0.10000E+01 volume 0.12927E-02 ppm1 8.104 ppm2 8.594 CV 1
ASSI { 333}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 36 and name HB ))
2.200 0.600 0.600 peak 333 spectrum 1 weight 0.10000E+01 volume 0.20935E-02 ppm1 8.591 ppm2 2.107 CV 1
ASSI { 334}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 37 and name HG ))
2.000 0.500 0.500 peak 334 spectrum 1 weight 0.10000E+01 volume 0.24601E-02 ppm1 8.592 ppm2 1.662 CV 1
ASSI { 336}
(( segid " " and resid 37 and name H ))
( segid " " and resid 38 and name HB% )
4.600 2.600 1.400 peak 336 spectrum 1 weight 0.10000E+01 volume 0.74343E-03 ppm1 8.586 ppm2 1.282 CV 1
ASSI { 338}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 33 and name HA ))
3.600 1.600 1.600 peak 338 spectrum 1 weight 0.10000E+01 volume 0.77972E-03 ppm1 8.584 ppm2 3.604 CV 1
ASSI { 343}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 35 and name HA ))
3.200 1.300 1.300 peak 343 spectrum 1 weight 0.10000E+01 volume 0.22425E-02 ppm1 7.591 ppm2 4.183 CV 1
ASSI { 344}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 38 and name HA ))
2.500 0.800 0.800 peak 344 spectrum 1 weight 0.10000E+01 volume 0.56701E-02 ppm1 7.592 ppm2 4.081 CV 1
ASSI { 345}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 34 and name HA ))
3.100 1.200 1.200 peak 345 spectrum 1 weight 0.10000E+01 volume 0.30628E-02 ppm1 7.593 ppm2 3.976 CV 1
ASSI { 346}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 36 and name HA ))
3.600 1.600 1.600 peak 346 spectrum 1 weight 0.10000E+01 volume 0.44869E-03 ppm1 7.596 ppm2 3.656 CV 1
ASSI { 347}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 36 and name HB ))
3.800 1.800 1.800 peak 347 spectrum 1 weight 0.10000E+01 volume 0.84297E-03 ppm1 7.592 ppm2 2.101 CV 1
ASSI { 350}
(( segid " " and resid 38 and name H ))
( segid " " and resid 38 and name HB% )
2.200 0.600 0.600 peak 350 spectrum 1 weight 0.10000E+01 volume 0.93982E-02 ppm1 7.592 ppm2 1.285 CV 1
ASSI { 352}
(( segid " " and resid 38 and name H ))
( segid " " and resid 37 and name HD1%)
2.400 0.700 0.700 peak 352 spectrum 1 weight 0.10000E+01 volume 0.22364E-02 ppm1 7.592 ppm2 0.850 CV 1
ASSI { 353}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 37 and name H ))
2.300 0.700 0.700 peak 353 spectrum 1 weight 0.10000E+01 volume 0.28498E-02 ppm1 7.593 ppm2 8.596 CV 1
ASSI { 354}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 36 and name H ))
3.500 1.500 1.500 peak 354 spectrum 1 weight 0.10000E+01 volume 0.57184E-03 ppm1 7.594 ppm2 8.101 CV 1
ASSI { 355}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 40 and name H ))
3.500 1.500 1.500 peak 355 spectrum 1 weight 0.10000E+01 volume 0.19528E-02 ppm1 7.593 ppm2 7.880 CV 1
ASSI { 356}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 39 and name HA ))
3.000 1.100 1.100 peak 356 spectrum 1 weight 0.10000E+01 volume 0.21030E-02 ppm1 7.539 ppm2 4.735 CV 1
ASSI { 357}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 38 and name HA ))
3.400 1.400 1.400 peak 357 spectrum 1 weight 0.10000E+01 volume 0.10869E-02 ppm1 7.538 ppm2 4.080 CV 1
ASSI { 358}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 37 and name HA ))
3.500 1.500 1.500 peak 358 spectrum 1 weight 0.10000E+01 volume 0.66344E-03 ppm1 7.542 ppm2 3.955 CV 1
ASSI { 360}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 39 and name HB2 ))
2.700 0.900 0.900 peak 360 spectrum 1 weight 0.10000E+01 volume 0.16143E-02 ppm1 7.540 ppm2 3.471 CV 1
ASSI { 361}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 39 and name HB3 ))
3.700 1.700 1.700 peak 361 spectrum 1 weight 0.10000E+01 volume 0.19764E-02 ppm1 7.539 ppm2 2.868 CV 1
ASSI { 362}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 40 and name HB2 ))
4.300 2.300 1.700 peak 362 spectrum 1 weight 0.10000E+01 volume 0.10076E-02 ppm1 7.541 ppm2 1.900 CV 1
OR { 362}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 40 and name HG ))
ASSI { 364}
(( segid " " and resid 39 and name H ))
( segid " " and resid 38 and name HB% )
3.300 1.300 1.300 peak 364 spectrum 1 weight 0.10000E+01 volume 0.20236E-02 ppm1 7.537 ppm2 1.285 CV 1
ASSI { 366}
(( segid " " and resid 39 and name H ))
( segid " " and resid 37 and name HD1%)
4.900 3.000 1.100 peak 366 spectrum 1 weight 0.10000E+01 volume 0.59645E-03 ppm1 7.528 ppm2 0.877 CV 1
ASSI { 367}
(( segid " " and resid 39 and name H ))
( segid " " and resid 20 and name HD1%)
4.100 2.100 1.900 peak 367 spectrum 1 weight 0.10000E+01 volume 0.10704E-02 ppm1 7.540 ppm2 0.628 CV 1
OR { 367}
(( segid " " and resid 39 and name H ))
( segid " " and resid 20 and name HD2%)
ASSI { 368}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 39 and name HD2 ))
2.900 1.100 1.100 peak 368 spectrum 1 weight 0.10000E+01 volume 0.13413E-02 ppm1 7.539 ppm2 7.430 CV 1
ASSI { 370}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 39 and name HA ))
3.200 1.200 1.200 peak 370 spectrum 1 weight 0.10000E+01 volume 0.22515E-02 ppm1 7.878 ppm2 4.741 CV 1
ASSI { 371}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 40 and name HA ))
2.900 1.000 1.000 peak 371 spectrum 1 weight 0.10000E+01 volume 0.19589E-02 ppm1 7.879 ppm2 4.454 CV 1
ASSI { 372}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 37 and name HA ))
3.200 1.300 1.300 peak 372 spectrum 1 weight 0.10000E+01 volume 0.88452E-03 ppm1 7.876 ppm2 3.938 CV 1
ASSI { 373}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 39 and name HB2 ))
3.400 1.500 1.500 peak 373 spectrum 1 weight 0.10000E+01 volume 0.10293E-02 ppm1 7.877 ppm2 3.452 CV 1
ASSI { 374}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 39 and name HB3 ))
3.800 1.800 1.800 peak 374 spectrum 1 weight 0.10000E+01 volume 0.15508E-02 ppm1 7.878 ppm2 2.860 CV 1
ASSI { 375}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 40 and name HB2 ))
2.500 0.800 0.800 peak 375 spectrum 1 weight 0.10000E+01 volume 0.47943E-02 ppm1 7.879 ppm2 1.916 CV 1
OR { 375}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 40 and name HG ))
ASSI { 376}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 40 and name HB3 ))
2.500 0.800 0.800 peak 376 spectrum 1 weight 0.10000E+01 volume 0.42794E-02 ppm1 7.879 ppm2 1.529 CV 1
ASSI { 377}
(( segid " " and resid 40 and name H ))
( segid " " and resid 42 and name HG2%)
3.700 1.700 1.700 peak 377 spectrum 1 weight 0.10000E+01 volume 0.62305E-03 ppm1 7.879 ppm2 1.285 CV 1
ASSI { 378}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 20 and name HB2 ))
4.000 2.000 2.000 peak 378 spectrum 1 weight 0.10000E+01 volume 0.59454E-03 ppm1 7.878 ppm2 1.183 CV 1
ASSI { 379}
(( segid " " and resid 40 and name H ))
( segid " " and resid 40 and name HD2%)
3.200 1.300 1.300 peak 379 spectrum 1 weight 0.10000E+01 volume 0.35854E-02 ppm1 7.878 ppm2 0.961 CV 1
OR { 379}
(( segid " " and resid 40 and name H ))
( segid " " and resid 40 and name HD1%)
ASSI { 380}
(( segid " " and resid 40 and name H ))
( segid " " and resid 20 and name HD2%)
3.400 1.500 1.500 peak 380 spectrum 1 weight 0.10000E+01 volume 0.15991E-02 ppm1 7.880 ppm2 0.599 CV 1
ASSI { 381}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 38 and name HA ))
4.200 2.200 1.800 peak 381 spectrum 1 weight 0.10000E+01 volume 0.46799E-03 ppm1 7.880 ppm2 4.085 CV 1
ASSI { 382}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 39 and name H ))
2.100 0.500 0.500 peak 382 spectrum 1 weight 0.10000E+01 volume 0.80054E-02 ppm1 7.879 ppm2 7.540 CV 1
ASSI { 383}
(( segid " " and resid 40 and name H ))
(( segid " " and resid 41 and name H ))
4.400 2.400 1.600 peak 383 spectrum 1 weight 0.10000E+01 volume 0.64277E-03 ppm1 7.878 ppm2 8.411 CV 1
ASSI { 384}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 42 and name HB ))
4.000 2.000 2.000 peak 384 spectrum 1 weight 0.10000E+01 volume 0.61426E-03 ppm1 8.418 ppm2 4.198 CV 1
OR { 384}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 42 and name HA ))
ASSI { 385}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 40 and name HA ))
2.700 0.900 0.900 peak 385 spectrum 1 weight 0.10000E+01 volume 0.25260E-02 ppm1 8.420 ppm2 4.454 CV 1
ASSI { 386}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 41 and name HB2 ))
3.200 1.300 1.300 peak 386 spectrum 1 weight 0.10000E+01 volume 0.15203E-02 ppm1 8.422 ppm2 2.823 CV 1
OR { 386}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 41 and name HB3 ))
ASSI { 387}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 40 and name HG ))
3.800 1.800 1.800 peak 387 spectrum 1 weight 0.10000E+01 volume 0.13682E-02 ppm1 8.420 ppm2 1.914 CV 1
OR { 387}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 388}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 40 and name HB3 ))
4.500 2.600 1.500 peak 388 spectrum 1 weight 0.10000E+01 volume 0.58169E-03 ppm1 8.427 ppm2 1.520 CV 1
ASSI { 389}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 42 and name H ))
3.000 1.100 1.100 peak 389 spectrum 1 weight 0.10000E+01 volume 0.13199E-02 ppm1 8.417 ppm2 8.183 CV 1
ASSI { 390}
(( segid " " and resid 41 and name H ))
(( segid " " and resid 43 and name H ))
5.000 3.200 1.000 peak 390 spectrum 1 weight 0.10000E+01 volume 0.48028E-03 ppm1 8.427 ppm2 7.987 CV 1
ASSI { 392}
(( segid " " and resid 41 and name HD22))
(( segid " " and resid 41 and name HB2 ))
3.400 1.400 1.400 peak 392 spectrum 1 weight 0.10000E+01 volume 0.40365E-02 ppm1 6.746 ppm2 2.822 CV 1
OR { 392}
(( segid " " and resid 41 and name HD22))
(( segid " " and resid 41 and name HB3 ))
ASSI { 394}
(( segid " " and resid 41 and name HD21))
(( segid " " and resid 41 and name HB2 ))
2.600 0.800 0.800 peak 394 spectrum 1 weight 0.10000E+01 volume 0.46719E-02 ppm1 7.462 ppm2 2.824 CV 1
OR { 394}
(( segid " " and resid 41 and name HD21))
(( segid " " and resid 41 and name HB3 ))
ASSI { 395}
(( segid " " and resid 41 and name HD21))
(( segid " " and resid 41 and name HD22))
1.500 0.300 0.700 peak 395 spectrum 1 weight 0.10000E+01 volume 0.46051E-01 ppm1 7.463 ppm2 6.746 CV 1
ASSI { 396}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 42 and name HA ))
2.600 0.900 0.900 peak 396 spectrum 1 weight 0.10000E+01 volume 0.45158E-02 ppm1 8.179 ppm2 4.203 CV 1
OR { 396}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 42 and name HB ))
ASSI { 397}
(( segid " " and resid 42 and name H ))
( segid " " and resid 42 and name HG2%)
2.700 0.900 0.900 peak 397 spectrum 1 weight 0.10000E+01 volume 0.15377E-02 ppm1 8.178 ppm2 1.250 CV 1
ASSI { 399}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 41 and name HB2 ))
4.200 2.200 1.800 peak 399 spectrum 1 weight 0.10000E+01 volume 0.59104E-03 ppm1 8.175 ppm2 2.843 CV 1
OR { 399}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 41 and name HB3 ))
ASSI { 401}
(( segid " " and resid 42 and name H ))
( segid " " and resid 40 and name HD2%)
3.800 1.800 1.800 peak 401 spectrum 1 weight 0.10000E+01 volume 0.89328E-03 ppm1 8.179 ppm2 0.976 CV 1
OR { 401}
(( segid " " and resid 42 and name H ))
( segid " " and resid 40 and name HD1%)
ASSI { 402}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 43 and name H ))
2.500 0.800 0.800 peak 402 spectrum 1 weight 0.10000E+01 volume 0.32004E-02 ppm1 8.179 ppm2 7.984 CV 1
ASSI { 404}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 43 and name HA ))
2.600 0.900 0.900 peak 404 spectrum 1 weight 0.10000E+01 volume 0.24896E-02 ppm1 7.980 ppm2 4.387 CV 1
ASSI { 405}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 42 and name HA ))
3.000 1.100 1.100 peak 405 spectrum 1 weight 0.10000E+01 volume 0.52658E-02 ppm1 7.981 ppm2 4.203 CV 1
OR { 405}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 42 and name HB ))
ASSI { 406}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 44 and name HD3 ))
4.200 2.200 1.800 peak 406 spectrum 1 weight 0.10000E+01 volume 0.69238E-03 ppm1 7.984 ppm2 3.737 CV 1
ASSI { 408}
(( segid " " and resid 43 and name H ))
( segid " " and resid 43 and name HG2%)
2.500 0.800 0.800 peak 408 spectrum 1 weight 0.10000E+01 volume 0.52150E-02 ppm1 7.981 ppm2 0.723 CV 1
OR { 408}
(( segid " " and resid 43 and name H ))
( segid " " and resid 43 and name HG1%)
ASSI { 409}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 44 and name HD2 ))
4.900 3.000 1.100 peak 409 spectrum 1 weight 0.10000E+01 volume 0.37420E-03 ppm1 7.987 ppm2 3.552 CV 1
ASSI { 411}
(( segid " " and resid 45 and name H ))
(( segid " " and resid 44 and name HA ))
2.100 0.600 0.600 peak 411 spectrum 1 weight 0.10000E+01 volume 0.98298E-02 ppm1 8.108 ppm2 4.382 CV 1
ASSI { 412}
(( segid " " and resid 45 and name H ))
(( segid " " and resid 44 and name HB3 ))
3.600 1.600 1.600 peak 412 spectrum 1 weight 0.10000E+01 volume 0.34959E-02 ppm1 8.104 ppm2 2.197 CV 1
ASSI { 413}
(( segid " " and resid 45 and name H ))
(( segid " " and resid 45 and name HG3 ))
3.500 1.500 1.500 peak 413 spectrum 1 weight 0.10000E+01 volume 0.13995E-02 ppm1 8.108 ppm2 1.372 CV 1
ASSI { 414}
(( segid " " and resid 45 and name H ))
(( segid " " and resid 43 and name H ))
3.100 3.100 2.900 peak 414 spectrum 1 weight 0.10000E+01 volume 0.22675E-02 ppm1 8.106 ppm2 8.004 CV 1
ASSI { 416}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 46 and name HA ))
3.100 1.200 1.200 peak 416 spectrum 1 weight 0.10000E+01 volume 0.13732E-02 ppm1 7.685 ppm2 4.616 CV 1
ASSI { 417}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 45 and name HD3 ))
5.300 3.500 0.700 peak 417 spectrum 1 weight 0.10000E+01 volume 0.43900E-03 ppm1 7.686 ppm2 2.852 CV 1
ASSI { 418}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 49 and name HG2 ))
2.900 1.100 1.100 peak 418 spectrum 1 weight 0.10000E+01 volume 0.19912E-02 ppm1 7.684 ppm2 2.540 CV 1
ASSI { 419}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 49 and name HG3 ))
3.300 1.300 1.300 peak 419 spectrum 1 weight 0.10000E+01 volume 0.16021E-02 ppm1 7.686 ppm2 2.251 CV 1
ASSI { 420}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 45 and name HB2 ))
2.600 0.900 0.900 peak 420 spectrum 1 weight 0.10000E+01 volume 0.32945E-02 ppm1 7.684 ppm2 1.656 CV 1
OR { 420}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 45 and name HB3 ))
ASSI { 421}
(( segid " " and resid 46 and name H ))
( segid " " and resid 46 and name HG2%)
2.700 0.900 0.900 peak 421 spectrum 1 weight 0.10000E+01 volume 0.29060E-02 ppm1 7.685 ppm2 1.218 CV 1
ASSI { 422}
(( segid " " and resid 46 and name H ))
( segid " " and resid 50 and name HD1%)
4.100 2.100 1.900 peak 422 spectrum 1 weight 0.10000E+01 volume 0.92627E-03 ppm1 7.684 ppm2 0.902 CV 1
ASSI { 423}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 50 and name H ))
4.400 2.400 1.600 peak 423 spectrum 1 weight 0.10000E+01 volume 0.54138E-03 ppm1 7.695 ppm2 8.212 CV 1
ASSI { 424}
(( segid " " and resid 46 and name H ))
(( segid " " and resid 45 and name H ))
4.100 2.100 1.900 peak 424 spectrum 1 weight 0.10000E+01 volume 0.70307E-03 ppm1 7.688 ppm2 8.111 CV 1
ASSI { 425}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 46 and name HB ))
3.200 1.300 1.300 peak 425 spectrum 1 weight 0.10000E+01 volume 0.17991E-02 ppm1 9.010 ppm2 4.733 CV 1
ASSI { 426}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 46 and name HA ))
2.800 1.000 1.000 peak 426 spectrum 1 weight 0.10000E+01 volume 0.22887E-02 ppm1 9.010 ppm2 4.612 CV 1
ASSI { 427}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 47 and name HA ))
3.000 1.200 1.200 peak 427 spectrum 1 weight 0.10000E+01 volume 0.11291E-02 ppm1 9.013 ppm2 3.734 CV 1
ASSI { 428}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 47 and name HB3 ))
2.800 1.000 1.000 peak 428 spectrum 1 weight 0.10000E+01 volume 0.22403E-02 ppm1 9.010 ppm2 1.867 CV 1
OR { 428}
(( segid " " and resid 47 and name H ))
(( segid " " and resid 47 and name HB2 ))
ASSI { 431}
(( segid " " and resid 47 and name H ))
( segid " " and resid 37 and name HD2%)
4.200 2.200 1.800 peak 431 spectrum 1 weight 0.10000E+01 volume 0.12305E-02 ppm1 9.011 ppm2 0.857 CV 1
OR { 431}
(( segid " " and resid 47 and name H ))
( segid " " and resid 37 and name HD1%)
ASSI { 434}
(( segid " " and resid 48 and name H ))
( segid " " and resid 51 and name HD1%)
3.700 1.700 1.700 peak 434 spectrum 1 weight 0.10000E+01 volume 0.86161E-03 ppm1 8.344 ppm2 0.747 CV 1
ASSI { 435}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 46 and name HA ))
4.000 2.000 2.000 peak 435 spectrum 1 weight 0.10000E+01 volume 0.12255E-02 ppm1 8.337 ppm2 4.627 CV 1
ASSI { 436}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 48 and name HA ))
2.600 0.900 0.900 peak 436 spectrum 1 weight 0.10000E+01 volume 0.31326E-02 ppm1 8.338 ppm2 3.889 CV 1
ASSI { 437}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name HA ))
3.300 1.300 1.300 peak 437 spectrum 1 weight 0.10000E+01 volume 0.12016E-02 ppm1 8.338 ppm2 3.748 CV 1
ASSI { 441}
(( segid " " and resid 48 and name H ))
( segid " " and resid 37 and name HD2%)
4.200 2.200 1.800 peak 441 spectrum 1 weight 0.10000E+01 volume 0.89698E-03 ppm1 8.340 ppm2 0.827 CV 1
ASSI { 444}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name H ))
2.900 1.000 1.000 peak 444 spectrum 1 weight 0.10000E+01 volume 0.15342E-02 ppm1 8.336 ppm2 9.017 CV 1
ASSI { 445}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 49 and name HA ))
2.900 1.000 1.000 peak 445 spectrum 1 weight 0.10000E+01 volume 0.21935E-02 ppm1 7.714 ppm2 4.221 CV 1
ASSI { 446}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 48 and name HA ))
3.500 1.500 1.500 peak 446 spectrum 1 weight 0.10000E+01 volume 0.80076E-03 ppm1 7.715 ppm2 3.892 CV 1
ASSI { 447}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 49 and name HG2 ))
2.700 2.700 3.300 peak 447 spectrum 1 weight 0.10000E+01 volume 0.46898E-02 ppm1 7.714 ppm2 2.561 CV 1
ASSI { 448}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 49 and name HB2 ))
2.700 0.900 0.900 peak 448 spectrum 1 weight 0.10000E+01 volume 0.25051E-02 ppm1 7.714 ppm2 2.219 CV 1
OR { 448}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 451}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 48 and name HG2 ))
3.400 1.400 1.400 peak 451 spectrum 1 weight 0.10000E+01 volume 0.73400E-03 ppm1 7.713 ppm2 1.330 CV 1
ASSI { 453}
(( segid " " and resid 49 and name H ))
( segid " " and resid 50 and name HD1%)
3.900 1.900 1.900 peak 453 spectrum 1 weight 0.10000E+01 volume 0.14110E-02 ppm1 7.725 ppm2 0.898 CV 1
ASSI { 455}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 48 and name H ))
2.700 0.900 0.900 peak 455 spectrum 1 weight 0.10000E+01 volume 0.24190E-02 ppm1 7.713 ppm2 8.336 CV 1
ASSI { 457}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 50 and name HA ))
2.800 1.000 1.000 peak 457 spectrum 1 weight 0.10000E+01 volume 0.17381E-02 ppm1 8.204 ppm2 3.774 CV 1
ASSI { 458}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 49 and name HG2 ))
3.800 1.800 1.800 peak 458 spectrum 1 weight 0.10000E+01 volume 0.11849E-02 ppm1 8.205 ppm2 2.536 CV 1
ASSI { 461}
(( segid " " and resid 50 and name H ))
( segid " " and resid 17 and name HD1%)
3.600 1.700 1.700 peak 461 spectrum 1 weight 0.10000E+01 volume 0.37621E-02 ppm1 8.192 ppm2 1.052 CV 1
ASSI { 462}
(( segid " " and resid 50 and name H ))
( segid " " and resid 50 and name HD1%)
2.300 0.700 0.700 peak 462 spectrum 1 weight 0.10000E+01 volume 0.53325E-02 ppm1 8.202 ppm2 0.924 CV 1
ASSI { 463}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 49 and name H ))
2.800 1.000 1.000 peak 463 spectrum 1 weight 0.10000E+01 volume 0.22524E-02 ppm1 8.201 ppm2 7.704 CV 1
ASSI { 464}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 48 and name HA ))
3.600 1.600 1.600 peak 464 spectrum 1 weight 0.10000E+01 volume 0.10933E-02 ppm1 8.213 ppm2 3.893 CV 1
ASSI { 466}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 51 and name HA ))
2.900 1.100 1.100 peak 466 spectrum 1 weight 0.10000E+01 volume 0.15268E-02 ppm1 8.219 ppm2 2.972 CV 1
ASSI { 467}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 49 and name HG3 ))
4.300 2.300 1.700 peak 467 spectrum 1 weight 0.10000E+01 volume 0.54148E-03 ppm1 8.213 ppm2 2.269 CV 1
ASSI { 469}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 51 and name HB ))
2.300 0.700 0.700 peak 469 spectrum 1 weight 0.10000E+01 volume 0.33260E-02 ppm1 8.221 ppm2 1.605 CV 1
ASSI { 470}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 51 and name HG12))
3.300 1.400 1.400 peak 470 spectrum 1 weight 0.10000E+01 volume 0.29330E-02 ppm1 8.221 ppm2 1.531 CV 1
ASSI { 472}
(( segid " " and resid 51 and name H ))
( segid " " and resid 50 and name HG2%)
2.600 0.800 0.800 peak 472 spectrum 1 weight 0.10000E+01 volume 0.31076E-02 ppm1 8.222 ppm2 0.879 CV 1
ASSI { 474}
(( segid " " and resid 51 and name H ))
( segid " " and resid 51 and name HG2%)
3.500 1.500 1.500 peak 474 spectrum 1 weight 0.10000E+01 volume 0.27726E-02 ppm1 8.218 ppm2 0.685 CV 1
ASSI { 476}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 51 and name HG13))
3.900 1.900 1.900 peak 476 spectrum 1 weight 0.10000E+01 volume 0.83507E-03 ppm1 8.215 ppm2 0.056 CV 1
ASSI { 477}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 49 and name HA ))
3.300 1.400 1.400 peak 477 spectrum 1 weight 0.10000E+01 volume 0.13665E-02 ppm1 8.222 ppm2 4.210 CV 1
ASSI { 478}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 52 and name HA ))
2.700 0.900 0.900 peak 478 spectrum 1 weight 0.10000E+01 volume 0.36285E-02 ppm1 8.228 ppm2 4.020 CV 1
ASSI { 480}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 52 and name HB2 ))
2.000 0.500 0.500 peak 480 spectrum 1 weight 0.10000E+01 volume 0.57792E-02 ppm1 8.227 ppm2 3.234 CV 1
ASSI { 481}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 52 and name HB3 ))
3.000 1.100 1.100 peak 481 spectrum 1 weight 0.10000E+01 volume 0.62217E-02 ppm1 8.228 ppm2 3.168 CV 1
ASSI { 483}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 51 and name HB ))
2.700 0.900 0.900 peak 483 spectrum 1 weight 0.10000E+01 volume 0.28383E-02 ppm1 8.226 ppm2 1.622 CV 1
ASSI { 487}
(( segid " " and resid 52 and name H ))
( segid " " and resid 51 and name HG2%)
2.900 1.000 1.000 peak 487 spectrum 1 weight 0.10000E+01 volume 0.27738E-02 ppm1 8.228 ppm2 0.680 CV 1
ASSI { 488}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 51 and name HA ))
3.000 1.100 1.100 peak 488 spectrum 1 weight 0.10000E+01 volume 0.16900E-02 ppm1 8.230 ppm2 2.987 CV 1
ASSI { 489}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 52 and name HD2 ))
3.600 1.600 1.600 peak 489 spectrum 1 weight 0.10000E+01 volume 0.58313E-03 ppm1 8.226 ppm2 7.076 CV 1
ASSI { 492}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 52 and name HB2 ))
2.600 0.900 0.900 peak 492 spectrum 1 weight 0.10000E+01 volume 0.21550E-02 ppm1 8.138 ppm2 3.227 CV 1
ASSI { 493}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 52 and name HB3 ))
2.700 0.900 0.900 peak 493 spectrum 1 weight 0.10000E+01 volume 0.26879E-02 ppm1 8.139 ppm2 3.165 CV 1
ASSI { 494}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 53 and name HB3 ))
3.200 1.300 1.300 peak 494 spectrum 1 weight 0.10000E+01 volume 0.32442E-02 ppm1 8.139 ppm2 2.897 CV 1
ASSI { 495}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 53 and name HB2 ))
2.400 0.700 0.700 peak 495 spectrum 1 weight 0.10000E+01 volume 0.31117E-02 ppm1 8.138 ppm2 2.208 CV 1
ASSI { 497}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 56 and name HB3 ))
4.700 2.700 1.300 peak 497 spectrum 1 weight 0.10000E+01 volume 0.11441E-02 ppm1 8.145 ppm2 1.808 CV 1
ASSI { 499}
(( segid " " and resid 53 and name H ))
( segid " " and resid 55 and name HG2%)
3.700 1.700 1.700 peak 499 spectrum 1 weight 0.10000E+01 volume 0.16177E-02 ppm1 8.141 ppm2 0.814 CV 1
OR { 499}
(( segid " " and resid 53 and name H ))
( segid " " and resid 55 and name HG1%)
ASSI { 502}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 55 and name H ))
4.200 2.200 1.800 peak 502 spectrum 1 weight 0.10000E+01 volume 0.47339E-03 ppm1 8.138 ppm2 7.493 CV 1
ASSI { 505}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 54 and name HA ))
2.800 1.000 1.000 peak 505 spectrum 1 weight 0.10000E+01 volume 0.17132E-02 ppm1 8.302 ppm2 3.685 CV 1
ASSI { 506}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 51 and name HA ))
3.200 1.300 1.300 peak 506 spectrum 1 weight 0.10000E+01 volume 0.13851E-02 ppm1 8.308 ppm2 2.973 CV 1
ASSI { 508}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 54 and name HB3 ))
3.400 1.400 1.400 peak 508 spectrum 1 weight 0.10000E+01 volume 0.30268E-02 ppm1 8.305 ppm2 1.938 CV 1
ASSI { 509}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 54 and name HG ))
2.600 0.800 0.800 peak 509 spectrum 1 weight 0.10000E+01 volume 0.31275E-02 ppm1 8.306 ppm2 1.717 CV 1
ASSI { 512}
(( segid " " and resid 54 and name H ))
( segid " " and resid 54 and name HD2%)
3.200 1.300 1.300 peak 512 spectrum 1 weight 0.10000E+01 volume 0.42800E-02 ppm1 8.305 ppm2 0.419 CV 1
OR { 512}
(( segid " " and resid 54 and name H ))
( segid " " and resid 54 and name HD1%)
ASSI { 513}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 53 and name H ))
2.400 0.700 0.700 peak 513 spectrum 1 weight 0.10000E+01 volume 0.33624E-02 ppm1 8.305 ppm2 8.141 CV 1
ASSI { 514}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 55 and name H ))
2.700 0.900 0.900 peak 514 spectrum 1 weight 0.10000E+01 volume 0.18919E-02 ppm1 8.305 ppm2 7.496 CV 1
ASSI { 515}
(( segid " " and resid 55 and name H ))
( segid " " and resid 54 and name HD2%)
4.700 2.800 1.300 peak 515 spectrum 1 weight 0.10000E+01 volume 0.63624E-03 ppm1 7.504 ppm2 0.380 CV 1
ASSI { 517}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 56 and name HA ))
4.300 2.300 1.700 peak 517 spectrum 1 weight 0.10000E+01 volume 0.87283E-03 ppm1 7.505 ppm2 3.864 CV 1
ASSI { 519}
(( segid " " and resid 55 and name H ))
( segid " " and resid 55 and name HG1%)
2.200 0.600 0.600 peak 519 spectrum 1 weight 0.10000E+01 volume 0.56225E-02 ppm1 7.499 ppm2 0.785 CV 1
OR { 519}
(( segid " " and resid 55 and name H ))
( segid " " and resid 55 and name HG2%)
ASSI { 521}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 56 and name H ))
2.600 0.800 0.800 peak 521 spectrum 1 weight 0.10000E+01 volume 0.17626E-02 ppm1 7.496 ppm2 8.084 CV 1
ASSI { 523}
(( segid " " and resid 56 and name H ))
(( segid " " and resid 56 and name HA ))
2.800 1.000 1.000 peak 523 spectrum 1 weight 0.10000E+01 volume 0.27417E-02 ppm1 8.082 ppm2 3.825 CV 1
ASSI { 525}
(( segid " " and resid 56 and name H ))
(( segid " " and resid 56 and name HB3 ))
3.200 1.300 1.300 peak 525 spectrum 1 weight 0.10000E+01 volume 0.53333E-02 ppm1 8.091 ppm2 1.849 CV 1
ASSI { 526}
(( segid " " and resid 56 and name H ))
( segid " " and resid 55 and name HG2%)
2.800 1.000 1.000 peak 526 spectrum 1 weight 0.10000E+01 volume 0.36073E-02 ppm1 8.087 ppm2 0.818 CV 1
OR { 526}
(( segid " " and resid 56 and name H ))
( segid " " and resid 55 and name HG1%)
ASSI { 529}
(( segid " " and resid 56 and name HE22))
(( segid " " and resid 56 and name HG2 ))
3.800 1.800 1.800 peak 529 spectrum 1 weight 0.10000E+01 volume 0.15996E-02 ppm1 6.848 ppm2 2.209 CV 1
ASSI { 530}
(( segid " " and resid 56 and name HE22))
(( segid " " and resid 56 and name HG3 ))
3.600 1.600 1.600 peak 530 spectrum 1 weight 0.10000E+01 volume 0.19486E-02 ppm1 6.852 ppm2 2.129 CV 1
ASSI { 531}
(( segid " " and resid 56 and name HE22))
(( segid " " and resid 53 and name HE1 ))
3.500 1.500 1.500 peak 531 spectrum 1 weight 0.10000E+01 volume 0.87643E-03 ppm1 6.850 ppm2 7.953 CV 1
ASSI { 532}
(( segid " " and resid 56 and name HE22))
(( segid " " and resid 52 and name HE1 ))
2.500 2.500 3.500 peak 532 spectrum 1 weight 0.10000E+01 volume 0.67831E-03 ppm1 6.851 ppm2 7.843 CV 1
ASSI { 533}
(( segid " " and resid 56 and name HE22))
(( segid " " and resid 56 and name HE21))
1.300 0.200 0.900 peak 533 spectrum 1 weight 0.10000E+01 volume 0.45794E-01 ppm1 6.851 ppm2 7.407 CV 1
ASSI { 534}
(( segid " " and resid 56 and name HE21))
(( segid " " and resid 56 and name HG2 ))
3.000 1.100 1.100 peak 534 spectrum 1 weight 0.10000E+01 volume 0.23873E-02 ppm1 7.404 ppm2 2.204 CV 1
ASSI { 535}
(( segid " " and resid 56 and name HE21))
(( segid " " and resid 56 and name HG3 ))
2.200 0.600 0.600 peak 535 spectrum 1 weight 0.10000E+01 volume 0.34099E-02 ppm1 7.406 ppm2 2.128 CV 1
ASSI { 537}
(( segid " " and resid 56 and name HE21))
(( segid " " and resid 53 and name HE1 ))
4.400 2.400 1.600 peak 537 spectrum 1 weight 0.10000E+01 volume 0.80988E-03 ppm1 7.399 ppm2 7.965 CV 1
ASSI { 538}
(( segid " " and resid 56 and name HE21))
(( segid " " and resid 52 and name HE1 ))
4.400 2.400 1.600 peak 538 spectrum 1 weight 0.10000E+01 volume 0.78198E-03 ppm1 7.406 ppm2 7.836 CV 1
ASSI { 540}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 56 and name HA ))
3.100 1.200 1.200 peak 540 spectrum 1 weight 0.10000E+01 volume 0.20676E-02 ppm1 7.869 ppm2 3.832 CV 1
ASSI { 542}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 57 and name HB2 ))
2.600 0.800 0.800 peak 542 spectrum 1 weight 0.10000E+01 volume 0.52790E-02 ppm1 7.870 ppm2 2.152 CV 1
OR { 542}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 57 and name HG3 ))
ASSI { 543}
(( segid " " and resid 57 and name H ))
( segid " " and resid 57 and name HE% )
3.200 1.300 1.300 peak 543 spectrum 1 weight 0.10000E+01 volume 0.41582E-02 ppm1 7.869 ppm2 1.989 CV 1
OR { 543}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 57 and name HG2 ))
ASSI { 545}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 59 and name HG ))
4.200 2.200 1.800 peak 545 spectrum 1 weight 0.10000E+01 volume 0.96538E-03 ppm1 7.866 ppm2 1.474 CV 1
ASSI { 547}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 59 and name H ))
3.500 1.500 1.500 peak 547 spectrum 1 weight 0.10000E+01 volume 0.73873E-03 ppm1 7.869 ppm2 7.670 CV 1
ASSI { 548}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 55 and name H ))
4.200 2.300 1.800 peak 548 spectrum 1 weight 0.10000E+01 volume 0.46417E-03 ppm1 7.876 ppm2 7.494 CV 1
ASSI { 549}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 56 and name H ))
2.500 0.800 0.800 peak 549 spectrum 1 weight 0.10000E+01 volume 0.27415E-02 ppm1 7.870 ppm2 8.079 CV 1
ASSI { 550}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 58 and name HA3 ))
2.800 1.000 1.000 peak 550 spectrum 1 weight 0.10000E+01 volume 0.55122E-02 ppm1 7.925 ppm2 4.077 CV 1
ASSI { 552}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 54 and name HA ))
3.900 1.900 1.900 peak 552 spectrum 1 weight 0.10000E+01 volume 0.99701E-03 ppm1 7.925 ppm2 3.715 CV 1
ASSI { 553}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name HB2 ))
3.900 1.900 1.900 peak 553 spectrum 1 weight 0.10000E+01 volume 0.12567E-02 ppm1 7.925 ppm2 2.135 CV 1
OR { 553}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name HG3 ))
ASSI { 555}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 59 and name HB3 ))
4.900 3.100 1.100 peak 555 spectrum 1 weight 0.10000E+01 volume 0.92872E-03 ppm1 7.927 ppm2 1.340 CV 1
ASSI { 557}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 59 and name H ))
2.600 0.900 0.900 peak 557 spectrum 1 weight 0.10000E+01 volume 0.27982E-02 ppm1 7.924 ppm2 7.670 CV 1
ASSI { 558}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 60 and name H ))
3.600 1.600 1.600 peak 558 spectrum 1 weight 0.10000E+01 volume 0.99275E-03 ppm1 7.926 ppm2 7.071 CV 1
ASSI { 559}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 56 and name HA ))
2.300 2.300 3.700 peak 559 spectrum 1 weight 0.10000E+01 volume 0.10937E-02 ppm1 7.674 ppm2 3.834 CV 1
ASSI { 560}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 59 and name HA ))
2.700 0.900 0.900 peak 560 spectrum 1 weight 0.10000E+01 volume 0.28551E-02 ppm1 7.669 ppm2 4.201 CV 1
ASSI { 561}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 58 and name HA3 ))
2.900 1.000 1.000 peak 561 spectrum 1 weight 0.10000E+01 volume 0.28608E-02 ppm1 7.670 ppm2 4.083 CV 1
ASSI { 563}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 57 and name HG3 ))
4.000 2.000 2.000 peak 563 spectrum 1 weight 0.10000E+01 volume 0.10822E-02 ppm1 7.670 ppm2 2.146 CV 1
OR { 563}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 57 and name HB2 ))
ASSI { 564}
(( segid " " and resid 59 and name H ))
( segid " " and resid 57 and name HE% )
3.800 1.800 1.800 peak 564 spectrum 1 weight 0.10000E+01 volume 0.88065E-03 ppm1 7.668 ppm2 1.989 CV 1
OR { 564}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 57 and name HG2 ))
ASSI { 565}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 57 and name HB3 ))
2.900 2.900 3.100 peak 565 spectrum 1 weight 0.10000E+01 volume 0.13602E-02 ppm1 7.670 ppm2 1.696 CV 1
ASSI { 566}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 59 and name HG ))
2.700 0.900 0.900 peak 566 spectrum 1 weight 0.10000E+01 volume 0.33243E-02 ppm1 7.669 ppm2 1.462 CV 1
ASSI { 567}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 59 and name HB3 ))
3.200 1.300 1.300 peak 567 spectrum 1 weight 0.10000E+01 volume 0.42890E-02 ppm1 7.668 ppm2 1.369 CV 1
ASSI { 568}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 59 and name HB2 ))
2.200 0.600 0.600 peak 568 spectrum 1 weight 0.10000E+01 volume 0.36409E-02 ppm1 7.669 ppm2 1.267 CV 1
ASSI { 569}
(( segid " " and resid 59 and name H ))
( segid " " and resid 59 and name HD1%)
3.600 1.600 1.600 peak 569 spectrum 1 weight 0.10000E+01 volume 0.34435E-02 ppm1 7.669 ppm2 0.837 CV 1
ASSI { 570}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 60 and name H ))
2.300 0.700 0.700 peak 570 spectrum 1 weight 0.10000E+01 volume 0.53985E-02 ppm1 7.668 ppm2 7.069 CV 1
ASSI { 572}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 59 and name HA ))
3.200 1.200 1.200 peak 572 spectrum 1 weight 0.10000E+01 volume 0.13132E-02 ppm1 7.071 ppm2 4.197 CV 1
ASSI { 573}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 60 and name HA ))
2.900 1.000 1.000 peak 573 spectrum 1 weight 0.10000E+01 volume 0.24084E-02 ppm1 7.067 ppm2 4.539 CV 1
ASSI { 574}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 58 and name HA3 ))
4.100 2.100 1.900 peak 574 spectrum 1 weight 0.10000E+01 volume 0.10368E-02 ppm1 7.067 ppm2 4.069 CV 1
ASSI { 575}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 55 and name HA ))
2.500 0.800 0.800 peak 575 spectrum 1 weight 0.10000E+01 volume 0.34180E-02 ppm1 7.068 ppm2 3.970 CV 1
ASSI { 577}
(( segid " " and resid 60 and name H ))
( segid " " and resid 55 and name HG1%)
3.500 1.600 1.600 peak 577 spectrum 1 weight 0.10000E+01 volume 0.26483E-02 ppm1 7.068 ppm2 0.807 CV 1
OR { 577}
(( segid " " and resid 60 and name H ))
( segid " " and resid 55 and name HG2%)
ASSI { 578}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 61 and name H ))
4.100 2.100 1.900 peak 578 spectrum 1 weight 0.10000E+01 volume 0.91244E-03 ppm1 7.067 ppm2 8.645 CV 1
ASSI { 581}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 55 and name H ))
4.300 2.300 1.700 peak 581 spectrum 1 weight 0.10000E+01 volume 0.42420E-03 ppm1 7.073 ppm2 7.498 CV 1
ASSI { 583}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 61 and name HB3 ))
2.500 0.800 0.800 peak 583 spectrum 1 weight 0.10000E+01 volume 0.53603E-02 ppm1 8.647 ppm2 2.710 CV 1
OR { 583}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 61 and name HB2 ))
ASSI { 584}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 65 and name HB3 ))
3.700 1.700 1.700 peak 584 spectrum 1 weight 0.10000E+01 volume 0.11560E-02 ppm1 8.653 ppm2 2.391 CV 1
ASSI { 589}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 62 and name HB2 ))
2.700 2.700 3.300 peak 589 spectrum 1 weight 0.10000E+01 volume 0.23462E-02 ppm1 7.869 ppm2 4.001 CV 1
ASSI { 590}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 62 and name HB3 ))
3.200 1.300 1.300 peak 590 spectrum 1 weight 0.10000E+01 volume 0.24800E-02 ppm1 7.867 ppm2 3.771 CV 1
ASSI { 591}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 61 and name HB2 ))
2.600 0.900 0.900 peak 591 spectrum 1 weight 0.10000E+01 volume 0.45107E-02 ppm1 7.868 ppm2 2.704 CV 1
OR { 591}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 61 and name HB3 ))
ASSI { 592}
(( segid " " and resid 62 and name H ))
( segid " " and resid 55 and name HG1%)
2.900 1.100 1.100 peak 592 spectrum 1 weight 0.10000E+01 volume 0.26791E-02 ppm1 7.867 ppm2 0.796 CV 1
OR { 592}
(( segid " " and resid 62 and name H ))
( segid " " and resid 55 and name HG2%)
ASSI { 593}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 65 and name HB3 ))
3.700 1.700 1.700 peak 593 spectrum 1 weight 0.10000E+01 volume 0.11969E-02 ppm1 7.865 ppm2 2.408 CV 1
ASSI { 595}
(( segid " " and resid 62 and name H ))
( segid " " and resid 66 and name HE% )
4.100 2.100 1.900 peak 595 spectrum 1 weight 0.10000E+01 volume 0.38783E-03 ppm1 7.865 ppm2 7.075 CV 1
ASSI { 596}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 65 and name H ))
3.300 1.400 1.400 peak 596 spectrum 1 weight 0.10000E+01 volume 0.80105E-03 ppm1 7.867 ppm2 7.693 CV 1
ASSI { 597}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 61 and name H ))
2.300 0.700 0.700 peak 597 spectrum 1 weight 0.10000E+01 volume 0.65823E-02 ppm1 7.867 ppm2 8.649 CV 1
ASSI { 598}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 64 and name H ))
4.200 2.200 1.800 peak 598 spectrum 1 weight 0.10000E+01 volume 0.39089E-03 ppm1 7.866 ppm2 8.284 CV 1
ASSI { 600}
(( segid " " and resid 63 and name H ))
(( segid " " and resid 63 and name HB ))
2.600 0.800 0.800 peak 600 spectrum 1 weight 0.10000E+01 volume 0.33810E-02 ppm1 8.669 ppm2 2.222 CV 1
ASSI { 601}
(( segid " " and resid 63 and name H ))
( segid " " and resid 63 and name HG1%)
2.200 0.600 0.600 peak 601 spectrum 1 weight 0.10000E+01 volume 0.69764E-02 ppm1 8.668 ppm2 0.950 CV 1
ASSI { 603}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 64 and name HA ))
2.400 0.700 0.700 peak 603 spectrum 1 weight 0.10000E+01 volume 0.49443E-02 ppm1 8.291 ppm2 4.108 CV 1
ASSI { 606}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 64 and name HB2 ))
2.200 0.600 0.600 peak 606 spectrum 1 weight 0.10000E+01 volume 0.59058E-02 ppm1 8.291 ppm2 1.808 CV 1
ASSI { 607}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 64 and name HB3 ))
2.900 1.100 1.100 peak 607 spectrum 1 weight 0.10000E+01 volume 0.72149E-02 ppm1 8.291 ppm2 1.751 CV 1
ASSI { 608}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 64 and name HG3 ))
2.500 0.800 0.800 peak 608 spectrum 1 weight 0.10000E+01 volume 0.52381E-02 ppm1 8.292 ppm2 1.443 CV 1
OR { 608}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 64 and name HG2 ))
ASSI { 610}
(( segid " " and resid 64 and name H ))
( segid " " and resid 51 and name HG2%)
4.400 2.400 1.600 peak 610 spectrum 1 weight 0.10000E+01 volume 0.69214E-03 ppm1 8.288 ppm2 0.682 CV 1
ASSI { 611}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 62 and name HA ))
3.800 1.800 1.800 peak 611 spectrum 1 weight 0.10000E+01 volume 0.99583E-03 ppm1 8.288 ppm2 4.584 CV 1
ASSI { 612}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 62 and name HB3 ))
3.000 1.100 1.100 peak 612 spectrum 1 weight 0.10000E+01 volume 0.13132E-02 ppm1 8.291 ppm2 3.771 CV 1
ASSI { 614}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 65 and name HB3 ))
4.000 2.000 2.000 peak 614 spectrum 1 weight 0.10000E+01 volume 0.13675E-02 ppm1 8.292 ppm2 2.399 CV 1
ASSI { 619}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 63 and name H ))
2.500 0.800 0.800 peak 619 spectrum 1 weight 0.10000E+01 volume 0.34304E-02 ppm1 8.291 ppm2 8.669 CV 1
ASSI { 621}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 65 and name HA ))
2.500 0.800 0.800 peak 621 spectrum 1 weight 0.10000E+01 volume 0.55182E-02 ppm1 7.701 ppm2 4.419 CV 1
ASSI { 622}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 64 and name HA ))
2.800 1.000 1.000 peak 622 spectrum 1 weight 0.10000E+01 volume 0.35513E-02 ppm1 7.701 ppm2 4.108 CV 1
ASSI { 623}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 62 and name HB3 ))
3.900 1.900 1.900 peak 623 spectrum 1 weight 0.10000E+01 volume 0.10211E-02 ppm1 7.701 ppm2 3.766 CV 1
ASSI { 624}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 65 and name HB3 ))
2.300 0.700 0.700 peak 624 spectrum 1 weight 0.10000E+01 volume 0.91271E-02 ppm1 7.701 ppm2 2.404 CV 1
ASSI { 625}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 64 and name HB2 ))
2.600 0.800 0.800 peak 625 spectrum 1 weight 0.10000E+01 volume 0.26200E-02 ppm1 7.702 ppm2 1.813 CV 1
ASSI { 626}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 64 and name HB3 ))
3.200 1.300 1.300 peak 626 spectrum 1 weight 0.10000E+01 volume 0.30263E-02 ppm1 7.702 ppm2 1.751 CV 1
ASSI { 627}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 66 and name H ))
2.200 0.600 0.600 peak 627 spectrum 1 weight 0.10000E+01 volume 0.52201E-02 ppm1 7.700 ppm2 7.521 CV 1
ASSI { 628}
(( segid " " and resid 65 and name H ))
( segid " " and resid 66 and name HD% )
3.500 1.600 1.600 peak 628 spectrum 1 weight 0.10000E+01 volume 0.10504E-02 ppm1 7.700 ppm2 7.303 CV 1
ASSI { 630}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 64 and name H ))
2.400 0.700 0.700 peak 630 spectrum 1 weight 0.10000E+01 volume 0.43909E-02 ppm1 7.701 ppm2 8.292 CV 1
ASSI { 631}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 66 and name HA ))
2.700 0.900 0.900 peak 631 spectrum 1 weight 0.10000E+01 volume 0.26847E-02 ppm1 7.518 ppm2 4.584 CV 1
ASSI { 633}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 64 and name HA ))
3.800 1.800 1.800 peak 633 spectrum 1 weight 0.10000E+01 volume 0.63325E-03 ppm1 7.524 ppm2 4.114 CV 1
ASSI { 634}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 63 and name HA ))
4.200 2.300 1.800 peak 634 spectrum 1 weight 0.10000E+01 volume 0.41093E-03 ppm1 7.523 ppm2 3.959 CV 1
ASSI { 635}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 66 and name HB3 ))
3.700 1.700 1.700 peak 635 spectrum 1 weight 0.10000E+01 volume 0.18367E-02 ppm1 7.518 ppm2 3.371 CV 1
ASSI { 636}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 66 and name HB2 ))
2.900 1.000 1.000 peak 636 spectrum 1 weight 0.10000E+01 volume 0.24469E-02 ppm1 7.518 ppm2 2.897 CV 1
ASSI { 638}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 67 and name HB2 ))
4.600 2.600 1.400 peak 638 spectrum 1 weight 0.10000E+01 volume 0.45446E-03 ppm1 7.525 ppm2 2.076 CV 1
ASSI { 640}
(( segid " " and resid 66 and name H ))
( segid " " and resid 66 and name HD% )
2.100 0.500 0.500 peak 640 spectrum 1 weight 0.10000E+01 volume 0.34791E-02 ppm1 7.520 ppm2 7.299 CV 1
ASSI { 641}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 64 and name H ))
4.100 2.100 1.900 peak 641 spectrum 1 weight 0.10000E+01 volume 0.37086E-03 ppm1 7.520 ppm2 8.292 CV 1
ASSI { 644}
(( segid " " and resid 66 and name H ))
( segid " " and resid 66 and name HE% )
3.800 1.800 1.800 peak 644 spectrum 1 weight 0.10000E+01 volume 0.11436E-02 ppm1 7.516 ppm2 7.106 CV 1
ASSI { 645}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 64 and name HA ))
3.000 1.100 1.100 peak 645 spectrum 1 weight 0.10000E+01 volume 0.10414E-02 ppm1 7.802 ppm2 4.109 CV 1
ASSI { 647}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 67 and name HB3 ))
2.900 1.100 1.100 peak 647 spectrum 1 weight 0.10000E+01 volume 0.52079E-02 ppm1 7.802 ppm2 2.161 CV 1
ASSI { 648}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 64 and name HB3 ))
4.000 2.000 2.000 peak 648 spectrum 1 weight 0.10000E+01 volume 0.85063E-03 ppm1 7.799 ppm2 1.739 CV 1
ASSI { 650}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 66 and name HA ))
2.800 1.000 1.000 peak 650 spectrum 1 weight 0.10000E+01 volume 0.45317E-02 ppm1 7.802 ppm2 4.582 CV 1
ASSI { 651}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 66 and name HB3 ))
4.200 2.200 1.800 peak 651 spectrum 1 weight 0.10000E+01 volume 0.13065E-02 ppm1 7.804 ppm2 3.369 CV 1
ASSI { 652}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 66 and name HB2 ))
3.000 1.200 1.200 peak 652 spectrum 1 weight 0.10000E+01 volume 0.15181E-02 ppm1 7.801 ppm2 2.897 CV 1
ASSI { 654}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 66 and name H ))
1.800 0.400 0.400 peak 654 spectrum 1 weight 0.10000E+01 volume 0.66731E-02 ppm1 7.803 ppm2 7.522 CV 1
ASSI { 655}
(( segid " " and resid 67 and name H ))
( segid " " and resid 66 and name HD% )
3.400 1.500 1.500 peak 655 spectrum 1 weight 0.10000E+01 volume 0.14478E-02 ppm1 7.803 ppm2 7.300 CV 1
ASSI { 656}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 68 and name H ))
3.500 1.600 1.600 peak 656 spectrum 1 weight 0.10000E+01 volume 0.14113E-02 ppm1 7.803 ppm2 8.365 CV 1
ASSI { 657}
(( segid " " and resid 67 and name HE22))
(( segid " " and resid 67 and name HG3 ))
3.600 1.600 1.600 peak 657 spectrum 1 weight 0.10000E+01 volume 0.21984E-02 ppm1 6.951 ppm2 2.421 CV 1
OR { 657}
(( segid " " and resid 67 and name HE22))
(( segid " " and resid 67 and name HG2 ))
ASSI { 658}
(( segid " " and resid 67 and name HE22))
(( segid " " and resid 67 and name HB3 ))
3.900 1.900 1.900 peak 658 spectrum 1 weight 0.10000E+01 volume 0.99650E-03 ppm1 6.952 ppm2 2.201 CV 1
ASSI { 660}
(( segid " " and resid 67 and name HE22))
(( segid " " and resid 67 and name HE21))
1.400 0.200 0.800 peak 660 spectrum 1 weight 0.10000E+01 volume 0.47020E-01 ppm1 6.951 ppm2 7.572 CV 1
ASSI { 661}
(( segid " " and resid 67 and name HE21))
(( segid " " and resid 67 and name HA ))
4.500 2.600 1.500 peak 661 spectrum 1 weight 0.10000E+01 volume 0.55326E-03 ppm1 7.572 ppm2 4.410 CV 1
ASSI { 662}
(( segid " " and resid 67 and name HE21))
(( segid " " and resid 67 and name HG3 ))
2.300 0.700 0.700 peak 662 spectrum 1 weight 0.10000E+01 volume 0.48142E-02 ppm1 7.573 ppm2 2.420 CV 1
OR { 662}
(( segid " " and resid 67 and name HE21))
(( segid " " and resid 67 and name HG2 ))
ASSI { 663}
(( segid " " and resid 67 and name HE21))
(( segid " " and resid 67 and name HB3 ))
3.800 1.900 1.900 peak 663 spectrum 1 weight 0.10000E+01 volume 0.98800E-03 ppm1 7.575 ppm2 2.163 CV 1
ASSI { 664}
(( segid " " and resid 67 and name HE21))
( segid " " and resid 33 and name HG1%)
3.300 1.300 1.300 peak 664 spectrum 1 weight 0.10000E+01 volume 0.73479E-03 ppm1 7.572 ppm2 0.951 CV 1
ASSI { 665}
(( segid " " and resid 67 and name HE21))
( segid " " and resid 37 and name HD2%)
4.000 2.000 2.000 peak 665 spectrum 1 weight 0.10000E+01 volume 0.46034E-03 ppm1 7.577 ppm2 0.875 CV 1
ASSI { 667}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 67 and name HG2 ))
4.600 2.700 1.400 peak 667 spectrum 1 weight 0.10000E+01 volume 0.10203E-02 ppm1 8.355 ppm2 2.419 CV 1
OR { 667}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 67 and name HG3 ))
ASSI { 669}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 67 and name HB2 ))
2.800 1.000 1.000 peak 669 spectrum 1 weight 0.10000E+01 volume 0.13200E-02 ppm1 8.364 ppm2 2.063 CV 1
ASSI { 670}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 64 and name HB3 ))
3.300 3.300 2.700 peak 670 spectrum 1 weight 0.10000E+01 volume 0.26684E-02 ppm1 8.362 ppm2 1.722 CV 1
ASSI { 671}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 67 and name HA ))
2.700 0.900 0.900 peak 671 spectrum 1 weight 0.10000E+01 volume 0.62055E-02 ppm1 8.361 ppm2 4.396 CV 1
ASSI { 672}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 67 and name HB3 ))
2.700 0.900 0.900 peak 672 spectrum 1 weight 0.10000E+01 volume 0.14967E-02 ppm1 8.358 ppm2 2.164 CV 1
ASSI { 673}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HB2 ))
2.600 0.900 0.900 peak 673 spectrum 1 weight 0.10000E+01 volume 0.37670E-02 ppm1 8.361 ppm2 1.820 CV 1
OR { 673}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HB3 ))
ASSI { 675}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 70 and name H ))
4.100 2.100 1.900 peak 675 spectrum 1 weight 0.10000E+01 volume 0.50872E-03 ppm1 8.359 ppm2 8.550 CV 1
ASSI { 676}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 69 and name HA ))
2.800 1.000 1.000 peak 676 spectrum 1 weight 0.10000E+01 volume 0.22174E-02 ppm1 8.548 ppm2 4.400 CV 1
ASSI { 677}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 70 and name HA3 ))
3.000 1.100 1.100 peak 677 spectrum 1 weight 0.10000E+01 volume 0.20548E-02 ppm1 8.548 ppm2 4.024 CV 1
OR { 677}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 70 and name HA2 ))
ASSI { 678}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 68 and name HB3 ))
2.600 2.600 3.400 peak 678 spectrum 1 weight 0.10000E+01 volume 0.60845E-03 ppm1 8.541 ppm2 1.885 CV 1
OR { 678}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 68 and name HB2 ))
ASSI { 679}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 69 and name HB3 ))
4.100 2.100 1.900 peak 679 spectrum 1 weight 0.10000E+01 volume 0.61027E-03 ppm1 8.545 ppm2 1.791 CV 1
OR { 679}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 69 and name HB2 ))
ASSI { 680}
(( segid " " and resid 71 and name H ))
(( segid " " and resid 71 and name HA ))
2.900 1.100 1.100 peak 680 spectrum 1 weight 0.10000E+01 volume 0.17359E-02 ppm1 8.100 ppm2 4.324 CV 1
ASSI { 682}
(( segid " " and resid 71 and name H ))
(( segid " " and resid 70 and name HA2 ))
2.700 0.900 0.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.41602E-02 ppm1 8.098 ppm2 4.020 CV 1
OR { 682}
(( segid " " and resid 71 and name H ))
(( segid " " and resid 70 and name HA3 ))
ASSI { 683}
(( segid " " and resid 71 and name H ))
( segid " " and resid 71 and name HG2%)
3.400 1.500 1.500 peak 683 spectrum 1 weight 0.10000E+01 volume 0.10058E-02 ppm1 8.096 ppm2 1.172 CV 1
ASSI { 684}
(( segid " " and resid 71 and name H ))
(( segid " " and resid 70 and name H ))
5.000 3.200 1.000 peak 684 spectrum 1 weight 0.10000E+01 volume 0.26066E-03 ppm1 8.097 ppm2 8.551 CV 1
ASSI { 685}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 73 and name HA ))
2.700 0.900 0.900 peak 685 spectrum 1 weight 0.10000E+01 volume 0.23717E-02 ppm1 8.167 ppm2 4.141 CV 1
ASSI { 687}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 73 and name HG13))
2.800 1.000 1.000 peak 687 spectrum 1 weight 0.10000E+01 volume 0.19981E-02 ppm1 8.166 ppm2 1.399 CV 1
ASSI { 688}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 72 and name HA ))
2.300 0.600 0.600 peak 688 spectrum 1 weight 0.10000E+01 volume 0.64253E-02 ppm1 8.167 ppm2 4.689 CV 1
ASSI { 689}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 72 and name HB3 ))
3.800 1.800 1.800 peak 689 spectrum 1 weight 0.10000E+01 volume 0.21551E-02 ppm1 8.168 ppm2 3.141 CV 1
ASSI { 690}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 73 and name HB ))
2.600 0.800 0.800 peak 690 spectrum 1 weight 0.10000E+01 volume 0.45032E-02 ppm1 8.166 ppm2 1.777 CV 1
ASSI { 691}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 73 and name HG12))
3.000 1.100 1.100 peak 691 spectrum 1 weight 0.10000E+01 volume 0.25687E-02 ppm1 8.167 ppm2 1.137 CV 1
ASSI { 692}
(( segid " " and resid 73 and name H ))
( segid " " and resid 73 and name HG2%)
3.500 1.600 1.600 peak 692 spectrum 1 weight 0.10000E+01 volume 0.32410E-02 ppm1 8.168 ppm2 0.832 CV 1
OR { 692}
(( segid " " and resid 73 and name H ))
( segid " " and resid 73 and name HD1%)
ASSI { 693}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 72 and name HE1 ))
3.700 1.700 1.700 peak 693 spectrum 1 weight 0.10000E+01 volume 0.13218E-02 ppm1 8.165 ppm2 7.986 CV 1
ASSI { 694}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 74 and name H ))
3.500 1.500 1.500 peak 694 spectrum 1 weight 0.10000E+01 volume 0.14074E-02 ppm1 8.165 ppm2 8.384 CV 1
ASSI { 696}
(( segid " " and resid 74 and name H ))
(( segid " " and resid 74 and name HB ))
3.300 1.300 1.300 peak 696 spectrum 1 weight 0.10000E+01 volume 0.12272E-02 ppm1 8.400 ppm2 2.025 CV 1
ASSI { 700}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 75 and name HA ))
3.200 1.300 1.300 peak 700 spectrum 1 weight 0.10000E+01 volume 0.93035E-03 ppm1 8.389 ppm2 4.455 CV 1
ASSI { 701}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 74 and name HA ))
2.400 0.700 0.700 peak 701 spectrum 1 weight 0.10000E+01 volume 0.43557E-02 ppm1 8.394 ppm2 4.097 CV 1
ASSI { 702}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 74 and name HB ))
3.900 1.900 1.900 peak 702 spectrum 1 weight 0.10000E+01 volume 0.64964E-03 ppm1 8.399 ppm2 2.014 CV 1
ASSI { 703}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 75 and name HG ))
2.600 0.900 0.900 peak 703 spectrum 1 weight 0.10000E+01 volume 0.28873E-02 ppm1 8.390 ppm2 1.661 CV 1
OR { 703}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 75 and name HB3 ))
ASSI { 704}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 75 and name HG ))
2.500 0.800 0.800 peak 704 spectrum 1 weight 0.10000E+01 volume 0.34769E-02 ppm1 8.393 ppm2 1.574 CV 1
OR { 704}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 75 and name HB2 ))
ASSI { 707}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 76 and name HA ))
3.900 1.900 1.900 peak 707 spectrum 1 weight 0.10000E+01 volume 0.99360E-03 ppm1 8.403 ppm2 4.953 CV 1
ASSI { 708}
(( segid " " and resid 75 and name H ))
(( segid " " and resid 76 and name H ))
4.100 2.100 1.900 peak 708 spectrum 1 weight 0.10000E+01 volume 0.11911E-02 ppm1 8.389 ppm2 8.664 CV 1
ASSI { 709}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 75 and name HA ))
2.500 0.800 0.800 peak 709 spectrum 1 weight 0.10000E+01 volume 0.40893E-02 ppm1 8.661 ppm2 4.464 CV 1
ASSI { 711}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 75 and name HB3 ))
3.700 1.700 1.700 peak 711 spectrum 1 weight 0.10000E+01 volume 0.24693E-02 ppm1 8.658 ppm2 1.661 CV 1
OR { 711}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 75 and name HG ))
ASSI { 712}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 75 and name HB2 ))
3.800 1.800 1.800 peak 712 spectrum 1 weight 0.10000E+01 volume 0.24739E-02 ppm1 8.660 ppm2 1.573 CV 1
OR { 712}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 75 and name HG ))
ASSI { 714}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 81 and name HA ))
3.200 1.300 1.300 peak 714 spectrum 1 weight 0.10000E+01 volume 0.91348E-03 ppm1 8.650 ppm2 3.936 CV 1
ASSI { 719}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 76 and name HA ))
3.200 1.300 1.300 peak 719 spectrum 1 weight 0.10000E+01 volume 0.10838E-02 ppm1 8.658 ppm2 4.943 CV 1
ASSI { 723}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 114 and name HG13))
4.500 2.500 1.500 peak 723 spectrum 1 weight 0.10000E+01 volume 0.59328E-03 ppm1 10.470 ppm2 1.857 CV 1
ASSI { 728}
(( segid " " and resid 76 and name HE1 ))
( segid " " and resid 107 and name HB% )
3.600 1.600 1.600 peak 728 spectrum 1 weight 0.10000E+01 volume 0.73748E-03 ppm1 10.468 ppm2 1.162 CV 1
ASSI { 729}
(( segid " " and resid 76 and name HE1 ))
( segid " " and resid 74 and name HG1%)
2.900 1.100 1.100 peak 729 spectrum 1 weight 0.10000E+01 volume 0.30567E-02 ppm1 10.466 ppm2 0.879 CV 1
OR { 729}
(( segid " " and resid 76 and name HE1 ))
( segid " " and resid 74 and name HG2%)
ASSI { 731}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 80 and name HE21))
3.400 3.400 2.600 peak 731 spectrum 1 weight 0.10000E+01 volume 0.10947E-02 ppm1 10.464 ppm2 7.514 CV 1
ASSI { 732}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 76 and name HD1 ))
2.600 0.800 0.800 peak 732 spectrum 1 weight 0.10000E+01 volume 0.61930E-02 ppm1 10.467 ppm2 7.366 CV 1
ASSI { 733}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 76 and name HZ2 ))
2.900 1.000 1.000 peak 733 spectrum 1 weight 0.10000E+01 volume 0.25557E-02 ppm1 10.469 ppm2 7.109 CV 1
ASSI { 734}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 76 and name HH2 ))
4.600 2.700 1.400 peak 734 spectrum 1 weight 0.10000E+01 volume 0.57337E-03 ppm1 10.475 ppm2 6.903 CV 1
ASSI { 735}
(( segid " " and resid 77 and name H ))
(( segid " " and resid 77 and name HA ))
3.400 1.400 1.400 peak 735 spectrum 1 weight 0.10000E+01 volume 0.80558E-03 ppm1 8.653 ppm2 4.669 CV 1
ASSI { 736}
(( segid " " and resid 77 and name H ))
(( segid " " and resid 76 and name HB2 ))
4.100 2.100 1.900 peak 736 spectrum 1 weight 0.10000E+01 volume 0.60149E-03 ppm1 8.665 ppm2 3.164 CV 1
ASSI { 737}
(( segid " " and resid 77 and name H ))
(( segid " " and resid 80 and name HG3 ))
4.000 2.000 2.000 peak 737 spectrum 1 weight 0.10000E+01 volume 0.71859E-03 ppm1 8.659 ppm2 2.737 CV 1
OR { 737}
(( segid " " and resid 77 and name H ))
(( segid " " and resid 80 and name HG2 ))
ASSI { 738}
(( segid " " and resid 77 and name H ))
(( segid " " and resid 80 and name HB3 ))
3.300 1.300 1.300 peak 738 spectrum 1 weight 0.10000E+01 volume 0.70681E-03 ppm1 8.651 ppm2 2.554 CV 1
ASSI { 739}
(( segid " " and resid 77 and name H ))
(( segid " " and resid 80 and name HB2 ))
4.100 2.100 1.900 peak 739 spectrum 1 weight 0.10000E+01 volume 0.53332E-03 ppm1 8.651 ppm2 2.408 CV 1
ASSI { 740}
(( segid " " and resid 77 and name H ))
( segid " " and resid 77 and name HG2%)
2.900 1.100 1.100 peak 740 spectrum 1 weight 0.10000E+01 volume 0.15811E-02 ppm1 8.659 ppm2 1.210 CV 1
ASSI { 741}
(( segid " " and resid 77 and name H ))
(( segid " " and resid 76 and name HD1 ))
4.400 2.400 1.600 peak 741 spectrum 1 weight 0.10000E+01 volume 0.64061E-03 ppm1 8.650 ppm2 7.381 CV 1
OR { 741}
(( segid " " and resid 77 and name H ))
(( segid " " and resid 76 and name HE3 ))
ASSI { 742}
(( segid " " and resid 77 and name H ))
(( segid " " and resid 76 and name HA ))
3.000 1.100 1.100 peak 742 spectrum 1 weight 0.10000E+01 volume 0.13304E-02 ppm1 8.659 ppm2 4.938 CV 1
ASSI { 743}
(( segid " " and resid 78 and name H ))
(( segid " " and resid 77 and name HA ))
3.300 1.400 1.400 peak 743 spectrum 1 weight 0.10000E+01 volume 0.10608E-02 ppm1 9.101 ppm2 4.676 CV 1
OR { 743}
(( segid " " and resid 78 and name H ))
(( segid " " and resid 77 and name HB ))
ASSI { 744}
(( segid " " and resid 78 and name H ))
(( segid " " and resid 78 and name HA2 ))
3.300 1.400 1.400 peak 744 spectrum 1 weight 0.10000E+01 volume 0.10495E-02 ppm1 9.103 ppm2 4.039 CV 1
OR { 744}
(( segid " " and resid 78 and name H ))
(( segid " " and resid 78 and name HA3 ))
ASSI { 746}
(( segid " " and resid 79 and name H ))
(( segid " " and resid 78 and name HA2 ))
3.100 1.200 1.200 peak 746 spectrum 1 weight 0.10000E+01 volume 0.17383E-02 ppm1 8.551 ppm2 4.010 CV 1
OR { 746}
(( segid " " and resid 79 and name H ))
(( segid " " and resid 78 and name HA3 ))
ASSI { 747}
(( segid " " and resid 79 and name H ))
(( segid " " and resid 79 and name HA ))
3.100 1.200 1.200 peak 747 spectrum 1 weight 0.10000E+01 volume 0.17205E-02 ppm1 8.553 ppm2 4.544 CV 1
ASSI { 748}
(( segid " " and resid 79 and name H ))
(( segid " " and resid 79 and name HB3 ))
3.300 1.400 1.400 peak 748 spectrum 1 weight 0.10000E+01 volume 0.22714E-02 ppm1 8.553 ppm2 2.700 CV 1
ASSI { 749}
(( segid " " and resid 79 and name H ))
(( segid " " and resid 79 and name HB2 ))
2.900 1.100 1.100 peak 749 spectrum 1 weight 0.10000E+01 volume 0.25020E-02 ppm1 8.554 ppm2 2.594 CV 1
ASSI { 751}
(( segid " " and resid 79 and name H ))
(( segid " " and resid 78 and name H ))
3.800 1.800 1.800 peak 751 spectrum 1 weight 0.10000E+01 volume 0.64284E-03 ppm1 8.555 ppm2 9.094 CV 1
ASSI { 752}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 80 and name HG3 ))
4.300 2.300 1.700 peak 752 spectrum 1 weight 0.10000E+01 volume 0.13436E-02 ppm1 7.893 ppm2 2.769 CV 1
ASSI { 755}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 80 and name HB2 ))
3.000 1.200 1.200 peak 755 spectrum 1 weight 0.10000E+01 volume 0.12028E-02 ppm1 7.888 ppm2 2.405 CV 1
ASSI { 756}
(( segid " " and resid 80 and name H ))
( segid " " and resid 77 and name HG2%)
3.700 1.700 1.700 peak 756 spectrum 1 weight 0.10000E+01 volume 0.67872E-03 ppm1 7.888 ppm2 1.217 CV 1
ASSI { 757}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 81 and name H ))
3.000 1.100 1.100 peak 757 spectrum 1 weight 0.10000E+01 volume 0.17639E-02 ppm1 7.888 ppm2 8.646 CV 1
ASSI { 758}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 79 and name H ))
3.200 1.300 1.300 peak 758 spectrum 1 weight 0.10000E+01 volume 0.11232E-02 ppm1 7.888 ppm2 8.576 CV 1
ASSI { 759}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 49 and name HG2 ))
2.900 1.000 1.000 peak 759 spectrum 1 weight 0.10000E+01 volume 0.20433E-02 ppm1 7.061 ppm2 2.587 CV 1
ASSI { 761}
(( segid " " and resid 49 and name HE21))
( segid " " and resid 46 and name HG2%)
3.500 1.600 1.600 peak 761 spectrum 1 weight 0.10000E+01 volume 0.92342E-03 ppm1 7.063 ppm2 1.256 CV 1
ASSI { 763}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 49 and name HE22))
1.900 0.500 0.500 peak 763 spectrum 1 weight 0.10000E+01 volume 0.82135E-02 ppm1 7.061 ppm2 7.472 CV 1
ASSI { 764}
(( segid " " and resid 49 and name HE22))
(( segid " " and resid 49 and name HG2 ))
3.900 1.900 1.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.13998E-02 ppm1 7.471 ppm2 2.573 CV 1
ASSI { 767}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 81 and name HG3 ))
3.200 1.300 1.300 peak 767 spectrum 1 weight 0.10000E+01 volume 0.11460E-02 ppm1 8.648 ppm2 2.488 CV 1
ASSI { 768}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 81 and name HB3 ))
3.400 1.500 1.500 peak 768 spectrum 1 weight 0.10000E+01 volume 0.12182E-02 ppm1 8.647 ppm2 1.939 CV 1
ASSI { 770}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 79 and name HA ))
3.400 1.400 1.400 peak 770 spectrum 1 weight 0.10000E+01 volume 0.11871E-02 ppm1 8.151 ppm2 4.528 CV 1
ASSI { 771}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 82 and name HA ))
3.100 1.200 1.200 peak 771 spectrum 1 weight 0.10000E+01 volume 0.14530E-02 ppm1 8.153 ppm2 4.222 CV 1
ASSI { 772}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 83 and name HA ))
4.100 2.100 1.900 peak 772 spectrum 1 weight 0.10000E+01 volume 0.13361E-02 ppm1 8.149 ppm2 4.069 CV 1
ASSI { 777}
(( segid " " and resid 82 and name H ))
( segid " " and resid 82 and name HD1%)
3.700 1.700 1.700 peak 777 spectrum 1 weight 0.10000E+01 volume 0.32806E-02 ppm1 8.155 ppm2 0.958 CV 1
OR { 777}
(( segid " " and resid 82 and name H ))
( segid " " and resid 82 and name HD2%)
ASSI { 778}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 81 and name H ))
2.900 1.100 1.100 peak 778 spectrum 1 weight 0.10000E+01 volume 0.15854E-02 ppm1 8.152 ppm2 8.660 CV 1
ASSI { 779}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 68 and name HA ))
3.200 1.300 1.300 peak 779 spectrum 1 weight 0.10000E+01 volume 0.77283E-03 ppm1 8.099 ppm2 4.364 CV 1
ASSI { 780}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 82 and name HA ))
3.400 1.400 1.400 peak 780 spectrum 1 weight 0.10000E+01 volume 0.10307E-02 ppm1 8.109 ppm2 4.227 CV 1
ASSI { 782}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 83 and name HG2 ))
2.700 0.900 0.900 peak 782 spectrum 1 weight 0.10000E+01 volume 0.24810E-02 ppm1 8.103 ppm2 2.364 CV 1
OR { 782}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 83 and name HB2 ))
ASSI { 783}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 83 and name HB3 ))
3.200 1.300 1.300 peak 783 spectrum 1 weight 0.10000E+01 volume 0.29148E-02 ppm1 8.101 ppm2 2.233 CV 1
ASSI { 785}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 82 and name HB2 ))
3.600 1.600 1.600 peak 785 spectrum 1 weight 0.10000E+01 volume 0.21449E-02 ppm1 8.104 ppm2 1.924 CV 1
ASSI { 789}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 81 and name H ))
3.800 1.800 1.800 peak 789 spectrum 1 weight 0.10000E+01 volume 0.53434E-03 ppm1 8.102 ppm2 8.654 CV 1
ASSI { 790}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 81 and name HA ))
3.700 1.700 1.700 peak 790 spectrum 1 weight 0.10000E+01 volume 0.48686E-03 ppm1 8.030 ppm2 3.928 CV 1
ASSI { 791}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 83 and name HB2 ))
3.100 1.200 1.200 peak 791 spectrum 1 weight 0.10000E+01 volume 0.13525E-02 ppm1 8.034 ppm2 2.389 CV 1
OR { 791}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 83 and name HG2 ))
ASSI { 792}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 85 and name HB2 ))
4.000 2.000 2.000 peak 792 spectrum 1 weight 0.10000E+01 volume 0.14976E-02 ppm1 8.034 ppm2 2.300 CV 1
OR { 792}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 85 and name HG3 ))
ASSI { 793}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 84 and name HB3 ))
3.000 1.100 1.100 peak 793 spectrum 1 weight 0.10000E+01 volume 0.10218E-02 ppm1 8.028 ppm2 2.032 CV 1
ASSI { 794}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 84 and name HB2 ))
3.300 1.300 1.300 peak 794 spectrum 1 weight 0.10000E+01 volume 0.97688E-03 ppm1 8.028 ppm2 1.786 CV 1
ASSI { 795}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 84 and name HA ))
3.200 1.300 1.300 peak 795 spectrum 1 weight 0.10000E+01 volume 0.10031E-02 ppm1 8.024 ppm2 4.107 CV 1
ASSI { 799}
(( segid " " and resid 84 and name H ))
( segid " " and resid 84 and name HD2%)
4.400 2.400 1.600 peak 799 spectrum 1 weight 0.10000E+01 volume 0.78518E-03 ppm1 8.031 ppm2 0.600 CV 1
ASSI { 800}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 82 and name HA ))
3.100 1.200 1.200 peak 800 spectrum 1 weight 0.10000E+01 volume 0.14113E-02 ppm1 8.135 ppm2 4.187 CV 1
ASSI { 804}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 85 and name HB2 ))
2.400 0.700 0.700 peak 804 spectrum 1 weight 0.10000E+01 volume 0.51287E-02 ppm1 8.134 ppm2 2.260 CV 1
OR { 804}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 85 and name HB3 ))
ASSI { 805}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 84 and name HB3 ))
2.700 0.900 0.900 peak 805 spectrum 1 weight 0.10000E+01 volume 0.17807E-02 ppm1 8.136 ppm2 2.029 CV 1
ASSI { 806}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 84 and name HB2 ))
3.900 1.900 1.900 peak 806 spectrum 1 weight 0.10000E+01 volume 0.13897E-02 ppm1 8.134 ppm2 1.795 CV 1
ASSI { 811}
(( segid " " and resid 85 and name HE21))
(( segid " " and resid 85 and name HG2 ))
3.200 1.200 1.200 peak 811 spectrum 1 weight 0.10000E+01 volume 0.16832E-02 ppm1 6.845 ppm2 2.495 CV 1
ASSI { 812}
(( segid " " and resid 85 and name HE21))
(( segid " " and resid 85 and name HB2 ))
2.400 0.700 0.700 peak 812 spectrum 1 weight 0.10000E+01 volume 0.21178E-02 ppm1 6.846 ppm2 2.309 CV 1
OR { 812}
(( segid " " and resid 85 and name HE21))
(( segid " " and resid 85 and name HG3 ))
ASSI { 814}
(( segid " " and resid 85 and name HE21))
( segid " " and resid 73 and name HD1%)
3.200 1.300 1.300 peak 814 spectrum 1 weight 0.10000E+01 volume 0.11759E-02 ppm1 6.844 ppm2 0.853 CV 1
ASSI { 815}
(( segid " " and resid 85 and name HE21))
( segid " " and resid 121 and name HD1%)
3.300 1.400 1.400 peak 815 spectrum 1 weight 0.10000E+01 volume 0.93868E-03 ppm1 6.849 ppm2 0.706 CV 1
ASSI { 818}
(( segid " " and resid 85 and name HE21))
(( segid " " and resid 85 and name HE22))
1.500 0.300 0.700 peak 818 spectrum 1 weight 0.10000E+01 volume 0.27274E-01 ppm1 6.846 ppm2 7.236 CV 1
ASSI { 819}
(( segid " " and resid 85 and name HE22))
(( segid " " and resid 85 and name HG2 ))
3.400 1.400 1.400 peak 819 spectrum 1 weight 0.10000E+01 volume 0.29262E-02 ppm1 7.237 ppm2 2.491 CV 1
ASSI { 820}
(( segid " " and resid 85 and name HE22))
(( segid " " and resid 89 and name HG2 ))
3.600 3.600 2.400 peak 820 spectrum 1 weight 0.10000E+01 volume 0.26231E-02 ppm1 7.240 ppm2 2.392 CV 1
ASSI { 821}
(( segid " " and resid 85 and name HE22))
(( segid " " and resid 85 and name HB2 ))
3.300 1.400 1.400 peak 821 spectrum 1 weight 0.10000E+01 volume 0.36191E-02 ppm1 7.238 ppm2 2.301 CV 1
OR { 821}
(( segid " " and resid 85 and name HE22))
(( segid " " and resid 85 and name HG3 ))
ASSI { 822}
(( segid " " and resid 85 and name HE22))
(( segid " " and resid 121 and name HG ))
4.200 2.200 1.800 peak 822 spectrum 1 weight 0.10000E+01 volume 0.61847E-03 ppm1 7.229 ppm2 1.550 CV 1
ASSI { 823}
(( segid " " and resid 85 and name HE22))
( segid " " and resid 82 and name HD2%)
3.900 1.900 1.900 peak 823 spectrum 1 weight 0.10000E+01 volume 0.13791E-02 ppm1 7.236 ppm2 0.930 CV 1
ASSI { 828}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 86 and name HA ))
2.700 0.900 0.900 peak 828 spectrum 1 weight 0.10000E+01 volume 0.30200E-02 ppm1 8.378 ppm2 4.134 CV 1
ASSI { 829}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 85 and name HA ))
3.600 1.600 1.600 peak 829 spectrum 1 weight 0.10000E+01 volume 0.72929E-03 ppm1 8.383 ppm2 3.855 CV 1
ASSI { 830}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 86 and name HD2 ))
4.800 2.900 1.200 peak 830 spectrum 1 weight 0.10000E+01 volume 0.47800E-03 ppm1 8.380 ppm2 3.267 CV 1
OR { 830}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 86 and name HD3 ))
ASSI { 832}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 86 and name HB2 ))
2.400 0.700 0.700 peak 832 spectrum 1 weight 0.10000E+01 volume 0.55255E-02 ppm1 8.381 ppm2 2.021 CV 1
OR { 832}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 86 and name HB3 ))
ASSI { 833}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 86 and name HG2 ))
3.500 1.500 1.500 peak 833 spectrum 1 weight 0.10000E+01 volume 0.24182E-02 ppm1 8.382 ppm2 1.795 CV 1
ASSI { 834}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 86 and name HG3 ))
2.500 0.800 0.800 peak 834 spectrum 1 weight 0.10000E+01 volume 0.18939E-02 ppm1 8.379 ppm2 1.683 CV 1
ASSI { 837}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 85 and name H ))
2.700 0.900 0.900 peak 837 spectrum 1 weight 0.10000E+01 volume 0.25078E-02 ppm1 8.381 ppm2 8.138 CV 1
ASSI { 838}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 87 and name H ))
2.900 1.000 1.000 peak 838 spectrum 1 weight 0.10000E+01 volume 0.13021E-02 ppm1 8.382 ppm2 8.683 CV 1
ASSI { 839}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 87 and name HA ))
3.200 1.200 1.200 peak 839 spectrum 1 weight 0.10000E+01 volume 0.97940E-03 ppm1 8.678 ppm2 4.238 CV 1
ASSI { 841}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 87 and name HG ))
3.700 1.700 1.700 peak 841 spectrum 1 weight 0.10000E+01 volume 0.25502E-02 ppm1 8.683 ppm2 2.142 CV 1
ASSI { 842}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 86 and name HG3 ))
3.900 1.900 1.900 peak 842 spectrum 1 weight 0.10000E+01 volume 0.90864E-03 ppm1 8.677 ppm2 1.698 CV 1
ASSI { 843}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 87 and name HB3 ))
4.000 2.000 2.000 peak 843 spectrum 1 weight 0.10000E+01 volume 0.83960E-03 ppm1 8.677 ppm2 1.485 CV 1
ASSI { 846}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 88 and name H ))
3.200 1.300 1.300 peak 846 spectrum 1 weight 0.10000E+01 volume 0.85626E-03 ppm1 8.686 ppm2 8.905 CV 1
ASSI { 847}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 88 and name HA ))
2.900 1.100 1.100 peak 847 spectrum 1 weight 0.10000E+01 volume 0.15295E-02 ppm1 8.899 ppm2 3.935 CV 1
ASSI { 848}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 88 and name HB3 ))
2.700 0.900 0.900 peak 848 spectrum 1 weight 0.10000E+01 volume 0.13053E-02 ppm1 8.900 ppm2 3.185 CV 1
ASSI { 849}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 88 and name HB2 ))
3.300 1.400 1.400 peak 849 spectrum 1 weight 0.10000E+01 volume 0.12634E-02 ppm1 8.902 ppm2 2.939 CV 1
ASSI { 851}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 87 and name HG ))
4.100 2.100 1.900 peak 851 spectrum 1 weight 0.10000E+01 volume 0.12269E-02 ppm1 8.900 ppm2 2.112 CV 1
ASSI { 852}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 87 and name HB3 ))
3.500 1.500 1.500 peak 852 spectrum 1 weight 0.10000E+01 volume 0.44992E-03 ppm1 8.911 ppm2 1.506 CV 1
ASSI { 856}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 89 and name H ))
2.900 1.100 1.100 peak 856 spectrum 1 weight 0.10000E+01 volume 0.13685E-02 ppm1 8.901 ppm2 8.188 CV 1
ASSI { 857}
(( segid " " and resid 88 and name H ))
( segid " " and resid 88 and name HD% )
4.000 2.000 2.000 peak 857 spectrum 1 weight 0.10000E+01 volume 0.11896E-02 ppm1 8.900 ppm2 7.055 CV 1
ASSI { 858}
(( segid " " and resid 89 and name H ))
(( segid " " and resid 86 and name HA ))
3.600 1.600 1.600 peak 858 spectrum 1 weight 0.10000E+01 volume 0.67268E-03 ppm1 8.188 ppm2 4.129 CV 1
ASSI { 859}
(( segid " " and resid 89 and name H ))
(( segid " " and resid 85 and name HA ))
3.700 1.700 1.700 peak 859 spectrum 1 weight 0.10000E+01 volume 0.65363E-03 ppm1 8.191 ppm2 3.836 CV 1
ASSI { 860}
(( segid " " and resid 89 and name H ))
(( segid " " and resid 89 and name HA ))
2.800 1.000 1.000 peak 860 spectrum 1 weight 0.10000E+01 volume 0.17733E-02 ppm1 8.193 ppm2 3.744 CV 1
ASSI { 861}
(( segid " " and resid 89 and name H ))
(( segid " " and resid 88 and name HB2 ))
4.600 2.600 1.400 peak 861 spectrum 1 weight 0.10000E+01 volume 0.55850E-03 ppm1 8.188 ppm2 2.937 CV 1
ASSI { 864}
(( segid " " and resid 89 and name H ))
(( segid " " and resid 89 and name HB3 ))
3.400 1.400 1.400 peak 864 spectrum 1 weight 0.10000E+01 volume 0.27312E-02 ppm1 8.190 ppm2 2.173 CV 1
ASSI { 865}
(( segid " " and resid 89 and name H ))
(( segid " " and resid 89 and name HB2 ))
2.700 0.900 0.900 peak 865 spectrum 1 weight 0.10000E+01 volume 0.23444E-02 ppm1 8.189 ppm2 2.053 CV 1
ASSI { 868}
(( segid " " and resid 89 and name H ))
( segid " " and resid 88 and name HD% )
3.100 1.200 1.200 peak 868 spectrum 1 weight 0.10000E+01 volume 0.70881E-03 ppm1 8.189 ppm2 7.052 CV 1
ASSI { 870}
(( segid " " and resid 90 and name H ))
(( segid " " and resid 87 and name HA ))
3.700 1.700 1.700 peak 870 spectrum 1 weight 0.10000E+01 volume 0.66295E-03 ppm1 7.905 ppm2 4.270 CV 1
ASSI { 871}
(( segid " " and resid 90 and name H ))
(( segid " " and resid 89 and name HB3 ))
4.000 2.000 2.000 peak 871 spectrum 1 weight 0.10000E+01 volume 0.11657E-02 ppm1 7.923 ppm2 2.160 CV 1
ASSI { 872}
(( segid " " and resid 90 and name H ))
(( segid " " and resid 89 and name HB2 ))
3.000 1.100 1.100 peak 872 spectrum 1 weight 0.10000E+01 volume 0.11612E-02 ppm1 7.923 ppm2 2.047 CV 1
ASSI { 873}
(( segid " " and resid 90 and name H ))
(( segid " " and resid 90 and name HB2 ))
2.400 0.700 0.700 peak 873 spectrum 1 weight 0.10000E+01 volume 0.32724E-02 ppm1 7.912 ppm2 1.776 CV 1
ASSI { 875}
(( segid " " and resid 90 and name H ))
(( segid " " and resid 91 and name H ))
2.800 1.000 1.000 peak 875 spectrum 1 weight 0.10000E+01 volume 0.15912E-02 ppm1 7.922 ppm2 7.750 CV 1
ASSI { 876}
(( segid " " and resid 90 and name H ))
(( segid " " and resid 89 and name H ))
2.600 0.900 0.900 peak 876 spectrum 1 weight 0.10000E+01 volume 0.20266E-02 ppm1 7.905 ppm2 8.176 CV 1
ASSI { 878}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 91 and name HB2 ))
3.000 1.100 1.100 peak 878 spectrum 1 weight 0.10000E+01 volume 0.95533E-03 ppm1 7.750 ppm2 3.385 CV 1
ASSI { 879}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 91 and name HB3 ))
4.000 2.000 2.000 peak 879 spectrum 1 weight 0.10000E+01 volume 0.13481E-02 ppm1 7.746 ppm2 2.664 CV 1
ASSI { 881}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 90 and name HB2 ))
3.100 1.200 1.200 peak 881 spectrum 1 weight 0.10000E+01 volume 0.13351E-02 ppm1 7.745 ppm2 1.770 CV 1
ASSI { 885}
(( segid " " and resid 91 and name H ))
( segid " " and resid 91 and name HD% )
2.800 1.000 1.000 peak 885 spectrum 1 weight 0.10000E+01 volume 0.27561E-02 ppm1 7.749 ppm2 7.103 CV 1
ASSI { 886}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 91 and name HA ))
3.200 1.300 1.300 peak 886 spectrum 1 weight 0.10000E+01 volume 0.13511E-02 ppm1 7.747 ppm2 4.814 CV 1
ASSI { 889}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 92 and name HA ))
2.600 0.900 0.900 peak 889 spectrum 1 weight 0.10000E+01 volume 0.27424E-02 ppm1 7.845 ppm2 3.600 CV 1
ASSI { 890}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 92 and name HD3 ))
4.300 2.300 1.700 peak 890 spectrum 1 weight 0.10000E+01 volume 0.91550E-03 ppm1 7.849 ppm2 3.015 CV 1
ASSI { 891}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 92 and name HD2 ))
4.400 2.400 1.600 peak 891 spectrum 1 weight 0.10000E+01 volume 0.10761E-02 ppm1 7.844 ppm2 2.905 CV 1
ASSI { 892}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 92 and name HG3 ))
3.100 1.200 1.200 peak 892 spectrum 1 weight 0.10000E+01 volume 0.46366E-02 ppm1 7.845 ppm2 1.521 CV 1
OR { 892}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 92 and name HB2 ))
ASSI { 893}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 92 and name HG2 ))
2.400 0.700 0.700 peak 893 spectrum 1 weight 0.10000E+01 volume 0.20725E-02 ppm1 7.848 ppm2 1.238 CV 1
ASSI { 894}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 92 and name HB3 ))
2.500 0.800 0.800 peak 894 spectrum 1 weight 0.10000E+01 volume 0.36528E-02 ppm1 7.844 ppm2 1.083 CV 1
ASSI { 895}
(( segid " " and resid 92 and name H ))
( segid " " and resid 97 and name HG2%)
2.800 1.000 1.000 peak 895 spectrum 1 weight 0.10000E+01 volume 0.37980E-02 ppm1 7.846 ppm2 1.032 CV 1
OR { 895}
(( segid " " and resid 92 and name H ))
( segid " " and resid 97 and name HG1%)
ASSI { 896}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 93 and name HA ))
4.400 2.400 1.600 peak 896 spectrum 1 weight 0.10000E+01 volume 0.99016E-03 ppm1 7.846 ppm2 4.926 CV 1
ASSI { 898}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 91 and name HA ))
3.600 1.600 1.600 peak 898 spectrum 1 weight 0.10000E+01 volume 0.56668E-03 ppm1 7.847 ppm2 4.802 CV 1
ASSI { 899}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 93 and name H ))
2.800 1.000 1.000 peak 899 spectrum 1 weight 0.10000E+01 volume 0.16241E-02 ppm1 7.847 ppm2 8.378 CV 1
ASSI { 900}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 92 and name HA ))
3.300 1.400 1.400 peak 900 spectrum 1 weight 0.10000E+01 volume 0.10135E-02 ppm1 8.386 ppm2 3.604 CV 1
ASSI { 902}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 93 and name HB2 ))
2.600 0.900 0.900 peak 902 spectrum 1 weight 0.10000E+01 volume 0.34671E-02 ppm1 8.381 ppm2 2.850 CV 1
ASSI { 903}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 93 and name HB3 ))
3.000 1.100 1.100 peak 903 spectrum 1 weight 0.10000E+01 volume 0.37941E-02 ppm1 8.382 ppm2 2.471 CV 1
ASSI { 904}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 92 and name HG3 ))
3.100 1.200 1.200 peak 904 spectrum 1 weight 0.10000E+01 volume 0.20075E-02 ppm1 8.381 ppm2 1.518 CV 1
OR { 904}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 92 and name HB2 ))
ASSI { 905}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 92 and name HG2 ))
3.500 1.500 1.500 peak 905 spectrum 1 weight 0.10000E+01 volume 0.90754E-03 ppm1 8.376 ppm2 1.283 CV 1
ASSI { 906}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 92 and name HB3 ))
3.700 1.700 1.700 peak 906 spectrum 1 weight 0.10000E+01 volume 0.17388E-02 ppm1 8.381 ppm2 1.081 CV 1
ASSI { 908}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 93 and name HA ))
2.800 1.000 1.000 peak 908 spectrum 1 weight 0.10000E+01 volume 0.31974E-02 ppm1 8.381 ppm2 4.931 CV 1
ASSI { 909}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 91 and name HA ))
3.000 1.100 1.100 peak 909 spectrum 1 weight 0.10000E+01 volume 0.19511E-02 ppm1 8.383 ppm2 4.807 CV 1
ASSI { 910}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 94 and name HA ))
3.000 1.100 1.100 peak 910 spectrum 1 weight 0.10000E+01 volume 0.23741E-02 ppm1 7.830 ppm2 4.537 CV 1
ASSI { 911}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 94 and name HB3 ))
3.100 1.200 1.200 peak 911 spectrum 1 weight 0.10000E+01 volume 0.17093E-02 ppm1 7.831 ppm2 4.178 CV 1
ASSI { 912}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 94 and name HB2 ))
3.000 1.100 1.100 peak 912 spectrum 1 weight 0.10000E+01 volume 0.22974E-02 ppm1 7.829 ppm2 4.012 CV 1
ASSI { 914}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 93 and name HB2 ))
3.500 1.600 1.600 peak 914 spectrum 1 weight 0.10000E+01 volume 0.13197E-02 ppm1 7.835 ppm2 2.845 CV 1
ASSI { 915}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 93 and name HB3 ))
3.800 1.800 1.800 peak 915 spectrum 1 weight 0.10000E+01 volume 0.10245E-02 ppm1 7.834 ppm2 2.473 CV 1
ASSI { 916}
(( segid " " and resid 94 and name H ))
( segid " " and resid 97 and name HG2%)
3.600 1.600 1.600 peak 916 spectrum 1 weight 0.10000E+01 volume 0.19046E-02 ppm1 7.829 ppm2 1.016 CV 1
OR { 916}
(( segid " " and resid 94 and name H ))
( segid " " and resid 97 and name HG1%)
ASSI { 918}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 93 and name HA ))
3.100 1.200 1.200 peak 918 spectrum 1 weight 0.10000E+01 volume 0.25372E-02 ppm1 7.830 ppm2 4.925 CV 1
ASSI { 919}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 91 and name HA ))
3.000 1.100 1.100 peak 919 spectrum 1 weight 0.10000E+01 volume 0.33221E-02 ppm1 7.829 ppm2 4.806 CV 1
ASSI { 920}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 95 and name H ))
4.400 2.400 1.600 peak 920 spectrum 1 weight 0.10000E+01 volume 0.72520E-03 ppm1 7.836 ppm2 8.707 CV 1
ASSI { 921}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 93 and name H ))
2.600 0.800 0.800 peak 921 spectrum 1 weight 0.10000E+01 volume 0.45239E-02 ppm1 7.830 ppm2 8.381 CV 1
ASSI { 923}
(( segid " " and resid 95 and name H ))
(( segid " " and resid 94 and name HB3 ))
3.900 1.900 1.900 peak 923 spectrum 1 weight 0.10000E+01 volume 0.61078E-03 ppm1 8.708 ppm2 4.175 CV 1
ASSI { 924}
(( segid " " and resid 95 and name H ))
(( segid " " and resid 95 and name HB2 ))
3.100 1.200 1.200 peak 924 spectrum 1 weight 0.10000E+01 volume 0.17627E-02 ppm1 8.709 ppm2 2.789 CV 1
OR { 924}
(( segid " " and resid 95 and name H ))
(( segid " " and resid 95 and name HB3 ))
ASSI { 925}
(( segid " " and resid 95 and name H ))
(( segid " " and resid 96 and name H ))
3.300 1.400 1.400 peak 925 spectrum 1 weight 0.10000E+01 volume 0.11606E-02 ppm1 8.712 ppm2 7.855 CV 1
ASSI { 927}
(( segid " " and resid 96 and name H ))
(( segid " " and resid 95 and name HB2 ))
3.100 1.200 1.200 peak 927 spectrum 1 weight 0.10000E+01 volume 0.24683E-02 ppm1 7.876 ppm2 2.797 CV 1
OR { 927}
(( segid " " and resid 96 and name H ))
(( segid " " and resid 95 and name HB3 ))
ASSI { 928}
(( segid " " and resid 96 and name H ))
( segid " " and resid 97 and name HG1%)
3.800 1.800 1.800 peak 928 spectrum 1 weight 0.10000E+01 volume 0.22819E-02 ppm1 7.877 ppm2 1.030 CV 1
OR { 928}
(( segid " " and resid 96 and name H ))
( segid " " and resid 97 and name HG2%)
ASSI { 929}
(( segid " " and resid 96 and name H ))
(( segid " " and resid 96 and name HB3 ))
2.800 1.000 1.000 peak 929 spectrum 1 weight 0.10000E+01 volume 0.38904E-02 ppm1 7.878 ppm2 2.565 CV 1
OR { 929}
(( segid " " and resid 96 and name H ))
(( segid " " and resid 96 and name HB2 ))
ASSI { 930}
(( segid " " and resid 96 and name H ))
(( segid " " and resid 100 and name HD2 ))
3.500 1.500 1.500 peak 930 spectrum 1 weight 0.10000E+01 volume 0.12352E-02 ppm1 7.878 ppm2 7.085 CV 1
ASSI { 931}
(( segid " " and resid 96 and name H ))
(( segid " " and resid 97 and name H ))
3.100 1.200 1.200 peak 931 spectrum 1 weight 0.10000E+01 volume 0.29223E-02 ppm1 7.877 ppm2 8.654 CV 1
ASSI { 932}
(( segid " " and resid 97 and name H ))
(( segid " " and resid 97 and name HA ))
3.100 1.200 1.200 peak 932 spectrum 1 weight 0.10000E+01 volume 0.12055E-02 ppm1 8.640 ppm2 3.665 CV 1
ASSI { 933}
(( segid " " and resid 97 and name H ))
(( segid " " and resid 96 and name HB2 ))
4.500 2.500 1.500 peak 933 spectrum 1 weight 0.10000E+01 volume 0.70462E-03 ppm1 8.631 ppm2 2.557 CV 1
OR { 933}
(( segid " " and resid 97 and name H ))
(( segid " " and resid 96 and name HB3 ))
ASSI { 934}
(( segid " " and resid 97 and name H ))
(( segid " " and resid 97 and name HB ))
2.900 1.000 1.000 peak 934 spectrum 1 weight 0.10000E+01 volume 0.14315E-02 ppm1 8.642 ppm2 2.207 CV 1
ASSI { 935}
(( segid " " and resid 97 and name H ))
( segid " " and resid 97 and name HG1%)
2.500 0.800 0.800 peak 935 spectrum 1 weight 0.10000E+01 volume 0.38871E-02 ppm1 8.638 ppm2 1.016 CV 1
ASSI { 937}
(( segid " " and resid 98 and name H ))
(( segid " " and resid 97 and name HB ))
3.900 1.900 1.900 peak 937 spectrum 1 weight 0.10000E+01 volume 0.11575E-02 ppm1 8.576 ppm2 2.203 CV 1
ASSI { 938}
(( segid " " and resid 98 and name H ))
(( segid " " and resid 98 and name HB2 ))
2.400 0.700 0.700 peak 938 spectrum 1 weight 0.10000E+01 volume 0.18009E-02 ppm1 8.578 ppm2 1.433 CV 1
ASSI { 939}
(( segid " " and resid 98 and name H ))
( segid " " and resid 97 and name HG1%)
2.400 0.700 0.700 peak 939 spectrum 1 weight 0.10000E+01 volume 0.41040E-02 ppm1 8.578 ppm2 1.009 CV 1
OR { 939}
(( segid " " and resid 98 and name H ))
( segid " " and resid 97 and name HG2%)
ASSI { 941}
(( segid " " and resid 98 and name H ))
(( segid " " and resid 96 and name HA ))
4.100 2.100 1.900 peak 941 spectrum 1 weight 0.10000E+01 volume 0.55397E-03 ppm1 8.586 ppm2 4.804 CV 1
ASSI { 942}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 99 and name HA3 ))
2.400 0.800 0.800 peak 942 spectrum 1 weight 0.10000E+01 volume 0.37887E-02 ppm1 7.847 ppm2 3.623 CV 1
ASSI { 945}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 98 and name HB3 ))
3.200 1.300 1.300 peak 945 spectrum 1 weight 0.10000E+01 volume 0.15091E-02 ppm1 7.848 ppm2 1.826 CV 1
ASSI { 947}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 99 and name HA2 ))
2.600 0.800 0.800 peak 947 spectrum 1 weight 0.10000E+01 volume 0.68013E-02 ppm1 7.840 ppm2 3.814 CV 1
ASSI { 949}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 98 and name HB2 ))
2.900 1.000 1.000 peak 949 spectrum 1 weight 0.10000E+01 volume 0.24720E-02 ppm1 7.842 ppm2 1.436 CV 1
ASSI { 951}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 96 and name HA ))
3.700 1.700 1.700 peak 951 spectrum 1 weight 0.10000E+01 volume 0.71297E-03 ppm1 7.846 ppm2 4.803 CV 1
ASSI { 952}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 98 and name H ))
2.500 0.800 0.800 peak 952 spectrum 1 weight 0.10000E+01 volume 0.25182E-02 ppm1 7.846 ppm2 8.584 CV 1
ASSI { 953}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 96 and name HB2 ))
3.800 1.800 1.800 peak 953 spectrum 1 weight 0.10000E+01 volume 0.81283E-03 ppm1 7.756 ppm2 2.524 CV 1
ASSI { 957}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 100 and name HB2 ))
2.300 0.700 0.700 peak 957 spectrum 1 weight 0.10000E+01 volume 0.42918E-02 ppm1 7.753 ppm2 2.275 CV 1
ASSI { 961}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 100 and name HD2 ))
3.000 1.100 1.100 peak 961 spectrum 1 weight 0.10000E+01 volume 0.20599E-02 ppm1 7.747 ppm2 7.084 CV 1
ASSI { 963}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 101 and name H ))
2.600 0.800 0.800 peak 963 spectrum 1 weight 0.10000E+01 volume 0.22240E-02 ppm1 7.749 ppm2 8.307 CV 1
ASSI { 965}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 101 and name HB ))
2.600 0.900 0.900 peak 965 spectrum 1 weight 0.10000E+01 volume 0.19111E-02 ppm1 8.308 ppm2 2.068 CV 1
ASSI { 967}
(( segid " " and resid 102 and name H ))
(( segid " " and resid 101 and name H ))
3.300 1.400 1.400 peak 967 spectrum 1 weight 0.10000E+01 volume 0.60248E-03 ppm1 8.593 ppm2 8.303 CV 1
ASSI { 968}
(( segid " " and resid 102 and name H ))
(( segid " " and resid 103 and name H ))
3.000 1.100 1.100 peak 968 spectrum 1 weight 0.10000E+01 volume 0.11680E-02 ppm1 8.594 ppm2 7.480 CV 1
ASSI { 969}
(( segid " " and resid 103 and name H ))
(( segid " " and resid 103 and name HA ))
2.900 1.100 1.100 peak 969 spectrum 1 weight 0.10000E+01 volume 0.22089E-02 ppm1 7.471 ppm2 4.158 CV 1
ASSI { 970}
(( segid " " and resid 103 and name H ))
(( segid " " and resid 102 and name HA ))
3.300 1.400 1.400 peak 970 spectrum 1 weight 0.10000E+01 volume 0.13013E-02 ppm1 7.473 ppm2 4.045 CV 1
ASSI { 971}
(( segid " " and resid 103 and name H ))
(( segid " " and resid 100 and name HA ))
3.200 1.300 1.300 peak 971 spectrum 1 weight 0.10000E+01 volume 0.12835E-02 ppm1 7.475 ppm2 3.974 CV 1
ASSI { 972}
(( segid " " and resid 103 and name H ))
(( segid " " and resid 102 and name HB3 ))
3.700 1.700 1.700 peak 972 spectrum 1 weight 0.10000E+01 volume 0.15248E-02 ppm1 7.475 ppm2 2.166 CV 1
ASSI { 973}
(( segid " " and resid 103 and name H ))
(( segid " " and resid 102 and name HB2 ))
2.900 1.000 1.000 peak 973 spectrum 1 weight 0.10000E+01 volume 0.13257E-02 ppm1 7.468 ppm2 2.111 CV 1
ASSI { 975}
(( segid " " and resid 103 and name H ))
(( segid " " and resid 103 and name HG3 ))
3.000 1.100 1.100 peak 975 spectrum 1 weight 0.10000E+01 volume 0.22066E-02 ppm1 7.470 ppm2 1.449 CV 1
OR { 975}
(( segid " " and resid 103 and name H ))
(( segid " " and resid 103 and name HG2 ))
ASSI { 979}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 103 and name HA ))
3.800 1.800 1.800 peak 979 spectrum 1 weight 0.10000E+01 volume 0.58888E-03 ppm1 7.375 ppm2 4.165 CV 1
ASSI { 980}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 104 and name HB3 ))
4.000 2.000 2.000 peak 980 spectrum 1 weight 0.10000E+01 volume 0.11285E-02 ppm1 7.374 ppm2 2.901 CV 1
ASSI { 981}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 104 and name HB2 ))
2.900 1.000 1.000 peak 981 spectrum 1 weight 0.10000E+01 volume 0.13286E-02 ppm1 7.370 ppm2 2.619 CV 1
ASSI { 982}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 103 and name HB3 ))
3.400 1.400 1.400 peak 982 spectrum 1 weight 0.10000E+01 volume 0.13305E-02 ppm1 7.371 ppm2 1.816 CV 1
OR { 982}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 103 and name HB2 ))
ASSI { 984}
(( segid " " and resid 104 and name H ))
( segid " " and resid 105 and name HG2%)
3.600 1.600 1.600 peak 984 spectrum 1 weight 0.10000E+01 volume 0.23252E-02 ppm1 7.371 ppm2 1.040 CV 1
OR { 984}
(( segid " " and resid 104 and name H ))
( segid " " and resid 105 and name HD1%)
ASSI { 985}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 104 and name HA ))
3.300 1.400 1.400 peak 985 spectrum 1 weight 0.10000E+01 volume 0.11440E-02 ppm1 7.372 ppm2 4.822 CV 1
ASSI { 986}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 105 and name H ))
2.700 0.900 0.900 peak 986 spectrum 1 weight 0.10000E+01 volume 0.21835E-02 ppm1 7.372 ppm2 8.078 CV 1
ASSI { 987}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 100 and name H ))
2.500 2.500 3.500 peak 987 spectrum 1 weight 0.10000E+01 volume 0.72663E-03 ppm1 7.372 ppm2 7.760 CV 1
ASSI { 988}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 103 and name H ))
2.700 0.900 0.900 peak 988 spectrum 1 weight 0.10000E+01 volume 0.22894E-02 ppm1 7.370 ppm2 7.484 CV 1
ASSI { 989}
(( segid " " and resid 105 and name H ))
(( segid " " and resid 105 and name HA ))
3.100 1.200 1.200 peak 989 spectrum 1 weight 0.10000E+01 volume 0.12349E-02 ppm1 8.083 ppm2 4.216 CV 1
ASSI { 991}
(( segid " " and resid 105 and name H ))
(( segid " " and resid 105 and name HB ))
2.700 0.900 0.900 peak 991 spectrum 1 weight 0.10000E+01 volume 0.23958E-02 ppm1 8.083 ppm2 1.960 CV 1
ASSI { 992}
(( segid " " and resid 105 and name H ))
(( segid " " and resid 105 and name HG13))
4.000 2.000 2.000 peak 992 spectrum 1 weight 0.10000E+01 volume 0.10366E-02 ppm1 8.089 ppm2 1.426 CV 1
ASSI { 994}
(( segid " " and resid 105 and name H ))
( segid " " and resid 105 and name HG2%)
2.500 0.800 0.800 peak 994 spectrum 1 weight 0.10000E+01 volume 0.57699E-02 ppm1 8.080 ppm2 1.033 CV 1
OR { 994}
(( segid " " and resid 105 and name H ))
( segid " " and resid 105 and name HD1%)
ASSI { 996}
(( segid " " and resid 105 and name H ))
(( segid " " and resid 104 and name HA ))
3.600 1.600 1.600 peak 996 spectrum 1 weight 0.10000E+01 volume 0.71942E-03 ppm1 8.090 ppm2 4.814 CV 1
ASSI { 997}
(( segid " " and resid 106 and name H ))
(( segid " " and resid 106 and name HB ))
2.900 1.100 1.100 peak 997 spectrum 1 weight 0.10000E+01 volume 0.10099E-02 ppm1 9.158 ppm2 4.375 CV 1
ASSI { 998}
(( segid " " and resid 106 and name H ))
(( segid " " and resid 105 and name HA ))
2.700 0.900 0.900 peak 998 spectrum 1 weight 0.10000E+01 volume 0.14212E-02 ppm1 9.165 ppm2 4.230 CV 1
ASSI { 1000}
(( segid " " and resid 106 and name H ))
(( segid " " and resid 105 and name HG12))
2.900 1.100 1.100 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.56137E-03 ppm1 9.169 ppm2 1.565 CV 1
ASSI { 1001}
(( segid " " and resid 106 and name H ))
(( segid " " and resid 105 and name HG13))
3.400 1.500 1.500 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.86803E-03 ppm1 9.163 ppm2 1.386 CV 1
ASSI { 1003}
(( segid " " and resid 106 and name H ))
( segid " " and resid 105 and name HG2%)
3.700 1.800 1.800 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.17500E-02 ppm1 9.160 ppm2 1.047 CV 1
OR { 1003}
(( segid " " and resid 106 and name H ))
( segid " " and resid 105 and name HD1%)
ASSI { 1005}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 107 and name HA ))
2.400 0.700 0.700 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.40224E-02 ppm1 7.635 ppm2 4.461 CV 1
ASSI { 1006}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 106 and name HB ))
3.000 1.100 1.100 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.47342E-02 ppm1 7.636 ppm2 4.382 CV 1
ASSI { 1007}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 105 and name HA ))
4.000 2.000 2.000 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.17127E-02 ppm1 7.636 ppm2 4.235 CV 1
ASSI { 1008}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 106 and name HA ))
2.900 1.000 1.000 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 7.635 ppm2 4.069 CV 1
ASSI { 1009}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 105 and name HB ))
4.800 2.800 1.200 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.68308E-03 ppm1 7.636 ppm2 1.950 CV 1
ASSI { 1010}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 105 and name HG12))
1.700 0.400 0.500 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.15161E-02 ppm1 7.635 ppm2 1.588 CV 1
ASSI { 1011}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 105 and name HG13))
3.300 1.300 1.300 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.32527E-02 ppm1 7.635 ppm2 1.391 CV 1
ASSI { 1012}
(( segid " " and resid 107 and name H ))
( segid " " and resid 107 and name HB% )
2.100 0.500 0.500 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.87201E-02 ppm1 7.635 ppm2 1.142 CV 1
ASSI { 1013}
(( segid " " and resid 107 and name H ))
( segid " " and resid 105 and name HG2%)
2.600 0.800 0.800 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.73002E-02 ppm1 7.636 ppm2 1.072 CV 1
OR { 1013}
(( segid " " and resid 107 and name H ))
( segid " " and resid 105 and name HD1%)
ASSI { 1014}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 106 and name H ))
2.400 0.700 0.700 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.25338E-02 ppm1 7.636 ppm2 9.168 CV 1
ASSI { 1015}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 108 and name H ))
3.600 1.600 1.600 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.14537E-02 ppm1 7.634 ppm2 8.194 CV 1
ASSI { 1017}
(( segid " " and resid 108 and name H ))
(( segid " " and resid 107 and name HA ))
2.300 0.600 0.600 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.72196E-02 ppm1 8.191 ppm2 4.465 CV 1
ASSI { 1018}
(( segid " " and resid 108 and name H ))
(( segid " " and resid 108 and name HA ))
2.700 0.900 0.900 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.30129E-02 ppm1 8.190 ppm2 4.081 CV 1
ASSI { 1019}
(( segid " " and resid 108 and name H ))
(( segid " " and resid 108 and name HB2 ))
2.400 0.700 0.700 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.76911E-02 ppm1 8.191 ppm2 1.730 CV 1
OR { 1019}
(( segid " " and resid 108 and name H ))
(( segid " " and resid 108 and name HB3 ))
ASSI { 1020}
(( segid " " and resid 108 and name H ))
(( segid " " and resid 108 and name HG2 ))
2.600 0.900 0.900 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.48215E-02 ppm1 8.190 ppm2 1.411 CV 1
OR { 1020}
(( segid " " and resid 108 and name H ))
(( segid " " and resid 108 and name HG3 ))
ASSI { 1021}
(( segid " " and resid 108 and name H ))
( segid " " and resid 107 and name HB% )
3.000 1.100 1.100 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.40046E-02 ppm1 8.192 ppm2 1.160 CV 1
ASSI { 1022}
(( segid " " and resid 109 and name H ))
(( segid " " and resid 108 and name HA ))
2.200 0.600 0.600 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.78637E-02 ppm1 7.638 ppm2 4.084 CV 1
ASSI { 1024}
(( segid " " and resid 109 and name H ))
(( segid " " and resid 109 and name HB3 ))
2.600 0.900 0.900 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.49745E-02 ppm1 7.639 ppm2 1.472 CV 1
OR { 1024}
(( segid " " and resid 109 and name H ))
(( segid " " and resid 109 and name HG3 ))
ASSI { 1025}
(( segid " " and resid 109 and name H ))
( segid " " and resid 107 and name HB% )
3.100 1.200 1.200 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.22062E-02 ppm1 7.638 ppm2 1.119 CV 1
ASSI { 1026}
(( segid " " and resid 109 and name H ))
( segid " " and resid 105 and name HG2%)
2.800 1.000 1.000 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.32400E-02 ppm1 7.639 ppm2 1.044 CV 1
OR { 1026}
(( segid " " and resid 109 and name H ))
( segid " " and resid 105 and name HD1%)
ASSI { 1027}
(( segid " " and resid 109 and name H ))
(( segid " " and resid 109 and name HA ))
3.000 1.200 1.200 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.16736E-02 ppm1 7.640 ppm2 4.619 CV 1
ASSI { 1028}
(( segid " " and resid 109 and name H ))
(( segid " " and resid 110 and name H ))
4.200 2.200 1.800 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.66623E-03 ppm1 7.642 ppm2 8.381 CV 1
ASSI { 1029}
(( segid " " and resid 109 and name H ))
(( segid " " and resid 108 and name H ))
3.800 1.800 1.800 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.12950E-02 ppm1 7.636 ppm2 8.192 CV 1
ASSI { 1030}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 110 and name HB2 ))
3.200 1.300 1.300 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.15400E-02 ppm1 8.375 ppm2 4.311 CV 1
ASSI { 1033}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 109 and name HA ))
2.700 0.900 0.900 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.30840E-02 ppm1 8.376 ppm2 4.616 CV 1
ASSI { 1034}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 110 and name HA ))
3.000 1.100 1.100 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.20421E-02 ppm1 8.378 ppm2 4.461 CV 1
ASSI { 1035}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 110 and name HB3 ))
3.200 1.300 1.300 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.14456E-02 ppm1 8.376 ppm2 4.001 CV 1
ASSI { 1036}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 113 and name HB3 ))
3.300 1.300 1.300 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.11057E-02 ppm1 8.374 ppm2 2.182 CV 1
OR { 1036}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 113 and name HB2 ))
ASSI { 1037}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 74 and name HB ))
3.900 3.900 2.100 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.89199E-03 ppm1 8.379 ppm2 2.048 CV 1
ASSI { 1039}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 109 and name HB2 ))
3.100 1.200 1.200 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.17043E-02 ppm1 8.374 ppm2 1.797 CV 1
ASSI { 1040}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 109 and name HB3 ))
3.100 1.200 1.200 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.19532E-02 ppm1 8.376 ppm2 1.461 CV 1
OR { 1040}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 109 and name HG3 ))
ASSI { 1042}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 113 and name H ))
4.100 2.100 1.900 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.44082E-03 ppm1 8.373 ppm2 7.546 CV 1
ASSI { 1043}
(( segid " " and resid 127 and name H ))
(( segid " " and resid 127 and name HA ))
3.400 1.500 1.500 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.49311E-03 ppm1 9.025 ppm2 3.766 CV 1
ASSI { 1045}
(( segid " " and resid 111 and name H ))
(( segid " " and resid 111 and name HG3 ))
3.200 1.300 1.300 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.84779E-03 ppm1 9.023 ppm2 1.618 CV 1
ASSI { 1046}
(( segid " " and resid 111 and name H ))
(( segid " " and resid 110 and name HA ))
2.900 1.000 1.000 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.16500E-02 ppm1 9.007 ppm2 4.444 CV 1
ASSI { 1047}
(( segid " " and resid 111 and name H ))
(( segid " " and resid 110 and name HB2 ))
3.900 1.900 1.900 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.97077E-03 ppm1 9.007 ppm2 4.315 CV 1
ASSI { 1050}
(( segid " " and resid 111 and name H ))
(( segid " " and resid 111 and name HB3 ))
2.800 1.000 1.000 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.21779E-02 ppm1 9.009 ppm2 1.903 CV 1
OR { 1050}
(( segid " " and resid 111 and name H ))
(( segid " " and resid 111 and name HB2 ))
ASSI { 1054}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 112 and name HA ))
2.800 1.000 1.000 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.22894E-02 ppm1 8.526 ppm2 4.042 CV 1
ASSI { 1055}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 111 and name HB3 ))
2.900 1.000 1.000 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.20545E-02 ppm1 8.529 ppm2 1.891 CV 1
OR { 1055}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 111 and name HB2 ))
ASSI { 1056}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 111 and name HG2 ))
3.900 1.900 1.900 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.12502E-02 ppm1 8.521 ppm2 1.766 CV 1
ASSI { 1057}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 111 and name HG3 ))
4.100 2.100 1.900 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.86237E-03 ppm1 8.526 ppm2 1.616 CV 1
ASSI { 1060}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 111 and name H ))
3.300 1.400 1.400 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.77936E-03 ppm1 8.525 ppm2 9.007 CV 1
ASSI { 1063}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 113 and name HB2 ))
2.900 1.000 1.000 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.20353E-02 ppm1 7.552 ppm2 2.217 CV 1
OR { 1063}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 113 and name HB3 ))
ASSI { 1064}
(( segid " " and resid 113 and name H ))
( segid " " and resid 102 and name HE% )
3.600 1.600 1.600 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.15246E-02 ppm1 7.553 ppm2 2.111 CV 1
ASSI { 1065}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 113 and name HG2 ))
3.400 1.500 1.500 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.25244E-02 ppm1 7.552 ppm2 1.925 CV 1
OR { 1065}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 113 and name HG3 ))
ASSI { 1068}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 112 and name H ))
3.100 1.200 1.200 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.13040E-02 ppm1 7.552 ppm2 8.534 CV 1
ASSI { 1069}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 114 and name H ))
2.800 1.000 1.000 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.18473E-02 ppm1 7.554 ppm2 8.107 CV 1
ASSI { 1071}
(( segid " " and resid 114 and name H ))
(( segid " " and resid 111 and name HA ))
3.300 1.300 1.300 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.93804E-03 ppm1 8.100 ppm2 3.999 CV 1
ASSI { 1072}
(( segid " " and resid 114 and name H ))
(( segid " " and resid 114 and name HA ))
3.300 1.300 1.300 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.78877E-03 ppm1 8.102 ppm2 3.865 CV 1
ASSI { 1075}
(( segid " " and resid 114 and name H ))
(( segid " " and resid 115 and name H ))
3.100 1.200 1.200 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.10596E-02 ppm1 8.099 ppm2 8.557 CV 1
ASSI { 1076}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 115 and name HA ))
3.200 1.300 1.300 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.72814E-03 ppm1 8.555 ppm2 3.347 CV 1
ASSI { 1085}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 112 and name HA ))
4.000 2.000 2.000 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.11893E-02 ppm1 8.125 ppm2 4.063 CV 1
ASSI { 1086}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 115 and name HA ))
3.700 1.700 1.700 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.45584E-03 ppm1 8.118 ppm2 3.354 CV 1
ASSI { 1087}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 116 and name HB2 ))
2.700 0.900 0.900 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.22220E-02 ppm1 8.115 ppm2 2.810 CV 1
ASSI { 1088}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 116 and name HB3 ))
2.700 0.900 0.900 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.20631E-02 ppm1 8.114 ppm2 2.673 CV 1
ASSI { 1094}
(( segid " " and resid 116 and name H ))
( segid " " and resid 115 and name HG1%)
4.000 2.000 2.000 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.14001E-02 ppm1 8.113 ppm2 1.137 CV 1
ASSI { 1095}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 117 and name H ))
2.900 1.000 1.000 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.12701E-02 ppm1 8.113 ppm2 7.541 CV 1
ASSI { 1096}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 115 and name H ))
2.900 1.000 1.000 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.13394E-02 ppm1 8.115 ppm2 8.561 CV 1
ASSI { 1099}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 116 and name HB2 ))
4.100 2.100 1.900 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.87505E-03 ppm1 7.535 ppm2 2.793 CV 1
ASSI { 1100}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 116 and name HB3 ))
3.100 1.200 1.200 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.82829E-03 ppm1 7.540 ppm2 2.690 CV 1
ASSI { 1103}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 114 and name HG12))
4.100 2.100 1.900 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.77800E-03 ppm1 7.537 ppm2 1.217 CV 1
ASSI { 1108}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 117 and name HD3 ))
3.500 1.600 1.600 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.15545E-02 ppm1 7.537 ppm2 0.596 CV 1
ASSI { 1113}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 118 and name H ))
2.900 1.100 1.100 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.11516E-02 ppm1 7.542 ppm2 8.406 CV 1
ASSI { 1114}
(( segid " " and resid 118 and name H ))
(( segid " " and resid 117 and name HA ))
3.600 1.600 1.600 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.75555E-03 ppm1 8.412 ppm2 4.048 CV 1
ASSI { 1115}
(( segid " " and resid 118 and name H ))
(( segid " " and resid 118 and name HA ))
3.400 1.400 1.400 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.51601E-03 ppm1 8.408 ppm2 3.660 CV 1
ASSI { 1123}
(( segid " " and resid 118 and name H ))
(( segid " " and resid 119 and name H ))
2.900 1.000 1.000 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.10987E-02 ppm1 8.400 ppm2 7.881 CV 1
ASSI { 1126}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 119 and name HA ))
2.800 1.000 1.000 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.21120E-02 ppm1 7.883 ppm2 4.152 CV 1
ASSI { 1127}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 118 and name HB2 ))
3.200 1.300 1.300 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.10266E-02 ppm1 7.889 ppm2 2.010 CV 1
ASSI { 1128}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 119 and name HB2 ))
2.400 0.700 0.700 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.31758E-02 ppm1 7.892 ppm2 1.764 CV 1
ASSI { 1134}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 120 and name H ))
2.600 0.900 0.900 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.25114E-02 ppm1 7.883 ppm2 8.151 CV 1
ASSI { 1135}
(( segid " " and resid 120 and name H ))
(( segid " " and resid 120 and name HA ))
2.700 0.900 0.900 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.40343E-02 ppm1 8.157 ppm2 4.052 CV 1
ASSI { 1136}
(( segid " " and resid 120 and name H ))
(( segid " " and resid 119 and name HB2 ))
2.900 1.000 1.000 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.21270E-02 ppm1 8.153 ppm2 1.748 CV 1
ASSI { 1137}
(( segid " " and resid 120 and name H ))
( segid " " and resid 120 and name HB% )
2.400 0.700 0.700 peak 1137 spectrum 1 weight 0.10000E+01 volume 0.65267E-02 ppm1 8.155 ppm2 1.456 CV 1
ASSI { 1138}
(( segid " " and resid 120 and name H ))
( segid " " and resid 71 and name HG2%)
4.100 2.100 1.900 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.51568E-03 ppm1 8.158 ppm2 1.200 CV 1
ASSI { 1139}
(( segid " " and resid 120 and name H ))
(( segid " " and resid 123 and name HB2 ))
4.100 2.100 1.900 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.59717E-03 ppm1 8.150 ppm2 1.049 CV 1
ASSI { 1143}
(( segid " " and resid 120 and name H ))
(( segid " " and resid 118 and name H ))
3.600 1.600 1.600 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.81636E-03 ppm1 8.157 ppm2 8.399 CV 1
ASSI { 1145}
(( segid " " and resid 121 and name H ))
(( segid " " and resid 120 and name HA ))
3.100 1.200 1.200 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.22074E-02 ppm1 8.145 ppm2 4.051 CV 1
ASSI { 1146}
(( segid " " and resid 121 and name H ))
(( segid " " and resid 121 and name HG ))
2.300 0.700 0.700 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.37957E-02 ppm1 8.147 ppm2 1.545 CV 1
ASSI { 1148}
(( segid " " and resid 121 and name H ))
( segid " " and resid 121 and name HD1%)
3.100 1.200 1.200 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.32232E-02 ppm1 8.146 ppm2 0.705 CV 1
ASSI { 1149}
(( segid " " and resid 121 and name H ))
( segid " " and resid 121 and name HD2%)
2.800 1.000 1.000 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.31819E-02 ppm1 8.144 ppm2 0.615 CV 1
ASSI { 1150}
(( segid " " and resid 121 and name H ))
(( segid " " and resid 122 and name H ))
2.700 0.900 0.900 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.18997E-02 ppm1 8.144 ppm2 7.842 CV 1
ASSI { 1151}
(( segid " " and resid 122 and name H ))
(( segid " " and resid 122 and name HA2 ))
2.200 0.600 0.600 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.69754E-02 ppm1 7.836 ppm2 4.005 CV 1
ASSI { 1153}
(( segid " " and resid 122 and name H ))
( segid " " and resid 121 and name HD1%)
3.900 1.900 1.900 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.17456E-02 ppm1 7.837 ppm2 0.708 CV 1
ASSI { 1155}
(( segid " " and resid 122 and name H ))
(( segid " " and resid 123 and name H ))
2.700 0.900 0.900 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.20716E-02 ppm1 7.838 ppm2 7.573 CV 1
ASSI { 1156}
(( segid " " and resid 122 and name H ))
(( segid " " and resid 124 and name H ))
4.000 2.000 2.000 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.90268E-03 ppm1 7.837 ppm2 6.796 CV 1
ASSI { 1160}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 122 and name HA3 ))
3.900 1.900 1.900 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.77283E-03 ppm1 7.582 ppm2 3.808 CV 1
ASSI { 1162}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 123 and name HG ))
2.900 1.000 1.000 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.14471E-02 ppm1 7.573 ppm2 1.370 CV 1
ASSI { 1163}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 123 and name HB2 ))
2.700 0.900 0.900 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.94569E-03 ppm1 7.575 ppm2 1.057 CV 1
ASSI { 1164}
(( segid " " and resid 123 and name H ))
( segid " " and resid 130 and name HD2%)
4.600 2.600 1.400 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.10369E-02 ppm1 7.585 ppm2 0.887 CV 1
ASSI { 1166}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 123 and name HB3 ))
3.300 1.400 1.400 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.30523E-02 ppm1 7.578 ppm2 0.628 CV 1
OR { 1166}
(( segid " " and resid 123 and name H ))
( segid " " and resid 123 and name HD2%)
ASSI { 1172}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 124 and name HA ))
2.900 1.100 1.100 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.19917E-02 ppm1 6.797 ppm2 4.276 CV 1
ASSI { 1173}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 119 and name HA ))
3.000 1.100 1.100 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.15647E-02 ppm1 6.799 ppm2 4.156 CV 1
ASSI { 1177}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 123 and name HG ))
4.300 2.400 1.700 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.77271E-03 ppm1 6.795 ppm2 1.366 CV 1
ASSI { 1178}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 123 and name HB2 ))
3.400 1.500 1.500 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.87904E-03 ppm1 6.796 ppm2 1.040 CV 1
ASSI { 1179}
(( segid " " and resid 124 and name H ))
( segid " " and resid 130 and name HD2%)
4.400 2.400 1.600 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.14534E-02 ppm1 6.800 ppm2 0.894 CV 1
ASSI { 1181}
(( segid " " and resid 124 and name H ))
( segid " " and resid 118 and name HD2%)
3.600 1.600 1.600 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.24559E-02 ppm1 6.796 ppm2 0.716 CV 1
ASSI { 1182}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 123 and name HB3 ))
2.900 1.100 1.100 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.35372E-02 ppm1 6.798 ppm2 0.597 CV 1
ASSI { 1183}
(( segid " " and resid 124 and name H ))
( segid " " and resid 124 and name HG1%)
2.400 0.700 0.700 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.35692E-02 ppm1 6.798 ppm2 0.527 CV 1
ASSI { 1186}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 123 and name H ))
2.600 0.800 0.800 peak 1186 spectrum 1 weight 0.10000E+01 volume 0.29601E-02 ppm1 6.799 ppm2 7.573 CV 1
ASSI { 1189}
(( segid " " and resid 125 and name H ))
(( segid " " and resid 124 and name HB ))
3.500 1.500 1.500 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.24898E-02 ppm1 8.865 ppm2 1.898 CV 1
ASSI { 1191}
(( segid " " and resid 125 and name H ))
( segid " " and resid 130 and name HD2%)
4.900 3.000 1.100 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.99683E-03 ppm1 8.865 ppm2 0.888 CV 1
ASSI { 1194}
(( segid " " and resid 125 and name H ))
(( segid " " and resid 126 and name H ))
2.300 0.600 0.600 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.40080E-02 ppm1 8.864 ppm2 7.633 CV 1
ASSI { 1195}
(( segid " " and resid 125 and name H ))
(( segid " " and resid 124 and name H ))
4.100 2.100 1.900 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.63250E-03 ppm1 8.864 ppm2 6.806 CV 1
ASSI { 1196}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 126 and name HA ))
2.800 1.000 1.000 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.15682E-02 ppm1 7.633 ppm2 4.572 CV 1
ASSI { 1198}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 129 and name HG2 ))
3.200 1.300 1.300 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.14328E-02 ppm1 7.633 ppm2 2.381 CV 1
OR { 1198}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 129 and name HG3 ))
ASSI { 1202}
(( segid " " and resid 126 and name H ))
( segid " " and resid 130 and name HD2%)
5.100 3.200 0.900 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.71368E-03 ppm1 7.632 ppm2 0.890 CV 1
ASSI { 1204}
(( segid " " and resid 126 and name H ))
( segid " " and resid 119 and name HD1%)
3.800 1.800 1.800 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.11075E-02 ppm1 7.632 ppm2 0.642 CV 1
ASSI { 1205}
(( segid " " and resid 126 and name H ))
( segid " " and resid 124 and name HG1%)
4.200 2.200 1.800 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.11098E-02 ppm1 7.633 ppm2 0.525 CV 1
ASSI { 1206}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 127 and name H ))
3.900 1.900 1.900 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.77532E-03 ppm1 7.634 ppm2 9.023 CV 1
ASSI { 1208}
(( segid " " and resid 127 and name H ))
(( segid " " and resid 126 and name HG2 ))
4.700 2.700 1.300 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.65961E-03 ppm1 9.027 ppm2 2.298 CV 1
ASSI { 1209}
(( segid " " and resid 127 and name H ))
(( segid " " and resid 126 and name HA ))
3.000 1.100 1.100 peak 1209 spectrum 1 weight 0.10000E+01 volume 0.99562E-03 ppm1 9.028 ppm2 4.565 CV 1
ASSI { 1210}
(( segid " " and resid 127 and name H ))
(( segid " " and resid 126 and name HB2 ))
3.400 1.500 1.500 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.98047E-03 ppm1 9.038 ppm2 2.209 CV 1
OR { 1210}
(( segid " " and resid 127 and name H ))
(( segid " " and resid 126 and name HG3 ))
ASSI { 1211}
(( segid " " and resid 127 and name H ))
(( segid " " and resid 127 and name HB2 ))
2.700 0.900 0.900 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 9.030 ppm2 1.863 CV 1
OR { 1211}
(( segid " " and resid 127 and name H ))
(( segid " " and resid 127 and name HB3 ))
ASSI { 1212}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 128 and name HA ))
3.000 1.100 1.100 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.17761E-02 ppm1 8.613 ppm2 4.049 CV 1
ASSI { 1213}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 128 and name HD3 ))
4.300 2.300 1.700 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.68844E-03 ppm1 8.612 ppm2 3.207 CV 1
OR { 1213}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 128 and name HD2 ))
ASSI { 1215}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 128 and name HG3 ))
3.100 1.200 1.200 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.22417E-02 ppm1 8.614 ppm2 1.601 CV 1
OR { 1215}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 128 and name HG2 ))
ASSI { 1216}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 129 and name H ))
3.000 1.100 1.100 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.12864E-02 ppm1 8.613 ppm2 7.788 CV 1
ASSI { 1217}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 127 and name H ))
3.700 1.700 1.700 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.34396E-03 ppm1 8.611 ppm2 9.027 CV 1
ASSI { 1218}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 129 and name HA ))
2.800 1.000 1.000 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.26365E-02 ppm1 7.793 ppm2 4.152 CV 1
ASSI { 1219}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 128 and name HA ))
3.000 1.100 1.100 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.18279E-02 ppm1 7.789 ppm2 4.054 CV 1
ASSI { 1220}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 127 and name HA ))
3.600 1.700 1.700 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.57152E-03 ppm1 7.791 ppm2 3.742 CV 1
ASSI { 1221}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 129 and name HG2 ))
2.400 0.700 0.700 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.43209E-02 ppm1 7.791 ppm2 2.390 CV 1
OR { 1221}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 129 and name HG3 ))
ASSI { 1227}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 129 and name HA ))
3.000 1.100 1.100 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.18405E-02 ppm1 7.762 ppm2 4.157 CV 1
ASSI { 1228}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 128 and name HA ))
3.300 1.300 1.300 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.12096E-02 ppm1 7.761 ppm2 4.057 CV 1
ASSI { 1229}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 129 and name HG3 ))
2.800 1.000 1.000 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.14517E-02 ppm1 7.760 ppm2 2.404 CV 1
OR { 1229}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 129 and name HG2 ))
ASSI { 1232}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 130 and name HG ))
2.500 0.800 0.800 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.59603E-02 ppm1 7.763 ppm2 1.664 CV 1
OR { 1232}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 130 and name HB3 ))
ASSI { 1233}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 130 and name HB2 ))
2.500 0.800 0.800 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.29308E-02 ppm1 7.763 ppm2 1.417 CV 1
ASSI { 1234}
(( segid " " and resid 130 and name H ))
( segid " " and resid 130 and name HD2%)
2.100 0.600 0.600 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.49885E-02 ppm1 7.763 ppm2 0.949 CV 1
OR { 1234}
(( segid " " and resid 130 and name H ))
( segid " " and resid 130 and name HD1%)
ASSI { 1235}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 130 and name HA ))
2.700 0.900 0.900 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.24632E-02 ppm1 7.765 ppm2 4.299 CV 1
ASSI { 1236}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 131 and name H ))
2.400 0.700 0.700 peak 1236 spectrum 1 weight 0.10000E+01 volume 0.40749E-02 ppm1 7.763 ppm2 7.419 CV 1
ASSI { 1238}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 128 and name HA ))
3.800 1.800 1.800 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.68843E-03 ppm1 7.430 ppm2 4.049 CV 1
ASSI { 1240}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 131 and name HA ))
3.100 1.200 1.200 peak 1240 spectrum 1 weight 0.10000E+01 volume 0.17208E-02 ppm1 7.417 ppm2 4.745 CV 1
ASSI { 1241}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 130 and name HA ))
3.300 1.300 1.300 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.11566E-02 ppm1 7.416 ppm2 4.302 CV 1
ASSI { 1242}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 129 and name HA ))
3.400 1.500 1.500 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.82980E-03 ppm1 7.420 ppm2 4.147 CV 1
ASSI { 1244}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 131 and name HB3 ))
3.900 1.900 1.900 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.18605E-02 ppm1 7.421 ppm2 3.283 CV 1
ASSI { 1245}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 131 and name HB2 ))
2.900 1.000 1.000 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.18206E-02 ppm1 7.418 ppm2 2.832 CV 1
ASSI { 1247}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 130 and name HB3 ))
3.600 1.700 1.700 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.16136E-02 ppm1 7.417 ppm2 1.678 CV 1
OR { 1247}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 130 and name HG ))
ASSI { 1248}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 130 and name HB2 ))
3.500 1.600 1.600 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.79024E-03 ppm1 7.417 ppm2 1.408 CV 1
ASSI { 1250}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 132 and name H ))
3.400 1.400 1.400 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.26556E-02 ppm1 7.421 ppm2 7.867 CV 1
ASSI { 1259}
(( segid " " and resid 134 and name H ))
(( segid " " and resid 133 and name HG3 ))
2.900 1.100 1.100 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.25918E-02 ppm1 8.532 ppm2 1.480 CV 1
OR { 1259}
(( segid " " and resid 134 and name H ))
(( segid " " and resid 133 and name HG2 ))
ASSI { 1262}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 135 and name HG2 ))
3.300 1.400 1.400 peak 1262 spectrum 1 weight 0.10000E+01 volume 0.10257E-02 ppm1 8.525 ppm2 2.394 CV 1
OR { 1262}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 135 and name HG3 ))
ASSI { 1263}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 135 and name HB3 ))
3.400 1.400 1.400 peak 1263 spectrum 1 weight 0.10000E+01 volume 0.20054E-02 ppm1 8.523 ppm2 2.090 CV 1
ASSI { 1264}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 135 and name HB2 ))
2.900 1.100 1.100 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.25552E-02 ppm1 8.524 ppm2 2.004 CV 1
ASSI { 1265}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 133 and name HB3 ))
3.100 3.100 2.900 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.19766E-02 ppm1 8.525 ppm2 1.898 CV 1
ASSI { 1267}
(( segid " " and resid 135 and name HE22))
(( segid " " and resid 135 and name HG2 ))
3.800 1.900 1.900 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.13992E-02 ppm1 6.937 ppm2 2.394 CV 1
OR { 1267}
(( segid " " and resid 135 and name HE22))
(( segid " " and resid 135 and name HG3 ))
ASSI { 1269}
(( segid " " and resid 135 and name HE21))
(( segid " " and resid 135 and name HA ))
3.900 1.900 1.900 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.10539E-02 ppm1 7.612 ppm2 4.358 CV 1
ASSI { 1270}
(( segid " " and resid 135 and name HE21))
(( segid " " and resid 135 and name HG2 ))
2.700 0.900 0.900 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.35319E-02 ppm1 7.610 ppm2 2.395 CV 1
OR { 1270}
(( segid " " and resid 135 and name HE21))
(( segid " " and resid 135 and name HG3 ))
ASSI { 1272}
(( segid " " and resid 135 and name HE21))
(( segid " " and resid 129 and name HB2 ))
2.600 2.600 3.400 peak 1272 spectrum 1 weight 0.10000E+01 volume 0.58775E-03 ppm1 7.610 ppm2 2.133 CV 1
ASSI { 1273}
(( segid " " and resid 135 and name HE21))
(( segid " " and resid 135 and name HE22))
1.400 0.200 0.800 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.67498E-01 ppm1 7.610 ppm2 6.935 CV 1
ASSI { 1275}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 135 and name HG3 ))
4.900 3.000 1.100 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.42828E-03 ppm1 8.455 ppm2 2.395 CV 1
OR { 1275}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 135 and name HG2 ))
ASSI { 1276}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 135 and name HB3 ))
3.500 1.500 1.500 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.80949E-03 ppm1 8.460 ppm2 2.090 CV 1
ASSI { 1277}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 135 and name HB2 ))
3.300 1.400 1.400 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.10265E-02 ppm1 8.460 ppm2 2.016 CV 1
ASSI { 1278}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 136 and name HB3 ))
2.600 0.900 0.900 peak 1278 spectrum 1 weight 0.10000E+01 volume 0.42485E-02 ppm1 8.454 ppm2 1.771 CV 1
OR { 1278}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 136 and name HB2 ))
ASSI { 1279}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 136 and name HG3 ))
3.200 1.300 1.300 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.11114E-02 ppm1 8.455 ppm2 1.454 CV 1
OR { 1279}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 136 and name HG2 ))
ASSI { 1283}
(( segid " " and resid 138 and name H ))
(( segid " " and resid 137 and name HA ))
1.900 0.500 0.500 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.21460E-01 ppm1 8.366 ppm2 4.316 CV 1
ASSI { 1284}
(( segid " " and resid 138 and name H ))
(( segid " " and resid 138 and name HB2 ))
2.200 0.600 0.600 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.10944E-01 ppm1 8.366 ppm2 1.657 CV 1
OR { 1284}
(( segid " " and resid 138 and name H ))
(( segid " " and resid 138 and name HB3 ))
ASSI { 1285}
(( segid " " and resid 138 and name H ))
( segid " " and resid 138 and name HD1%)
4.300 2.300 1.700 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.13760E-02 ppm1 8.365 ppm2 0.926 CV 1
OR { 1285}
(( segid " " and resid 138 and name H ))
( segid " " and resid 138 and name HD2%)
ASSI { 1286}
(( segid " " and resid 138 and name H ))
( segid " " and resid 138 and name HD1%)
5.000 3.100 1.000 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.54420E-03 ppm1 8.362 ppm2 0.879 CV 1
ASSI { 1288}
(( segid " " and resid 139 and name H ))
( segid " " and resid 139 and name HB% )
2.700 0.900 0.900 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.41030E-02 ppm1 8.369 ppm2 1.442 CV 1
ASSI { 1289}
(( segid " " and resid 140 and name H ))
(( segid " " and resid 140 and name HA ))
3.100 1.200 1.200 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.16829E-02 ppm1 8.292 ppm2 4.457 CV 1
ASSI { 1290}
(( segid " " and resid 140 and name H ))
(( segid " " and resid 140 and name HB2 ))
3.400 1.400 1.400 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.12000E-02 ppm1 8.292 ppm2 3.945 CV 1
OR { 1290}
(( segid " " and resid 140 and name H ))
(( segid " " and resid 140 and name HB3 ))
ASSI { 1291}
(( segid " " and resid 140 and name H ))
( segid " " and resid 139 and name HB% )
4.500 2.500 1.500 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.64474E-03 ppm1 8.292 ppm2 1.485 CV 1
ASSI { 1292}
(( segid " " and resid 140 and name H ))
(( segid " " and resid 139 and name HA ))
2.700 0.900 0.900 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.31336E-02 ppm1 8.288 ppm2 4.385 CV 1
ASSI { 1294}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 139 and name HA ))
2.600 2.600 3.400 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.60687E-03 ppm1 7.979 ppm2 4.387 CV 1
ASSI { 1295}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 141 and name HA ))
3.600 1.600 1.600 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.77539E-03 ppm1 7.978 ppm2 4.312 CV 1
ASSI { 1297}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 129 and name HG2 ))
2.500 2.500 3.500 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.74496E-03 ppm1 7.993 ppm2 2.378 CV 1
OR { 1297}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 129 and name HG3 ))
ASSI { 1300}
(( segid " " and resid 24 and name HD22))
(( segid " " and resid 24 and name HD21))
2.000 0.500 0.500 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.42634E-02 ppm1 7.486 ppm2 8.115 CV 1
ASSI { 1302}
(( segid " " and resid 24 and name HD22))
(( segid " " and resid 24 and name HB2 ))
4.100 2.100 1.900 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.12753E-02 ppm1 7.488 ppm2 2.539 CV 1
OR { 1302}
(( segid " " and resid 24 and name HD22))
(( segid " " and resid 24 and name HB3 ))
ASSI { 1303}
(( segid " " and resid 24 and name HD21))
(( segid " " and resid 24 and name HB2 ))
2.600 0.800 0.800 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.13818E-02 ppm1 8.117 ppm2 2.514 CV 1
ASSI { 1306}
(( segid " " and resid 80 and name HE22))
(( segid " " and resid 80 and name HB3 ))
4.400 2.400 1.600 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.94270E-03 ppm1 6.603 ppm2 2.550 CV 1
ASSI { 1307}
(( segid " " and resid 80 and name HE22))
(( segid " " and resid 80 and name HE21))
2.200 0.600 0.600 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.30506E-02 ppm1 6.605 ppm2 7.459 CV 1
ASSI { 1310}
(( segid " " and resid 80 and name HE21))
(( segid " " and resid 80 and name HB3 ))
3.700 1.800 1.800 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.85268E-03 ppm1 7.464 ppm2 2.586 CV 1
ASSI { 1311}
(( segid " " and resid 92 and name HE ))
(( segid " " and resid 92 and name HB3 ))
4.400 2.400 1.600 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.50833E-03 ppm1 7.320 ppm2 1.094 CV 1
ASSI { 1312}
(( segid " " and resid 92 and name HE ))
(( segid " " and resid 92 and name HG2 ))
3.500 1.500 1.500 peak 1312 spectrum 1 weight 0.10000E+01 volume 0.87977E-03 ppm1 7.318 ppm2 1.284 CV 1
ASSI { 1313}
(( segid " " and resid 92 and name HE ))
(( segid " " and resid 92 and name HG3 ))
3.000 1.200 1.200 peak 1313 spectrum 1 weight 0.10000E+01 volume 0.13359E-02 ppm1 7.319 ppm2 1.527 CV 1
OR { 1313}
(( segid " " and resid 92 and name HE ))
(( segid " " and resid 92 and name HB2 ))
ASSI { 1314}
(( segid " " and resid 92 and name HE ))
(( segid " " and resid 92 and name HD3 ))
3.100 1.200 1.200 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.13211E-02 ppm1 7.321 ppm2 3.032 CV 1
ASSI { 1315}
(( segid " " and resid 92 and name HE ))
(( segid " " and resid 92 and name HD2 ))
3.000 1.100 1.100 peak 1315 spectrum 1 weight 0.10000E+01 volume 0.16898E-02 ppm1 7.318 ppm2 2.924 CV 1
ASSI { 1316}
(( segid " " and resid 45 and name HE ))
(( segid " " and resid 53 and name HD2 ))
3.600 1.600 1.600 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.15476E-02 ppm1 7.114 ppm2 5.807 CV 1
ASSI { 1319}
(( segid " " and resid 45 and name HE ))
( segid " " and resid 43 and name HG2%)
4.000 2.000 2.000 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.99241E-03 ppm1 7.108 ppm2 0.736 CV 1
OR { 1319}
(( segid " " and resid 45 and name HE ))
( segid " " and resid 43 and name HG1%)
ASSI { 1321}
(( segid " " and resid 45 and name HE ))
(( segid " " and resid 45 and name HB3 ))
3.400 1.400 1.400 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.83989E-03 ppm1 7.117 ppm2 1.707 CV 1
OR { 1321}
(( segid " " and resid 45 and name HE ))
(( segid " " and resid 45 and name HB2 ))
ASSI { 1322}
(( segid " " and resid 45 and name HE ))
(( segid " " and resid 45 and name HG3 ))
3.600 1.600 1.600 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.67083E-03 ppm1 7.112 ppm2 1.349 CV 1
ASSI { 1324}
(( segid " " and resid 111 and name HE ))
(( segid " " and resid 111 and name HD3 ))
2.500 0.800 0.800 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 7.416 ppm2 3.241 CV 1
ASSI { 1325}
(( segid " " and resid 111 and name HE ))
(( segid " " and resid 111 and name HG3 ))
3.000 1.100 1.100 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.12016E-02 ppm1 7.411 ppm2 1.675 CV 1
ASSI { 1326}
(( segid " " and resid 111 and name HE ))
(( segid " " and resid 101 and name HB ))
2.400 2.400 3.600 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.82410E-03 ppm1 7.420 ppm2 2.020 CV 1
ASSI { 1329}
(( segid " " and resid 109 and name HE ))
(( segid " " and resid 109 and name HG3 ))
3.900 1.900 1.900 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.61178E-03 ppm1 6.513 ppm2 1.452 CV 1
OR { 1329}
(( segid " " and resid 109 and name HE ))
(( segid " " and resid 109 and name HB3 ))
ASSI { 1330}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HD2 ))
4.400 2.400 1.600 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.37733E-03 ppm1 8.365 ppm2 3.215 CV 1
OR { 1330}
(( segid " " and resid 68 and name H ))
(( segid " " and resid 68 and name HD3 ))
ASSI { 1}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 21 and name H ))
4.500 2.600 1.500 peak 1 spectrum 1 weight 0.10000E+01 volume 0.80816E-03 ppm1 1.036 ppm2 8.935 CV 1
ASSI { 2}
(( segid " " and resid 82 and name HB3 ))
(( segid " " and resid 85 and name HE22))
6.000 4.600 0.000 peak 2 spectrum 1 weight 0.10000E+01 volume 0.24503E-03 ppm1 1.683 ppm2 7.215 CV 1
ASSI { 2}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 73 and name HG12))
2.700 0.900 0.900 peak 2 spectrum 1 weight 0.10000E+01 volume 0.55594E-02 ppm1 1.774 ppm2 1.139 CV 1
ASSI { 3}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 6 and name HB% )
2.100 0.500 0.500 peak 3 spectrum 1 weight 0.10000E+01 volume 0.16741E-01 ppm1 4.562 ppm2 1.341 CV 1
ASSI { 6}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 131 and name HB3 ))
2.700 0.900 0.900 peak 6 spectrum 1 weight 0.10000E+01 volume 0.34226E-02 ppm1 7.123 ppm2 3.280 CV 1
ASSI { 7}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 131 and name HB2 ))
2.800 1.000 1.000 peak 7 spectrum 1 weight 0.10000E+01 volume 0.28632E-02 ppm1 7.123 ppm2 2.826 CV 1
ASSI { 11}
(( segid " " and resid 141 and name HB3 ))
(( segid " " and resid 141 and name H ))
3.800 1.800 1.800 peak 11 spectrum 1 weight 0.10000E+01 volume 0.66509E-03 ppm1 3.878 ppm2 7.976 CV 1
OR { 11}
(( segid " " and resid 141 and name HB2 ))
(( segid " " and resid 141 and name H ))
ASSI { 12}
(( segid " " and resid 141 and name HA ))
(( segid " " and resid 141 and name HB3 ))
3.000 1.200 1.200 peak 12 spectrum 1 weight 0.10000E+01 volume 0.23279E-02 ppm1 4.290 ppm2 3.868 CV 1
OR { 12}
(( segid " " and resid 141 and name HA ))
(( segid " " and resid 141 and name HB2 ))
ASSI { 14}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HG12))
3.000 1.100 1.100 peak 14 spectrum 1 weight 0.10000E+01 volume 0.11857E-02 ppm1 3.870 ppm2 1.246 CV 1
ASSI { 15}
(( segid " " and resid 114 and name HA ))
( segid " " and resid 114 and name HG2%)
2.600 0.900 0.900 peak 15 spectrum 1 weight 0.10000E+01 volume 0.43483E-02 ppm1 3.872 ppm2 0.951 CV 1
OR { 15}
(( segid " " and resid 114 and name HA ))
( segid " " and resid 114 and name HD1%)
ASSI { 18}
(( segid " " and resid 141 and name HB2 ))
( segid " " and resid 125 and name HB% )
2.200 0.600 0.600 peak 18 spectrum 1 weight 0.10000E+01 volume 0.13981E-02 ppm1 3.874 ppm2 1.433 CV 1
OR { 18}
(( segid " " and resid 141 and name HB3 ))
( segid " " and resid 125 and name HB% )
ASSI { 20}
(( segid " " and resid 140 and name HA ))
(( segid " " and resid 141 and name H ))
2.800 1.000 1.000 peak 20 spectrum 1 weight 0.10000E+01 volume 0.22213E-02 ppm1 4.489 ppm2 7.976 CV 1
ASSI { 21}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name H ))
3.000 1.200 1.200 peak 21 spectrum 1 weight 0.10000E+01 volume 0.13253E-02 ppm1 3.956 ppm2 8.282 CV 1
ASSI { 22}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name H ))
2.700 0.900 0.900 peak 22 spectrum 1 weight 0.10000E+01 volume 0.17583E-02 ppm1 3.959 ppm2 8.661 CV 1
ASSI { 23}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 66 and name HD% )
2.500 0.800 0.800 peak 23 spectrum 1 weight 0.10000E+01 volume 0.25923E-02 ppm1 3.956 ppm2 7.292 CV 1
ASSI { 24}
(( segid " " and resid 140 and name HB2 ))
(( segid " " and resid 140 and name HA ))
2.800 1.000 1.000 peak 24 spectrum 1 weight 0.10000E+01 volume 0.32627E-02 ppm1 3.924 ppm2 4.486 CV 1
OR { 24}
(( segid " " and resid 140 and name HB3 ))
(( segid " " and resid 140 and name HA ))
ASSI { 26}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 44 and name HA ))
2.500 2.500 3.500 peak 26 spectrum 1 weight 0.10000E+01 volume 0.70939E-02 ppm1 3.935 ppm2 4.392 CV 1
ASSI { 27}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 44 and name HA ))
2.600 0.800 0.800 peak 27 spectrum 1 weight 0.10000E+01 volume 0.65412E-02 ppm1 3.879 ppm2 4.391 CV 1
ASSI { 29}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HG2%)
2.200 0.600 0.600 peak 29 spectrum 1 weight 0.10000E+01 volume 0.13839E-01 ppm1 3.955 ppm2 0.950 CV 1
OR { 29}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HG1%)
ASSI { 34}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 50 and name HD1%)
2.400 0.700 0.700 peak 34 spectrum 1 weight 0.10000E+01 volume 0.78958E-02 ppm1 3.780 ppm2 0.911 CV 1
OR { 34}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 50 and name HG2%)
ASSI { 36}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HG13))
2.600 0.800 0.800 peak 36 spectrum 1 weight 0.10000E+01 volume 0.23396E-02 ppm1 3.781 ppm2 1.602 CV 1
OR { 36}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HG12))
ASSI { 37}
(( segid " " and resid 139 and name HA ))
( segid " " and resid 139 and name HB% )
2.600 0.800 0.800 peak 37 spectrum 1 weight 0.10000E+01 volume 0.51161E-02 ppm1 4.369 ppm2 1.438 CV 1
ASSI { 38}
(( segid " " and resid 139 and name HA ))
(( segid " " and resid 139 and name H ))
3.800 1.800 1.800 peak 38 spectrum 1 weight 0.10000E+01 volume 0.50048E-03 ppm1 4.379 ppm2 8.364 CV 1
ASSI { 40}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 20 and name H ))
4.100 2.100 1.900 peak 40 spectrum 1 weight 0.10000E+01 volume 0.86701E-03 ppm1 1.431 ppm2 8.665 CV 1
ASSI { 42}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 24 and name HD22))
2.900 1.100 1.100 peak 42 spectrum 1 weight 0.10000E+01 volume 0.43147E-02 ppm1 1.431 ppm2 7.484 CV 1
ASSI { 43}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 24 and name H ))
2.700 0.900 0.900 peak 43 spectrum 1 weight 0.10000E+01 volume 0.40964E-02 ppm1 1.432 ppm2 7.278 CV 1
ASSI { 44}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 20 and name HA ))
2.300 0.700 0.700 peak 44 spectrum 1 weight 0.10000E+01 volume 0.83299E-02 ppm1 1.433 ppm2 3.965 CV 1
ASSI { 45}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 23 and name HA ))
2.100 0.600 0.600 peak 45 spectrum 1 weight 0.10000E+01 volume 0.15661E-01 ppm1 1.431 ppm2 4.235 CV 1
ASSI { 52}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 86 and name H ))
3.200 1.300 1.300 peak 52 spectrum 1 weight 0.10000E+01 volume 0.15989E-02 ppm1 0.938 ppm2 8.357 CV 1
ASSI { 58}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name H ))
3.600 1.600 1.600 peak 58 spectrum 1 weight 0.10000E+01 volume 0.40222E-02 ppm1 0.947 ppm2 8.554 CV 1
ASSI { 60}
(( segid " " and resid 75 and name HG ))
(( segid " " and resid 76 and name H ))
3.900 1.900 1.900 peak 60 spectrum 1 weight 0.10000E+01 volume 0.21207E-02 ppm1 1.588 ppm2 8.621 CV 1
ASSI { 62}
( segid " " and resid 33 and name HG1%)
(( segid " " and resid 35 and name H ))
3.200 1.300 1.300 peak 62 spectrum 1 weight 0.10000E+01 volume 0.27658E-02 ppm1 0.934 ppm2 7.869 CV 1
ASSI { 65}
( segid " " and resid 59 and name HD2%)
(( segid " " and resid 59 and name H ))
3.400 1.500 1.500 peak 65 spectrum 1 weight 0.10000E+01 volume 0.33761E-02 ppm1 0.932 ppm2 7.663 CV 1
ASSI { 67}
( segid " " and resid 33 and name HG1%)
( segid " " and resid 66 and name HD% )
2.200 0.600 0.600 peak 67 spectrum 1 weight 0.10000E+01 volume 0.55190E-02 ppm1 0.938 ppm2 7.277 CV 1
ASSI { 69}
( segid " " and resid 33 and name HG1%)
( segid " " and resid 66 and name HE% )
2.900 1.000 1.000 peak 69 spectrum 1 weight 0.10000E+01 volume 0.57139E-02 ppm1 0.936 ppm2 7.100 CV 1
ASSI { 70}
( segid " " and resid 59 and name HD2%)
( segid " " and resid 21 and name HD% )
2.500 0.800 0.800 peak 70 spectrum 1 weight 0.10000E+01 volume 0.71908E-02 ppm1 0.932 ppm2 6.877 CV 1
OR { 70}
( segid " " and resid 59 and name HD2%)
( segid " " and resid 21 and name HE% )
ASSI { 71}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 76 and name HD1 ))
2.200 2.200 3.800 peak 71 spectrum 1 weight 0.10000E+01 volume 0.13089E-02 ppm1 0.889 ppm2 7.358 CV 1
OR { 71}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 76 and name HE3 ))
ASSI { 73}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 99 and name H ))
3.700 1.700 1.700 peak 73 spectrum 1 weight 0.10000E+01 volume 0.14693E-02 ppm1 0.891 ppm2 7.829 CV 1
ASSI { 76}
( segid " " and resid 98 and name HD1%)
( segid " " and resid 131 and name HE% )
4.300 2.300 1.700 peak 76 spectrum 1 weight 0.10000E+01 volume 0.13470E-02 ppm1 0.891 ppm2 6.743 CV 1
ASSI { 77}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 43 and name H ))
3.600 1.600 1.600 peak 77 spectrum 1 weight 0.10000E+01 volume 0.15514E-02 ppm1 0.946 ppm2 7.985 CV 1
ASSI { 80}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 40 and name H ))
3.300 1.400 1.400 peak 80 spectrum 1 weight 0.10000E+01 volume 0.29639E-02 ppm1 0.945 ppm2 7.868 CV 1
ASSI { 83}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 9 and name HZ3 ))
2.900 1.000 1.000 peak 83 spectrum 1 weight 0.10000E+01 volume 0.30253E-02 ppm1 0.945 ppm2 6.796 CV 1
ASSI { 84}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 9 and name HH2 ))
2.900 1.000 1.000 peak 84 spectrum 1 weight 0.10000E+01 volume 0.22434E-02 ppm1 0.945 ppm2 6.731 CV 1
ASSI { 88}
( segid " " and resid 138 and name HD2%)
(( segid " " and resid 138 and name HA ))
3.700 1.700 1.700 peak 88 spectrum 1 weight 0.10000E+01 volume 0.24172E-02 ppm1 0.941 ppm2 4.358 CV 1
ASSI { 89}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 75 and name HA ))
2.800 0.900 0.900 peak 89 spectrum 1 weight 0.10000E+01 volume 0.56619E-02 ppm1 0.887 ppm2 4.460 CV 1
ASSI { 90}
( segid " " and resid 138 and name HD1%)
(( segid " " and resid 138 and name HA ))
2.400 0.700 0.700 peak 90 spectrum 1 weight 0.10000E+01 volume 0.77011E-02 ppm1 0.887 ppm2 4.354 CV 1
ASSI { 91}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 19 and name HA ))
2.700 0.900 0.900 peak 91 spectrum 1 weight 0.10000E+01 volume 0.52305E-02 ppm1 0.947 ppm2 4.011 CV 1
ASSI { 92}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 17 and name HA ))
2.400 0.700 0.700 peak 92 spectrum 1 weight 0.10000E+01 volume 0.45631E-02 ppm1 0.989 ppm2 3.959 CV 1
ASSI { 96}
( segid " " and resid 33 and name HG1%)
(( segid " " and resid 33 and name HA ))
2.500 0.800 0.800 peak 96 spectrum 1 weight 0.10000E+01 volume 0.53113E-02 ppm1 0.939 ppm2 3.582 CV 1
ASSI { 97}
( segid " " and resid 59 and name HD2%)
(( segid " " and resid 18 and name HA ))
3.300 1.400 1.400 peak 97 spectrum 1 weight 0.10000E+01 volume 0.39769E-02 ppm1 0.932 ppm2 3.799 CV 1
ASSI { 99}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HA ))
3.400 1.400 1.400 peak 99 spectrum 1 weight 0.10000E+01 volume 0.44868E-02 ppm1 0.947 ppm2 3.728 CV 1
ASSI { 101}
(( segid " " and resid 75 and name HB3 ))
(( segid " " and resid 74 and name HA ))
4.400 2.400 1.600 peak 101 spectrum 1 weight 0.10000E+01 volume 0.11223E-02 ppm1 1.669 ppm2 4.099 CV 1
ASSI { 108}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 86 and name HD3 ))
2.800 1.000 1.000 peak 108 spectrum 1 weight 0.10000E+01 volume 0.20059E-02 ppm1 0.977 ppm2 3.239 CV 1
OR { 108}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 86 and name HD2 ))
ASSI { 111}
( segid " " and resid 33 and name HG1%)
(( segid " " and resid 51 and name HA ))
3.300 1.400 1.400 peak 111 spectrum 1 weight 0.10000E+01 volume 0.25667E-02 ppm1 0.936 ppm2 2.968 CV 1
ASSI { 112}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 86 and name HD3 ))
3.200 1.300 1.300 peak 112 spectrum 1 weight 0.10000E+01 volume 0.39053E-02 ppm1 0.937 ppm2 3.271 CV 1
OR { 112}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 86 and name HD2 ))
ASSI { 113}
( segid " " and resid 138 and name HD1%)
(( segid " " and resid 136 and name HE2 ))
3.300 1.300 1.300 peak 113 spectrum 1 weight 0.10000E+01 volume 0.13514E-02 ppm1 0.888 ppm2 3.012 CV 1
OR { 113}
( segid " " and resid 138 and name HD1%)
(( segid " " and resid 136 and name HE3 ))
ASSI { 116}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 129 and name HG2 ))
4.000 2.000 2.000 peak 116 spectrum 1 weight 0.10000E+01 volume 0.19678E-02 ppm1 1.590 ppm2 2.394 CV 1
OR { 116}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 129 and name HG3 ))
ASSI { 120}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 40 and name HG ))
2.000 0.500 0.500 peak 120 spectrum 1 weight 0.10000E+01 volume 0.21477E-01 ppm1 0.945 ppm2 1.903 CV 1
OR { 120}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 40 and name HB2 ))
ASSI { 121}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 114 and name HB ))
2.400 0.700 0.700 peak 121 spectrum 1 weight 0.10000E+01 volume 0.41298E-02 ppm1 0.893 ppm2 2.236 CV 1
ASSI { 124}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 82 and name HG ))
2.000 0.500 0.500 peak 124 spectrum 1 weight 0.10000E+01 volume 0.20810E-01 ppm1 0.942 ppm2 1.814 CV 1
ASSI { 128}
( segid " " and resid 59 and name HD2%)
(( segid " " and resid 59 and name HG ))
1.800 0.400 0.400 peak 128 spectrum 1 weight 0.10000E+01 volume 0.19362E-01 ppm1 0.932 ppm2 1.468 CV 1
ASSI { 129}
( segid " " and resid 130 and name HD2%)
(( segid " " and resid 127 and name HG2 ))
2.400 2.400 3.600 peak 129 spectrum 1 weight 0.10000E+01 volume 0.60925E-02 ppm1 0.888 ppm2 1.781 CV 1
ASSI { 130}
( segid " " and resid 130 and name HD2%)
(( segid " " and resid 129 and name HG3 ))
3.100 1.200 1.200 peak 130 spectrum 1 weight 0.10000E+01 volume 0.24574E-02 ppm1 0.889 ppm2 2.387 CV 1
ASSI { 131}
( segid " " and resid 138 and name HD1%)
(( segid " " and resid 126 and name HG2 ))
2.500 2.500 3.500 peak 131 spectrum 1 weight 0.10000E+01 volume 0.27870E-02 ppm1 0.890 ppm2 2.327 CV 1
ASSI { 132}
( segid " " and resid 130 and name HD2%)
(( segid " " and resid 115 and name HB ))
2.600 0.800 0.800 peak 132 spectrum 1 weight 0.10000E+01 volume 0.22257E-02 ppm1 0.889 ppm2 2.250 CV 1
ASSI { 134}
( segid " " and resid 130 and name HD2%)
( segid " " and resid 124 and name HG1%)
1.900 0.500 0.500 peak 134 spectrum 1 weight 0.10000E+01 volume 0.10670E-01 ppm1 0.931 ppm2 0.517 CV 1
ASSI { 136}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 85 and name HG2 ))
2.900 1.000 1.000 peak 136 spectrum 1 weight 0.10000E+01 volume 0.34095E-02 ppm1 0.941 ppm2 2.479 CV 1
ASSI { 137}
(( segid " " and resid 138 and name HA ))
( segid " " and resid 138 and name HD1%)
2.300 0.700 0.700 peak 137 spectrum 1 weight 0.10000E+01 volume 0.99121E-02 ppm1 4.356 ppm2 0.897 CV 1
OR { 137}
(( segid " " and resid 138 and name HA ))
( segid " " and resid 138 and name HD2%)
ASSI { 138}
(( segid " " and resid 138 and name HA ))
(( segid " " and resid 138 and name HB3 ))
2.100 0.600 0.600 peak 138 spectrum 1 weight 0.10000E+01 volume 0.15481E-01 ppm1 4.356 ppm2 1.628 CV 1
OR { 138}
(( segid " " and resid 138 and name HA ))
(( segid " " and resid 138 and name HB2 ))
OR { 138}
(( segid " " and resid 138 and name HA ))
(( segid " " and resid 138 and name HG ))
ASSI { 139}
(( segid " " and resid 135 and name HA ))
(( segid " " and resid 136 and name HG3 ))
3.500 1.500 1.500 peak 139 spectrum 1 weight 0.10000E+01 volume 0.37227E-02 ppm1 4.352 ppm2 1.441 CV 1
OR { 139}
(( segid " " and resid 135 and name HA ))
(( segid " " and resid 136 and name HG2 ))
ASSI { 140}
(( segid " " and resid 75 and name HB3 ))
( segid " " and resid 75 and name HD1%)
2.300 0.700 0.700 peak 140 spectrum 1 weight 0.10000E+01 volume 0.11626E-01 ppm1 1.674 ppm2 0.911 CV 1
OR { 140}
(( segid " " and resid 75 and name HB3 ))
( segid " " and resid 75 and name HD2%)
ASSI { 141}
(( segid " " and resid 138 and name HB3 ))
( segid " " and resid 138 and name HD2%)
2.300 0.600 0.600 peak 141 spectrum 1 weight 0.10000E+01 volume 0.13757E-01 ppm1 1.659 ppm2 0.924 CV 1
OR { 141}
(( segid " " and resid 138 and name HB2 ))
( segid " " and resid 138 and name HD2%)
OR { 141}
(( segid " " and resid 138 and name HB2 ))
( segid " " and resid 138 and name HD1%)
ASSI { 142}
(( segid " " and resid 75 and name HB2 ))
( segid " " and resid 75 and name HD2%)
2.300 0.600 0.600 peak 142 spectrum 1 weight 0.10000E+01 volume 0.14306E-01 ppm1 1.565 ppm2 0.902 CV 1
OR { 142}
(( segid " " and resid 75 and name HB2 ))
( segid " " and resid 75 and name HD1%)
ASSI { 145}
(( segid " " and resid 75 and name HG ))
( segid " " and resid 75 and name HD2%)
1.900 0.500 0.500 peak 145 spectrum 1 weight 0.10000E+01 volume 0.24218E-01 ppm1 1.586 ppm2 0.908 CV 1
OR { 145}
(( segid " " and resid 75 and name HG ))
( segid " " and resid 75 and name HD1%)
ASSI { 150}
(( segid " " and resid 64 and name HE2 ))
(( segid " " and resid 64 and name H ))
4.100 2.100 1.900 peak 150 spectrum 1 weight 0.10000E+01 volume 0.89718E-03 ppm1 2.980 ppm2 8.287 CV 1
OR { 150}
(( segid " " and resid 64 and name HE3 ))
(( segid " " and resid 64 and name H ))
ASSI { 156}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 65 and name H ))
3.800 1.800 1.800 peak 156 spectrum 1 weight 0.10000E+01 volume 0.13932E-02 ppm1 1.463 ppm2 7.751 CV 1
OR { 156}
(( segid " " and resid 64 and name HG3 ))
(( segid " " and resid 65 and name H ))
ASSI { 168}
(( segid " " and resid 48 and name HD3 ))
(( segid " " and resid 48 and name HA ))
3.600 1.700 1.700 peak 168 spectrum 1 weight 0.10000E+01 volume 0.32084E-02 ppm1 1.693 ppm2 3.887 CV 1
OR { 168}
(( segid " " and resid 48 and name HD2 ))
(( segid " " and resid 48 and name HA ))
ASSI { 187}
(( segid " " and resid 133 and name HB2 ))
(( segid " " and resid 134 and name HD3 ))
3.900 1.900 1.900 peak 187 spectrum 1 weight 0.10000E+01 volume 0.11709E-02 ppm1 1.766 ppm2 3.229 CV 1
OR { 187}
(( segid " " and resid 133 and name HB2 ))
(( segid " " and resid 134 and name HD2 ))
ASSI { 189}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 103 and name HA ))
2.500 0.800 0.800 peak 189 spectrum 1 weight 0.10000E+01 volume 0.63422E-02 ppm1 1.811 ppm2 4.152 CV 1
OR { 189}
(( segid " " and resid 103 and name HB3 ))
(( segid " " and resid 103 and name HA ))
ASSI { 192}
(( segid " " and resid 103 and name HB3 ))
(( segid " " and resid 103 and name H ))
2.400 0.700 0.700 peak 192 spectrum 1 weight 0.10000E+01 volume 0.58781E-02 ppm1 1.811 ppm2 7.468 CV 1
OR { 192}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 103 and name H ))
ASSI { 206}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name H ))
3.600 1.600 1.600 peak 206 spectrum 1 weight 0.10000E+01 volume 0.18072E-02 ppm1 2.078 ppm2 8.707 CV 1
ASSI { 208}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 67 and name H ))
2.800 1.000 1.000 peak 208 spectrum 1 weight 0.10000E+01 volume 0.23160E-02 ppm1 2.411 ppm2 7.794 CV 1
OR { 208}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 67 and name H ))
ASSI { 213}
(( segid " " and resid 135 and name HB2 ))
(( segid " " and resid 135 and name HA ))
2.700 0.900 0.900 peak 213 spectrum 1 weight 0.10000E+01 volume 0.58909E-02 ppm1 1.997 ppm2 4.345 CV 1
ASSI { 216}
(( segid " " and resid 135 and name HA ))
(( segid " " and resid 135 and name HB3 ))
2.000 0.500 0.500 peak 216 spectrum 1 weight 0.10000E+01 volume 0.14188E-01 ppm1 4.344 ppm2 2.096 CV 1
ASSI { 217}
(( segid " " and resid 135 and name HA ))
(( segid " " and resid 135 and name HG3 ))
2.500 0.800 0.800 peak 217 spectrum 1 weight 0.10000E+01 volume 0.96982E-02 ppm1 4.345 ppm2 2.393 CV 1
OR { 217}
(( segid " " and resid 135 and name HA ))
(( segid " " and resid 135 and name HG2 ))
ASSI { 219}
(( segid " " and resid 135 and name HB2 ))
(( segid " " and resid 135 and name HG3 ))
2.100 0.500 0.500 peak 219 spectrum 1 weight 0.10000E+01 volume 0.19437E-01 ppm1 1.997 ppm2 2.388 CV 1
OR { 219}
(( segid " " and resid 135 and name HB2 ))
(( segid " " and resid 135 and name HG2 ))
ASSI { 220}
(( segid " " and resid 135 and name HB3 ))
(( segid " " and resid 135 and name HB2 ))
1.200 0.200 1.000 peak 220 spectrum 1 weight 0.10000E+01 volume 0.10884E+00 ppm1 2.097 ppm2 2.002 CV 1
ASSI { 227}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 51 and name HG12))
2.800 1.000 1.000 peak 227 spectrum 1 weight 0.10000E+01 volume 0.19550E-02 ppm1 2.391 ppm2 1.448 CV 1
OR { 227}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 51 and name HG12))
ASSI { 231}
(( segid " " and resid 134 and name HD3 ))
(( segid " " and resid 134 and name H ))
3.300 1.300 1.300 peak 231 spectrum 1 weight 0.10000E+01 volume 0.10902E-02 ppm1 3.231 ppm2 8.529 CV 1
OR { 231}
(( segid " " and resid 134 and name HD2 ))
(( segid " " and resid 134 and name H ))
ASSI { 232}
(( segid " " and resid 111 and name HD2 ))
(( segid " " and resid 111 and name HE ))
3.300 1.300 1.300 peak 232 spectrum 1 weight 0.10000E+01 volume 0.74790E-03 ppm1 3.260 ppm2 7.413 CV 1
OR { 232}
(( segid " " and resid 111 and name HD3 ))
(( segid " " and resid 111 and name HE ))
ASSI { 237}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HB3 ))
1.600 0.300 0.600 peak 237 spectrum 1 weight 0.10000E+01 volume 0.17889E-01 ppm1 1.865 ppm2 2.184 CV 1
ASSI { 240}
(( segid " " and resid 86 and name HD2 ))
(( segid " " and resid 86 and name HB2 ))
2.400 0.700 0.700 peak 240 spectrum 1 weight 0.10000E+01 volume 0.71134E-02 ppm1 3.262 ppm2 2.004 CV 1
OR { 240}
(( segid " " and resid 86 and name HD2 ))
(( segid " " and resid 86 and name HB3 ))
OR { 240}
(( segid " " and resid 86 and name HD3 ))
(( segid " " and resid 86 and name HB2 ))
OR { 240}
(( segid " " and resid 86 and name HD3 ))
(( segid " " and resid 86 and name HB3 ))
ASSI { 249}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HD3 ))
3.800 1.800 1.800 peak 249 spectrum 1 weight 0.10000E+01 volume 0.20399E-02 ppm1 1.869 ppm2 3.735 CV 1
ASSI { 250}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HD2 ))
3.800 1.800 1.800 peak 250 spectrum 1 weight 0.10000E+01 volume 0.17057E-02 ppm1 1.870 ppm2 3.543 CV 1
ASSI { 251}
(( segid " " and resid 111 and name HB3 ))
(( segid " " and resid 111 and name HA ))
2.800 1.000 1.000 peak 251 spectrum 1 weight 0.10000E+01 volume 0.21096E-02 ppm1 1.883 ppm2 4.000 CV 1
ASSI { 262}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 45 and name H ))
3.700 1.700 1.700 peak 262 spectrum 1 weight 0.10000E+01 volume 0.16301E-02 ppm1 1.867 ppm2 8.101 CV 1
ASSI { 278}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name H ))
2.400 0.700 0.700 peak 278 spectrum 1 weight 0.10000E+01 volume 0.33851E-02 ppm1 1.874 ppm2 8.330 CV 1
ASSI { 288}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 14 and name H ))
3.900 1.900 1.900 peak 288 spectrum 1 weight 0.10000E+01 volume 0.12464E-02 ppm1 2.847 ppm2 8.711 CV 1
ASSI { 289}
(( segid " " and resid 131 and name HA ))
( segid " " and resid 131 and name HD% )
2.900 1.000 1.000 peak 289 spectrum 1 weight 0.10000E+01 volume 0.26573E-02 ppm1 4.736 ppm2 7.112 CV 1
ASSI { 293}
(( segid " " and resid 131 and name HB3 ))
(( segid " " and resid 131 and name HB2 ))
2.200 0.600 0.600 peak 293 spectrum 1 weight 0.10000E+01 volume 0.37140E-02 ppm1 3.285 ppm2 2.827 CV 1
ASSI { 295}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 14 and name HA ))
2.900 1.100 1.100 peak 295 spectrum 1 weight 0.10000E+01 volume 0.14839E-02 ppm1 2.847 ppm2 3.978 CV 1
ASSI { 296}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB3 ))
2.600 0.800 0.800 peak 296 spectrum 1 weight 0.10000E+01 volume 0.38265E-02 ppm1 4.735 ppm2 2.846 CV 1
ASSI { 298}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB2 ))
3.200 1.300 1.300 peak 298 spectrum 1 weight 0.10000E+01 volume 0.25090E-02 ppm1 4.730 ppm2 3.478 CV 1
ASSI { 299}
(( segid " " and resid 131 and name HA ))
(( segid " " and resid 132 and name HB3 ))
4.500 2.500 1.500 peak 299 spectrum 1 weight 0.10000E+01 volume 0.98507E-03 ppm1 4.733 ppm2 1.827 CV 1
OR { 299}
(( segid " " and resid 131 and name HA ))
(( segid " " and resid 132 and name HB2 ))
ASSI { 303}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 14 and name HG3 ))
2.100 0.600 0.600 peak 303 spectrum 1 weight 0.10000E+01 volume 0.42098E-02 ppm1 2.851 ppm2 2.144 CV 1
ASSI { 305}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 133 and name HB2 ))
3.300 1.400 1.400 peak 305 spectrum 1 weight 0.10000E+01 volume 0.19252E-02 ppm1 2.834 ppm2 1.797 CV 1
OR { 305}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 133 and name HB3 ))
ASSI { 307}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 131 and name HB2 ))
4.300 2.300 1.700 peak 307 spectrum 1 weight 0.10000E+01 volume 0.90109E-03 ppm1 6.742 ppm2 2.828 CV 1
ASSI { 308}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 112 and name HA ))
3.700 1.700 1.700 peak 308 spectrum 1 weight 0.10000E+01 volume 0.12703E-02 ppm1 6.742 ppm2 4.044 CV 1
ASSI { 309}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 131 and name HB3 ))
3.300 1.400 1.400 peak 309 spectrum 1 weight 0.10000E+01 volume 0.19752E-02 ppm1 6.742 ppm2 3.269 CV 1
ASSI { 310}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 129 and name HG3 ))
2.500 2.500 3.500 peak 310 spectrum 1 weight 0.10000E+01 volume 0.61677E-03 ppm1 6.743 ppm2 2.397 CV 1
OR { 310}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 129 and name HG2 ))
ASSI { 311}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 115 and name HB ))
3.400 1.400 1.400 peak 311 spectrum 1 weight 0.10000E+01 volume 0.10163E-02 ppm1 6.742 ppm2 2.217 CV 1
ASSI { 312}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 127 and name HB3 ))
2.700 0.900 0.900 peak 312 spectrum 1 weight 0.10000E+01 volume 0.27077E-02 ppm1 6.742 ppm2 1.861 CV 1
OR { 312}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 127 and name HB2 ))
ASSI { 313}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 127 and name HG2 ))
3.000 1.200 1.200 peak 313 spectrum 1 weight 0.10000E+01 volume 0.23883E-02 ppm1 6.742 ppm2 1.707 CV 1
ASSI { 316}
( segid " " and resid 131 and name HE% )
( segid " " and resid 115 and name HG1%)
2.900 1.100 1.100 peak 316 spectrum 1 weight 0.10000E+01 volume 0.18832E-02 ppm1 6.742 ppm2 1.127 CV 1
ASSI { 317}
( segid " " and resid 131 and name HE% )
( segid " " and resid 115 and name HG2%)
2.200 0.600 0.600 peak 317 spectrum 1 weight 0.10000E+01 volume 0.59174E-02 ppm1 6.742 ppm2 0.943 CV 1
ASSI { 318}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 128 and name HA ))
3.000 1.100 1.100 peak 318 spectrum 1 weight 0.10000E+01 volume 0.20954E-02 ppm1 7.122 ppm2 4.045 CV 1
ASSI { 319}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 115 and name HB ))
4.000 2.000 2.000 peak 319 spectrum 1 weight 0.10000E+01 volume 0.64618E-03 ppm1 7.123 ppm2 2.209 CV 1
ASSI { 320}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 127 and name HB3 ))
3.000 1.100 1.100 peak 320 spectrum 1 weight 0.10000E+01 volume 0.21760E-02 ppm1 7.123 ppm2 1.868 CV 1
OR { 320}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 127 and name HB2 ))
ASSI { 321}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 130 and name HB3 ))
3.200 1.300 1.300 peak 321 spectrum 1 weight 0.10000E+01 volume 0.21237E-02 ppm1 7.123 ppm2 1.679 CV 1
ASSI { 322}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 130 and name HB2 ))
2.900 1.000 1.000 peak 322 spectrum 1 weight 0.10000E+01 volume 0.13863E-02 ppm1 7.123 ppm2 1.444 CV 1
ASSI { 323}
( segid " " and resid 131 and name HD% )
( segid " " and resid 115 and name HG1%)
4.000 2.000 2.000 peak 323 spectrum 1 weight 0.10000E+01 volume 0.65698E-03 ppm1 7.124 ppm2 1.120 CV 1
ASSI { 324}
( segid " " and resid 131 and name HD% )
( segid " " and resid 115 and name HG2%)
3.200 1.300 1.300 peak 324 spectrum 1 weight 0.10000E+01 volume 0.30564E-02 ppm1 7.123 ppm2 0.946 CV 1
ASSI { 326}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 131 and name H ))
2.400 2.400 3.600 peak 326 spectrum 1 weight 0.10000E+01 volume 0.93776E-03 ppm1 6.742 ppm2 7.409 CV 1
ASSI { 327}
( segid " " and resid 131 and name HE% )
( segid " " and resid 131 and name HD% )
1.900 0.400 0.400 peak 327 spectrum 1 weight 0.10000E+01 volume 0.25022E-01 ppm1 6.742 ppm2 7.120 CV 1
ASSI { 329}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 132 and name H ))
2.300 2.300 3.700 peak 329 spectrum 1 weight 0.10000E+01 volume 0.10446E-02 ppm1 7.124 ppm2 7.863 CV 1
ASSI { 330}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 130 and name H ))
3.000 1.200 1.200 peak 330 spectrum 1 weight 0.10000E+01 volume 0.11565E-02 ppm1 7.123 ppm2 7.762 CV 1
ASSI { 331}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 131 and name H ))
3.000 1.100 1.100 peak 331 spectrum 1 weight 0.10000E+01 volume 0.24834E-02 ppm1 7.123 ppm2 7.411 CV 1
ASSI { 334}
(( segid " " and resid 130 and name HB3 ))
(( segid " " and resid 130 and name H ))
3.700 1.700 1.700 peak 334 spectrum 1 weight 0.10000E+01 volume 0.11591E-02 ppm1 1.680 ppm2 7.760 CV 1
ASSI { 336}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 130 and name H ))
2.300 0.700 0.700 peak 336 spectrum 1 weight 0.10000E+01 volume 0.29360E-02 ppm1 0.972 ppm2 7.760 CV 1
ASSI { 337}
(( segid " " and resid 130 and name HB2 ))
(( segid " " and resid 130 and name HA ))
3.600 1.600 1.600 peak 337 spectrum 1 weight 0.10000E+01 volume 0.10043E-02 ppm1 1.402 ppm2 4.301 CV 1
ASSI { 342}
( segid " " and resid 130 and name HD1%)
( segid " " and resid 88 and name HE% )
3.700 1.700 1.700 peak 342 spectrum 1 weight 0.10000E+01 volume 0.10280E-02 ppm1 0.973 ppm2 7.209 CV 1
ASSI { 343}
( segid " " and resid 130 and name HD1%)
( segid " " and resid 131 and name HE% )
3.700 1.700 1.700 peak 343 spectrum 1 weight 0.10000E+01 volume 0.88025E-03 ppm1 0.974 ppm2 6.749 CV 1
ASSI { 344}
( segid " " and resid 130 and name HD1%)
( segid " " and resid 131 and name HD% )
3.700 1.700 1.700 peak 344 spectrum 1 weight 0.10000E+01 volume 0.10989E-02 ppm1 0.971 ppm2 7.113 CV 1
ASSI { 347}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 130 and name HA ))
3.200 1.300 1.300 peak 347 spectrum 1 weight 0.10000E+01 volume 0.24671E-02 ppm1 0.974 ppm2 4.296 CV 1
ASSI { 348}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 129 and name HA ))
4.000 2.000 2.000 peak 348 spectrum 1 weight 0.10000E+01 volume 0.11386E-02 ppm1 0.974 ppm2 4.155 CV 1
ASSI { 350}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 127 and name HA ))
2.600 0.800 0.800 peak 350 spectrum 1 weight 0.10000E+01 volume 0.16613E-02 ppm1 0.971 ppm2 3.742 CV 1
ASSI { 351}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 115 and name HA ))
3.300 1.400 1.400 peak 351 spectrum 1 weight 0.10000E+01 volume 0.19742E-02 ppm1 0.972 ppm2 3.345 CV 1
ASSI { 352}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 79 and name HA ))
3.400 1.400 1.400 peak 352 spectrum 1 weight 0.10000E+01 volume 0.17169E-02 ppm1 0.979 ppm2 4.533 CV 1
ASSI { 354}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 83 and name HA ))
3.000 1.100 1.100 peak 354 spectrum 1 weight 0.10000E+01 volume 0.34975E-02 ppm1 0.935 ppm2 4.026 CV 1
ASSI { 355}
( segid " " and resid 33 and name HG1%)
(( segid " " and resid 51 and name HG13))
2.600 0.800 0.800 peak 355 spectrum 1 weight 0.10000E+01 volume 0.29173E-02 ppm1 0.939 ppm2 0.094 CV 1
ASSI { 356}
( segid " " and resid 33 and name HG1%)
( segid " " and resid 32 and name HG1%)
2.600 0.900 0.900 peak 356 spectrum 1 weight 0.10000E+01 volume 0.14299E-01 ppm1 0.940 ppm2 1.293 CV 1
ASSI { 357}
( segid " " and resid 130 and name HD1%)
( segid " " and resid 119 and name HD1%)
2.600 0.800 0.800 peak 357 spectrum 1 weight 0.10000E+01 volume 0.38262E-02 ppm1 0.973 ppm2 0.655 CV 1
ASSI { 358}
( segid " " and resid 130 and name HD1%)
( segid " " and resid 124 and name HG1%)
2.200 0.600 0.600 peak 358 spectrum 1 weight 0.10000E+01 volume 0.66008E-02 ppm1 0.972 ppm2 0.519 CV 1
ASSI { 359}
( segid " " and resid 130 and name HD1%)
( segid " " and resid 124 and name HG2%)
1.800 0.400 0.400 peak 359 spectrum 1 weight 0.10000E+01 volume 0.14486E-01 ppm1 0.971 ppm2 0.809 CV 1
ASSI { 360}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 130 and name HB2 ))
2.200 0.600 0.600 peak 360 spectrum 1 weight 0.10000E+01 volume 0.57145E-02 ppm1 0.973 ppm2 1.414 CV 1
ASSI { 361}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 127 and name HB3 ))
2.900 1.000 1.000 peak 361 spectrum 1 weight 0.10000E+01 volume 0.48817E-02 ppm1 0.977 ppm2 1.829 CV 1
OR { 361}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 127 and name HB2 ))
ASSI { 362}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 129 and name HG3 ))
3.100 1.200 1.200 peak 362 spectrum 1 weight 0.10000E+01 volume 0.11106E-02 ppm1 0.971 ppm2 2.398 CV 1
OR { 362}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 129 and name HG2 ))
ASSI { 370}
(( segid " " and resid 129 and name HB3 ))
(( segid " " and resid 129 and name HA ))
2.900 1.000 1.000 peak 370 spectrum 1 weight 0.10000E+01 volume 0.23303E-02 ppm1 2.241 ppm2 4.145 CV 1
ASSI { 371}
(( segid " " and resid 129 and name HB2 ))
(( segid " " and resid 129 and name HA ))
2.900 1.000 1.000 peak 371 spectrum 1 weight 0.10000E+01 volume 0.20840E-02 ppm1 2.178 ppm2 4.147 CV 1
ASSI { 373}
(( segid " " and resid 129 and name HG3 ))
(( segid " " and resid 129 and name HA ))
3.100 1.200 1.200 peak 373 spectrum 1 weight 0.10000E+01 volume 0.48396E-02 ppm1 2.399 ppm2 4.147 CV 1
OR { 373}
(( segid " " and resid 129 and name HG2 ))
(( segid " " and resid 129 and name HA ))
ASSI { 374}
(( segid " " and resid 113 and name HB3 ))
(( segid " " and resid 113 and name HG2 ))
2.500 0.800 0.800 peak 374 spectrum 1 weight 0.10000E+01 volume 0.44903E-02 ppm1 2.235 ppm2 1.906 CV 1
OR { 374}
(( segid " " and resid 113 and name HB2 ))
(( segid " " and resid 113 and name HG3 ))
OR { 374}
(( segid " " and resid 113 and name HB3 ))
(( segid " " and resid 113 and name HG3 ))
OR { 374}
(( segid " " and resid 113 and name HB2 ))
(( segid " " and resid 113 and name HG2 ))
ASSI { 377}
(( segid " " and resid 129 and name HG3 ))
(( segid " " and resid 130 and name HG ))
2.800 1.000 1.000 peak 377 spectrum 1 weight 0.10000E+01 volume 0.23775E-02 ppm1 2.396 ppm2 1.621 CV 1
OR { 377}
(( segid " " and resid 129 and name HG2 ))
(( segid " " and resid 130 and name HG ))
ASSI { 381}
(( segid " " and resid 129 and name HB3 ))
( segid " " and resid 124 and name HG2%)
3.600 1.600 1.600 peak 381 spectrum 1 weight 0.10000E+01 volume 0.25224E-02 ppm1 2.240 ppm2 0.811 CV 1
ASSI { 384}
(( segid " " and resid 129 and name HB2 ))
( segid " " and resid 124 and name HG2%)
3.800 1.800 1.800 peak 384 spectrum 1 weight 0.10000E+01 volume 0.23972E-02 ppm1 2.176 ppm2 0.816 CV 1
ASSI { 387}
(( segid " " and resid 129 and name HG3 ))
( segid " " and resid 130 and name HD2%)
2.600 0.800 0.800 peak 387 spectrum 1 weight 0.10000E+01 volume 0.41753E-02 ppm1 2.401 ppm2 0.958 CV 1
OR { 387}
(( segid " " and resid 129 and name HG2 ))
( segid " " and resid 130 and name HD2%)
OR { 387}
(( segid " " and resid 129 and name HG3 ))
( segid " " and resid 130 and name HD1%)
OR { 387}
(( segid " " and resid 129 and name HG2 ))
( segid " " and resid 130 and name HD1%)
ASSI { 388}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 9 and name HZ3 ))
3.400 1.400 1.400 peak 388 spectrum 1 weight 0.10000E+01 volume 0.91704E-03 ppm1 2.425 ppm2 6.800 CV 1
OR { 388}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 9 and name HZ3 ))
ASSI { 389}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 9 and name HE3 ))
2.800 1.000 1.000 peak 389 spectrum 1 weight 0.10000E+01 volume 0.10439E-02 ppm1 2.427 ppm2 7.072 CV 1
OR { 389}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 9 and name HE3 ))
ASSI { 390}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name H ))
2.700 0.900 0.900 peak 390 spectrum 1 weight 0.10000E+01 volume 0.31757E-02 ppm1 4.150 ppm2 8.624 CV 1
ASSI { 393}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name H ))
2.400 0.700 0.700 peak 393 spectrum 1 weight 0.10000E+01 volume 0.33101E-02 ppm1 2.058 ppm2 7.795 CV 1
ASSI { 394}
(( segid " " and resid 128 and name HB3 ))
(( segid " " and resid 129 and name H ))
3.300 1.300 1.300 peak 394 spectrum 1 weight 0.10000E+01 volume 0.12811E-02 ppm1 1.867 ppm2 7.782 CV 1
OR { 394}
(( segid " " and resid 128 and name HB2 ))
(( segid " " and resid 129 and name H ))
ASSI { 395}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name H ))
2.300 0.700 0.700 peak 395 spectrum 1 weight 0.10000E+01 volume 0.92734E-02 ppm1 1.990 ppm2 8.626 CV 1
OR { 395}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name H ))
ASSI { 404}
(( segid " " and resid 127 and name HD2 ))
( segid " " and resid 131 and name HE% )
4.300 2.300 1.700 peak 404 spectrum 1 weight 0.10000E+01 volume 0.58226E-03 ppm1 3.248 ppm2 6.745 CV 1
OR { 404}
(( segid " " and resid 127 and name HD3 ))
( segid " " and resid 131 and name HE% )
ASSI { 405}
(( segid " " and resid 127 and name HD2 ))
( segid " " and resid 131 and name HE% )
4.300 2.300 1.700 peak 405 spectrum 1 weight 0.10000E+01 volume 0.51051E-03 ppm1 3.200 ppm2 6.744 CV 1
ASSI { 410}
(( segid " " and resid 126 and name HB2 ))
(( segid " " and resid 126 and name H ))
3.700 1.700 1.700 peak 410 spectrum 1 weight 0.10000E+01 volume 0.12356E-02 ppm1 2.222 ppm2 7.624 CV 1
ASSI { 411}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 126 and name H ))
3.200 1.300 1.300 peak 411 spectrum 1 weight 0.10000E+01 volume 0.14267E-02 ppm1 1.958 ppm2 7.627 CV 1
ASSI { 412}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 126 and name H ))
2.500 0.800 0.800 peak 412 spectrum 1 weight 0.10000E+01 volume 0.17807E-02 ppm1 2.295 ppm2 7.627 CV 1
ASSI { 413}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 126 and name H ))
3.200 1.300 1.300 peak 413 spectrum 1 weight 0.10000E+01 volume 0.18822E-02 ppm1 2.206 ppm2 7.626 CV 1
ASSI { 415}
(( segid " " and resid 126 and name HA ))
(( segid " " and resid 128 and name H ))
4.200 2.200 1.800 peak 415 spectrum 1 weight 0.10000E+01 volume 0.71870E-03 ppm1 4.562 ppm2 8.621 CV 1
ASSI { 416}
(( segid " " and resid 126 and name HA ))
(( segid " " and resid 129 and name H ))
4.800 2.900 1.200 peak 416 spectrum 1 weight 0.10000E+01 volume 0.50402E-03 ppm1 4.576 ppm2 7.783 CV 1
ASSI { 418}
(( segid " " and resid 126 and name HA ))
(( segid " " and resid 126 and name HB3 ))
2.600 0.800 0.800 peak 418 spectrum 1 weight 0.10000E+01 volume 0.31505E-02 ppm1 4.566 ppm2 1.953 CV 1
ASSI { 419}
(( segid " " and resid 126 and name HA ))
( segid " " and resid 119 and name HD2%)
3.000 1.100 1.100 peak 419 spectrum 1 weight 0.10000E+01 volume 0.16383E-02 ppm1 4.563 ppm2 0.803 CV 1
ASSI { 420}
(( segid " " and resid 126 and name HA ))
( segid " " and resid 119 and name HD1%)
3.400 1.400 1.400 peak 420 spectrum 1 weight 0.10000E+01 volume 0.17951E-02 ppm1 4.563 ppm2 0.657 CV 1
ASSI { 421}
(( segid " " and resid 126 and name HB2 ))
( segid " " and resid 119 and name HD1%)
4.300 2.300 1.700 peak 421 spectrum 1 weight 0.10000E+01 volume 0.90637E-03 ppm1 2.221 ppm2 0.663 CV 1
ASSI { 422}
(( segid " " and resid 126 and name HB3 ))
( segid " " and resid 119 and name HD1%)
4.500 2.600 1.500 peak 422 spectrum 1 weight 0.10000E+01 volume 0.89194E-03 ppm1 1.967 ppm2 0.667 CV 1
ASSI { 423}
(( segid " " and resid 126 and name HB2 ))
( segid " " and resid 125 and name HB% )
4.000 2.000 2.000 peak 423 spectrum 1 weight 0.10000E+01 volume 0.16379E-02 ppm1 2.216 ppm2 1.475 CV 1
ASSI { 424}
(( segid " " and resid 126 and name HB2 ))
(( segid " " and resid 126 and name HB3 ))
1.800 0.400 0.400 peak 424 spectrum 1 weight 0.10000E+01 volume 0.11456E-01 ppm1 2.222 ppm2 1.962 CV 1
ASSI { 425}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 129 and name HG2 ))
3.900 1.900 1.900 peak 425 spectrum 1 weight 0.10000E+01 volume 0.24545E-02 ppm1 1.958 ppm2 2.390 CV 1
OR { 425}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 129 and name HG3 ))
ASSI { 426}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 126 and name HB2 ))
1.800 0.400 0.400 peak 426 spectrum 1 weight 0.10000E+01 volume 0.14600E-01 ppm1 1.958 ppm2 2.218 CV 1
OR { 426}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 126 and name HG3 ))
ASSI { 427}
(( segid " " and resid 126 and name HB2 ))
(( segid " " and resid 128 and name HD3 ))
3.500 1.600 1.600 peak 427 spectrum 1 weight 0.10000E+01 volume 0.84379E-03 ppm1 2.221 ppm2 3.201 CV 1
OR { 427}
(( segid " " and resid 126 and name HB2 ))
(( segid " " and resid 128 and name HD2 ))
ASSI { 428}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 128 and name HD3 ))
4.300 2.300 1.700 peak 428 spectrum 1 weight 0.10000E+01 volume 0.67783E-03 ppm1 1.957 ppm2 3.198 CV 1
OR { 428}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 128 and name HD2 ))
ASSI { 429}
(( segid " " and resid 126 and name HB2 ))
(( segid " " and resid 126 and name HA ))
3.300 1.300 1.300 peak 429 spectrum 1 weight 0.10000E+01 volume 0.89338E-03 ppm1 2.220 ppm2 4.566 CV 1
ASSI { 431}
(( segid " " and resid 126 and name HB2 ))
(( segid " " and resid 127 and name H ))
3.700 1.700 1.700 peak 431 spectrum 1 weight 0.10000E+01 volume 0.51212E-03 ppm1 2.222 ppm2 9.024 CV 1
ASSI { 432}
(( segid " " and resid 126 and name HB2 ))
(( segid " " and resid 128 and name H ))
3.200 1.300 1.300 peak 432 spectrum 1 weight 0.10000E+01 volume 0.70725E-03 ppm1 2.231 ppm2 8.602 CV 1
ASSI { 433}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 129 and name H ))
5.100 3.300 0.900 peak 433 spectrum 1 weight 0.10000E+01 volume 0.78892E-03 ppm1 1.960 ppm2 7.786 CV 1
ASSI { 434}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 128 and name H ))
5.000 3.100 1.000 peak 434 spectrum 1 weight 0.10000E+01 volume 0.71555E-03 ppm1 1.956 ppm2 8.604 CV 1
ASSI { 435}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 127 and name H ))
4.900 2.900 1.100 peak 435 spectrum 1 weight 0.10000E+01 volume 0.52680E-03 ppm1 1.959 ppm2 9.024 CV 1
ASSI { 436}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 129 and name H ))
4.500 2.500 1.500 peak 436 spectrum 1 weight 0.10000E+01 volume 0.10589E-02 ppm1 2.297 ppm2 7.785 CV 1
ASSI { 437}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 129 and name H ))
2.700 0.900 0.900 peak 437 spectrum 1 weight 0.10000E+01 volume 0.11835E-02 ppm1 2.207 ppm2 7.781 CV 1
ASSI { 438}
(( segid " " and resid 12 and name HG3 ))
(( segid " " and resid 12 and name H ))
3.700 1.700 1.700 peak 438 spectrum 1 weight 0.10000E+01 volume 0.14505E-02 ppm1 2.300 ppm2 8.967 CV 1
ASSI { 441}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 127 and name H ))
4.100 2.100 1.900 peak 441 spectrum 1 weight 0.10000E+01 volume 0.63892E-03 ppm1 2.208 ppm2 9.025 CV 1
ASSI { 444}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 126 and name HA ))
3.700 1.700 1.700 peak 444 spectrum 1 weight 0.10000E+01 volume 0.11279E-02 ppm1 2.296 ppm2 4.569 CV 1
ASSI { 445}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 126 and name HA ))
3.800 1.800 1.800 peak 445 spectrum 1 weight 0.10000E+01 volume 0.10231E-02 ppm1 2.207 ppm2 4.567 CV 1
ASSI { 449}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 128 and name HA ))
4.000 2.000 2.000 peak 449 spectrum 1 weight 0.10000E+01 volume 0.98082E-03 ppm1 2.191 ppm2 4.050 CV 1
ASSI { 450}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 28 and name HA ))
2.500 0.800 0.800 peak 450 spectrum 1 weight 0.10000E+01 volume 0.55431E-02 ppm1 2.304 ppm2 4.144 CV 1
ASSI { 453}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 128 and name HD3 ))
4.200 2.200 1.800 peak 453 spectrum 1 weight 0.10000E+01 volume 0.90246E-03 ppm1 2.298 ppm2 3.201 CV 1
OR { 453}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 128 and name HD2 ))
ASSI { 454}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 128 and name HD3 ))
3.700 1.700 1.700 peak 454 spectrum 1 weight 0.10000E+01 volume 0.81809E-03 ppm1 2.207 ppm2 3.199 CV 1
OR { 454}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 128 and name HD2 ))
ASSI { 455}
(( segid " " and resid 126 and name HG2 ))
( segid " " and resid 124 and name HG1%)
5.400 3.600 0.600 peak 455 spectrum 1 weight 0.10000E+01 volume 0.48427E-03 ppm1 2.298 ppm2 0.523 CV 1
ASSI { 456}
(( segid " " and resid 126 and name HG2 ))
( segid " " and resid 119 and name HD1%)
4.300 2.300 1.700 peak 456 spectrum 1 weight 0.10000E+01 volume 0.10974E-02 ppm1 2.296 ppm2 0.661 CV 1
ASSI { 457}
(( segid " " and resid 126 and name HG3 ))
( segid " " and resid 119 and name HD1%)
4.000 2.000 2.000 peak 457 spectrum 1 weight 0.10000E+01 volume 0.13162E-02 ppm1 2.204 ppm2 0.661 CV 1
ASSI { 459}
(( segid " " and resid 126 and name HG2 ))
( segid " " and resid 125 and name HB% )
2.500 0.800 0.800 peak 459 spectrum 1 weight 0.10000E+01 volume 0.47994E-02 ppm1 2.296 ppm2 1.468 CV 1
ASSI { 465}
(( segid " " and resid 125 and name HA ))
( segid " " and resid 119 and name HD1%)
3.800 1.800 1.800 peak 465 spectrum 1 weight 0.10000E+01 volume 0.13796E-02 ppm1 4.304 ppm2 0.658 CV 1
ASSI { 466}
(( segid " " and resid 125 and name HA ))
( segid " " and resid 124 and name HG1%)
4.000 2.000 2.000 peak 466 spectrum 1 weight 0.10000E+01 volume 0.74158E-03 ppm1 4.301 ppm2 0.518 CV 1
ASSI { 468}
(( segid " " and resid 125 and name HA ))
(( segid " " and resid 126 and name HG2 ))
4.500 2.600 1.500 peak 468 spectrum 1 weight 0.10000E+01 volume 0.71477E-03 ppm1 4.296 ppm2 2.269 CV 1
OR { 468}
(( segid " " and resid 125 and name HA ))
(( segid " " and resid 126 and name HB2 ))
ASSI { 469}
(( segid " " and resid 125 and name HA ))
(( segid " " and resid 126 and name H ))
3.300 1.400 1.400 peak 469 spectrum 1 weight 0.10000E+01 volume 0.13654E-02 ppm1 4.301 ppm2 7.623 CV 1
ASSI { 470}
(( segid " " and resid 125 and name HA ))
(( segid " " and resid 125 and name H ))
2.900 1.100 1.100 peak 470 spectrum 1 weight 0.10000E+01 volume 0.20250E-02 ppm1 4.304 ppm2 8.859 CV 1
ASSI { 471}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 125 and name H ))
2.300 0.700 0.700 peak 471 spectrum 1 weight 0.10000E+01 volume 0.84216E-02 ppm1 1.466 ppm2 8.858 CV 1
ASSI { 472}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 126 and name H ))
2.600 0.800 0.800 peak 472 spectrum 1 weight 0.10000E+01 volume 0.56239E-02 ppm1 1.465 ppm2 7.626 CV 1
ASSI { 473}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 124 and name H ))
2.500 2.500 3.500 peak 473 spectrum 1 weight 0.10000E+01 volume 0.64669E-03 ppm1 1.465 ppm2 6.792 CV 1
ASSI { 474}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 125 and name HA ))
2.200 0.600 0.600 peak 474 spectrum 1 weight 0.10000E+01 volume 0.16201E-01 ppm1 1.466 ppm2 4.302 CV 1
ASSI { 477}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 129 and name HG2 ))
3.800 1.800 1.800 peak 477 spectrum 1 weight 0.10000E+01 volume 0.20740E-02 ppm1 1.465 ppm2 2.383 CV 1
OR { 477}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 129 and name HG3 ))
ASSI { 478}
( segid " " and resid 125 and name HB% )
( segid " " and resid 124 and name HG2%)
3.600 1.600 1.600 peak 478 spectrum 1 weight 0.10000E+01 volume 0.34824E-02 ppm1 1.466 ppm2 0.810 CV 1
ASSI { 479}
( segid " " and resid 125 and name HB% )
( segid " " and resid 119 and name HD1%)
3.700 1.700 1.700 peak 479 spectrum 1 weight 0.10000E+01 volume 0.27230E-02 ppm1 1.466 ppm2 0.662 CV 1
ASSI { 480}
( segid " " and resid 125 and name HB% )
( segid " " and resid 124 and name HG1%)
4.000 2.000 2.000 peak 480 spectrum 1 weight 0.10000E+01 volume 0.20300E-02 ppm1 1.465 ppm2 0.519 CV 1
ASSI { 481}
( segid " " and resid 125 and name HB% )
( segid " " and resid 130 and name HD2%)
4.500 2.500 1.500 peak 481 spectrum 1 weight 0.10000E+01 volume 0.16810E-02 ppm1 1.462 ppm2 0.958 CV 1
OR { 481}
( segid " " and resid 125 and name HB% )
( segid " " and resid 130 and name HD1%)
ASSI { 482}
(( segid " " and resid 124 and name HA ))
(( segid " " and resid 125 and name H ))
2.600 0.800 0.800 peak 482 spectrum 1 weight 0.10000E+01 volume 0.27968E-02 ppm1 4.269 ppm2 8.858 CV 1
ASSI { 484}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 125 and name H ))
2.400 0.700 0.700 peak 484 spectrum 1 weight 0.10000E+01 volume 0.35056E-02 ppm1 0.808 ppm2 8.859 CV 1
ASSI { 485}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 125 and name H ))
3.700 1.700 1.700 peak 485 spectrum 1 weight 0.10000E+01 volume 0.19829E-02 ppm1 0.514 ppm2 8.859 CV 1
ASSI { 486}
(( segid " " and resid 124 and name HA ))
( segid " " and resid 124 and name HG1%)
3.300 1.300 1.300 peak 486 spectrum 1 weight 0.10000E+01 volume 0.19993E-02 ppm1 4.269 ppm2 0.518 CV 1
ASSI { 487}
(( segid " " and resid 124 and name HA ))
( segid " " and resid 124 and name HG2%)
2.700 0.900 0.900 peak 487 spectrum 1 weight 0.10000E+01 volume 0.40630E-02 ppm1 4.269 ppm2 0.807 CV 1
ASSI { 489}
(( segid " " and resid 124 and name HA ))
(( segid " " and resid 124 and name HB ))
2.600 0.800 0.800 peak 489 spectrum 1 weight 0.10000E+01 volume 0.32261E-02 ppm1 4.269 ppm2 1.896 CV 1
ASSI { 491}
(( segid " " and resid 124 and name HB ))
( segid " " and resid 119 and name HD1%)
3.500 1.600 1.600 peak 491 spectrum 1 weight 0.10000E+01 volume 0.22585E-02 ppm1 1.892 ppm2 0.647 CV 1
ASSI { 492}
(( segid " " and resid 124 and name HB ))
( segid " " and resid 124 and name HG1%)
2.100 0.600 0.600 peak 492 spectrum 1 weight 0.10000E+01 volume 0.67128E-02 ppm1 1.892 ppm2 0.518 CV 1
ASSI { 493}
(( segid " " and resid 124 and name HB ))
( segid " " and resid 130 and name HD1%)
3.000 1.100 1.100 peak 493 spectrum 1 weight 0.10000E+01 volume 0.24723E-02 ppm1 1.890 ppm2 0.947 CV 1
OR { 493}
(( segid " " and resid 124 and name HB ))
( segid " " and resid 130 and name HD2%)
ASSI { 494}
(( segid " " and resid 124 and name HB ))
( segid " " and resid 125 and name HB% )
4.500 2.500 1.500 peak 494 spectrum 1 weight 0.10000E+01 volume 0.12736E-02 ppm1 1.897 ppm2 1.467 CV 1
ASSI { 495}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 129 and name HG3 ))
3.400 1.400 1.400 peak 495 spectrum 1 weight 0.10000E+01 volume 0.14881E-02 ppm1 1.892 ppm2 2.395 CV 1
OR { 495}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 129 and name HG2 ))
ASSI { 498}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 119 and name HA ))
4.300 2.400 1.700 peak 498 spectrum 1 weight 0.10000E+01 volume 0.10409E-02 ppm1 1.890 ppm2 4.155 CV 1
ASSI { 499}
( segid " " and resid 124 and name HG2%)
( segid " " and resid 124 and name HG1%)
1.700 0.400 0.500 peak 499 spectrum 1 weight 0.10000E+01 volume 0.31241E-01 ppm1 0.807 ppm2 0.520 CV 1
ASSI { 500}
( segid " " and resid 124 and name HG2%)
( segid " " and resid 130 and name HD2%)
1.600 0.300 0.600 peak 500 spectrum 1 weight 0.10000E+01 volume 0.42043E-01 ppm1 0.807 ppm2 0.938 CV 1
OR { 500}
( segid " " and resid 124 and name HG2%)
( segid " " and resid 130 and name HD1%)
ASSI { 501}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 129 and name HG2 ))
2.200 0.600 0.600 peak 501 spectrum 1 weight 0.10000E+01 volume 0.57183E-02 ppm1 0.806 ppm2 2.392 CV 1
OR { 501}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 129 and name HG3 ))
ASSI { 503}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 124 and name HB ))
1.900 0.500 0.500 peak 503 spectrum 1 weight 0.10000E+01 volume 0.13885E-01 ppm1 0.807 ppm2 1.895 CV 1
ASSI { 504}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 130 and name HG ))
2.400 0.700 0.700 peak 504 spectrum 1 weight 0.10000E+01 volume 0.85630E-02 ppm1 0.806 ppm2 1.632 CV 1
OR { 504}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 130 and name HB3 ))
ASSI { 510}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 129 and name HG3 ))
3.900 1.900 1.900 peak 510 spectrum 1 weight 0.10000E+01 volume 0.19097E-02 ppm1 0.514 ppm2 2.393 CV 1
OR { 510}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 129 and name HG2 ))
ASSI { 515}
( segid " " and resid 124 and name HG1%)
( segid " " and resid 130 and name HD1%)
1.800 0.400 0.400 peak 515 spectrum 1 weight 0.10000E+01 volume 0.19005E-01 ppm1 0.514 ppm2 0.947 CV 1
OR { 515}
( segid " " and resid 124 and name HG1%)
( segid " " and resid 130 and name HD2%)
ASSI { 518}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 119 and name HA ))
2.500 0.800 0.800 peak 518 spectrum 1 weight 0.10000E+01 volume 0.38708E-02 ppm1 0.515 ppm2 4.146 CV 1
ASSI { 519}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 122 and name HA2 ))
3.000 1.100 1.100 peak 519 spectrum 1 weight 0.10000E+01 volume 0.14949E-02 ppm1 0.514 ppm2 3.975 CV 1
ASSI { 520}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 127 and name HA ))
3.600 1.600 1.600 peak 520 spectrum 1 weight 0.10000E+01 volume 0.17101E-02 ppm1 0.514 ppm2 3.737 CV 1
ASSI { 521}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 115 and name HA ))
3.900 1.900 1.900 peak 521 spectrum 1 weight 0.10000E+01 volume 0.87850E-03 ppm1 0.516 ppm2 3.341 CV 1
ASSI { 523}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 118 and name H ))
4.400 2.400 1.600 peak 523 spectrum 1 weight 0.10000E+01 volume 0.96796E-03 ppm1 0.515 ppm2 8.396 CV 1
ASSI { 524}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 116 and name H ))
3.100 1.200 1.200 peak 524 spectrum 1 weight 0.10000E+01 volume 0.10387E-02 ppm1 0.514 ppm2 8.140 CV 1
ASSI { 525}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 119 and name H ))
3.000 1.100 1.100 peak 525 spectrum 1 weight 0.10000E+01 volume 0.23542E-02 ppm1 0.514 ppm2 7.865 CV 1
ASSI { 527}
( segid " " and resid 124 and name HG1%)
( segid " " and resid 88 and name HE% )
2.900 1.100 1.100 peak 527 spectrum 1 weight 0.10000E+01 volume 0.29280E-02 ppm1 0.514 ppm2 7.211 CV 1
ASSI { 531}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 126 and name H ))
2.100 0.500 0.500 peak 531 spectrum 1 weight 0.10000E+01 volume 0.57040E-02 ppm1 0.805 ppm2 7.597 CV 1
ASSI { 532}
( segid " " and resid 124 and name HG2%)
( segid " " and resid 88 and name HE% )
2.500 2.500 3.500 peak 532 spectrum 1 weight 0.10000E+01 volume 0.10437E-01 ppm1 0.806 ppm2 7.213 CV 1
ASSI { 533}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 124 and name H ))
2.800 1.000 1.000 peak 533 spectrum 1 weight 0.10000E+01 volume 0.49021E-02 ppm1 0.805 ppm2 6.794 CV 1
ASSI { 535}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 126 and name H ))
4.100 2.200 1.900 peak 535 spectrum 1 weight 0.10000E+01 volume 0.16496E-02 ppm1 1.892 ppm2 7.624 CV 1
ASSI { 536}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 124 and name H ))
3.500 1.500 1.500 peak 536 spectrum 1 weight 0.10000E+01 volume 0.11996E-02 ppm1 1.892 ppm2 6.793 CV 1
ASSI { 538}
(( segid " " and resid 124 and name HA ))
(( segid " " and resid 126 and name H ))
4.400 2.500 1.600 peak 538 spectrum 1 weight 0.10000E+01 volume 0.97130E-03 ppm1 4.265 ppm2 7.621 CV 1
ASSI { 540}
(( segid " " and resid 123 and name HB3 ))
(( segid " " and resid 123 and name H ))
4.600 2.700 1.400 peak 540 spectrum 1 weight 0.10000E+01 volume 0.39297E-03 ppm1 0.612 ppm2 7.561 CV 1
ASSI { 541}
(( segid " " and resid 123 and name HA ))
(( segid " " and resid 123 and name H ))
2.900 1.100 1.100 peak 541 spectrum 1 weight 0.10000E+01 volume 0.16418E-02 ppm1 3.962 ppm2 7.565 CV 1
ASSI { 542}
(( segid " " and resid 123 and name HA ))
(( segid " " and resid 124 and name H ))
3.400 1.400 1.400 peak 542 spectrum 1 weight 0.10000E+01 volume 0.87534E-03 ppm1 3.959 ppm2 6.793 CV 1
ASSI { 543}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 123 and name H ))
3.600 1.600 1.600 peak 543 spectrum 1 weight 0.10000E+01 volume 0.23798E-02 ppm1 0.630 ppm2 7.561 CV 1
ASSI { 547}
(( segid " " and resid 123 and name HA ))
( segid " " and resid 88 and name HE% )
4.800 2.900 1.200 peak 547 spectrum 1 weight 0.10000E+01 volume 0.33539E-03 ppm1 3.959 ppm2 7.223 CV 1
ASSI { 548}
(( segid " " and resid 123 and name HA ))
(( segid " " and resid 88 and name HZ ))
4.600 2.700 1.400 peak 548 spectrum 1 weight 0.10000E+01 volume 0.30436E-03 ppm1 3.973 ppm2 7.109 CV 1
ASSI { 549}
(( segid " " and resid 123 and name HB2 ))
( segid " " and resid 88 and name HE% )
6.000 5.000 0.000 peak 549 spectrum 1 weight 0.10000E+01 volume 0.96487E-04 ppm1 1.065 ppm2 7.213 CV 1
ASSI { 550}
(( segid " " and resid 123 and name HB3 ))
( segid " " and resid 88 and name HE% )
3.800 1.800 1.800 peak 550 spectrum 1 weight 0.10000E+01 volume 0.22150E-03 ppm1 0.622 ppm2 7.211 CV 1
ASSI { 552}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 123 and name HA ))
2.400 2.400 3.600 peak 552 spectrum 1 weight 0.10000E+01 volume 0.42744E-02 ppm1 0.631 ppm2 3.957 CV 1
ASSI { 553}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 85 and name HA ))
1.900 1.900 4.100 peak 553 spectrum 1 weight 0.10000E+01 volume 0.39246E-02 ppm1 0.631 ppm2 3.854 CV 1
ASSI { 556}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 88 and name HB3 ))
2.300 0.700 0.700 peak 556 spectrum 1 weight 0.10000E+01 volume 0.10953E-02 ppm1 0.632 ppm2 3.191 CV 1
ASSI { 559}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 85 and name HG3 ))
2.400 0.700 0.700 peak 559 spectrum 1 weight 0.10000E+01 volume 0.47743E-02 ppm1 0.631 ppm2 2.283 CV 1
ASSI { 560}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 123 and name HG ))
2.200 0.600 0.600 peak 560 spectrum 1 weight 0.10000E+01 volume 0.67578E-02 ppm1 0.631 ppm2 1.358 CV 1
ASSI { 562}
( segid " " and resid 123 and name HD1%)
(( segid " " and resid 88 and name HB2 ))
3.500 1.500 1.500 peak 562 spectrum 1 weight 0.10000E+01 volume 0.16110E-02 ppm1 0.789 ppm2 2.978 CV 1
ASSI { 563}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 61 and name HB2 ))
4.400 2.400 1.600 peak 563 spectrum 1 weight 0.10000E+01 volume 0.79708E-03 ppm1 0.785 ppm2 2.703 CV 1
OR { 563}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 61 and name HB3 ))
ASSI { 565}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 55 and name HB ))
2.200 0.600 0.600 peak 565 spectrum 1 weight 0.10000E+01 volume 0.10174E-01 ppm1 0.782 ppm2 2.002 CV 1
ASSI { 566}
( segid " " and resid 55 and name HG2%)
( segid " " and resid 60 and name HB% )
2.800 1.000 1.000 peak 566 spectrum 1 weight 0.10000E+01 volume 0.10330E-01 ppm1 0.783 ppm2 1.238 CV 1
ASSI { 569}
(( segid " " and resid 123 and name HG ))
(( segid " " and resid 118 and name HA ))
5.900 4.400 0.100 peak 569 spectrum 1 weight 0.10000E+01 volume 0.94189E-04 ppm1 1.358 ppm2 3.653 CV 1
ASSI { 572}
(( segid " " and resid 123 and name HB2 ))
(( segid " " and resid 123 and name HB3 ))
2.300 0.600 0.600 peak 572 spectrum 1 weight 0.10000E+01 volume 0.15401E-02 ppm1 1.051 ppm2 0.626 CV 1
OR { 572}
(( segid " " and resid 123 and name HB2 ))
( segid " " and resid 123 and name HD2%)
ASSI { 576}
(( segid " " and resid 123 and name HB3 ))
(( segid " " and resid 123 and name HB2 ))
3.000 3.000 3.000 peak 576 spectrum 1 weight 0.10000E+01 volume 0.19734E-03 ppm1 0.627 ppm2 1.052 CV 1
ASSI { 577}
(( segid " " and resid 123 and name HB3 ))
(( segid " " and resid 123 and name HG ))
4.300 2.300 1.700 peak 577 spectrum 1 weight 0.10000E+01 volume 0.22419E-03 ppm1 0.607 ppm2 1.347 CV 1
ASSI { 578}
(( segid " " and resid 123 and name HB2 ))
(( segid " " and resid 123 and name HG ))
3.300 1.300 1.300 peak 578 spectrum 1 weight 0.10000E+01 volume 0.34494E-03 ppm1 1.048 ppm2 1.342 CV 1
ASSI { 579}
(( segid " " and resid 123 and name HB2 ))
(( segid " " and resid 123 and name HA ))
3.800 1.800 1.800 peak 579 spectrum 1 weight 0.10000E+01 volume 0.47374E-03 ppm1 1.050 ppm2 3.965 CV 1
ASSI { 580}
(( segid " " and resid 123 and name HB3 ))
(( segid " " and resid 123 and name HA ))
3.500 1.500 1.500 peak 580 spectrum 1 weight 0.10000E+01 volume 0.41317E-03 ppm1 0.624 ppm2 3.961 CV 1
ASSI { 581}
(( segid " " and resid 123 and name HG ))
(( segid " " and resid 122 and name H ))
4.700 2.800 1.300 peak 581 spectrum 1 weight 0.10000E+01 volume 0.32480E-03 ppm1 1.338 ppm2 7.830 CV 1
ASSI { 584}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 56 and name H ))
2.700 0.900 0.900 peak 584 spectrum 1 weight 0.10000E+01 volume 0.34610E-02 ppm1 0.784 ppm2 8.093 CV 1
ASSI { 586}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 55 and name H ))
2.400 0.700 0.700 peak 586 spectrum 1 weight 0.10000E+01 volume 0.69533E-02 ppm1 0.781 ppm2 7.494 CV 1
ASSI { 588}
( segid " " and resid 123 and name HD2%)
( segid " " and resid 88 and name HE% )
2.800 0.900 0.900 peak 588 spectrum 1 weight 0.10000E+01 volume 0.19121E-02 ppm1 0.632 ppm2 7.216 CV 1
ASSI { 589}
( segid " " and resid 123 and name HD2%)
( segid " " and resid 88 and name HD% )
3.000 1.200 1.200 peak 589 spectrum 1 weight 0.10000E+01 volume 0.24684E-02 ppm1 0.628 ppm2 7.044 CV 1
OR { 589}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 88 and name HZ ))
ASSI { 592}
(( segid " " and resid 122 and name HA3 ))
(( segid " " and resid 122 and name H ))
3.500 1.600 1.600 peak 592 spectrum 1 weight 0.10000E+01 volume 0.14209E-02 ppm1 3.780 ppm2 7.833 CV 1
ASSI { 593}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 124 and name H ))
4.200 2.200 1.800 peak 593 spectrum 1 weight 0.10000E+01 volume 0.20472E-03 ppm1 3.994 ppm2 6.782 CV 1
ASSI { 594}
(( segid " " and resid 122 and name HA3 ))
(( segid " " and resid 124 and name H ))
5.300 3.500 0.700 peak 594 spectrum 1 weight 0.10000E+01 volume 0.29362E-03 ppm1 3.783 ppm2 6.786 CV 1
ASSI { 595}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 123 and name H ))
3.900 1.900 1.900 peak 595 spectrum 1 weight 0.10000E+01 volume 0.39537E-03 ppm1 4.001 ppm2 7.567 CV 1
ASSI { 602}
(( segid " " and resid 29 and name HA3 ))
(( segid " " and resid 29 and name HA2 ))
2.200 0.600 0.600 peak 602 spectrum 1 weight 0.10000E+01 volume 0.51068E-02 ppm1 3.750 ppm2 4.088 CV 1
ASSI { 604}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 122 and name HA3 ))
2.400 0.700 0.700 peak 604 spectrum 1 weight 0.10000E+01 volume 0.24952E-02 ppm1 4.018 ppm2 3.821 CV 1
ASSI { 605}
(( segid " " and resid 121 and name HB3 ))
(( segid " " and resid 121 and name H ))
3.800 1.800 1.800 peak 605 spectrum 1 weight 0.10000E+01 volume 0.87797E-03 ppm1 1.447 ppm2 8.139 CV 1
ASSI { 606}
(( segid " " and resid 121 and name HB2 ))
(( segid " " and resid 121 and name H ))
3.700 1.700 1.700 peak 606 spectrum 1 weight 0.10000E+01 volume 0.43250E-03 ppm1 1.625 ppm2 8.143 CV 1
ASSI { 608}
(( segid " " and resid 121 and name HA ))
( segid " " and resid 121 and name HD1%)
3.200 1.300 1.300 peak 608 spectrum 1 weight 0.10000E+01 volume 0.55822E-02 ppm1 4.151 ppm2 0.725 CV 1
ASSI { 609}
(( segid " " and resid 121 and name HA ))
( segid " " and resid 121 and name HD2%)
3.100 1.200 1.200 peak 609 spectrum 1 weight 0.10000E+01 volume 0.26719E-02 ppm1 4.153 ppm2 0.609 CV 1
ASSI { 613}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name HA ))
3.500 1.500 1.500 peak 613 spectrum 1 weight 0.10000E+01 volume 0.11202E-02 ppm1 1.561 ppm2 4.462 CV 1
ASSI { 616}
(( segid " " and resid 121 and name HB3 ))
(( segid " " and resid 122 and name H ))
4.500 2.500 1.500 peak 616 spectrum 1 weight 0.10000E+01 volume 0.48344E-03 ppm1 1.442 ppm2 7.836 CV 1
ASSI { 617}
(( segid " " and resid 121 and name HB3 ))
(( segid " " and resid 123 and name H ))
4.900 3.000 1.100 peak 617 spectrum 1 weight 0.10000E+01 volume 0.35844E-03 ppm1 1.446 ppm2 7.553 CV 1
ASSI { 621}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 85 and name HE22))
3.300 1.400 1.400 peak 621 spectrum 1 weight 0.10000E+01 volume 0.11923E-02 ppm1 0.729 ppm2 7.227 CV 1
ASSI { 622}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 123 and name H ))
3.800 1.800 1.800 peak 622 spectrum 1 weight 0.10000E+01 volume 0.11833E-02 ppm1 0.726 ppm2 7.550 CV 1
ASSI { 625}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 118 and name H ))
4.400 2.400 1.600 peak 625 spectrum 1 weight 0.10000E+01 volume 0.35299E-03 ppm1 0.725 ppm2 8.394 CV 1
ASSI { 632}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 88 and name H ))
3.100 1.200 1.200 peak 632 spectrum 1 weight 0.10000E+01 volume 0.21891E-02 ppm1 0.601 ppm2 8.872 CV 1
ASSI { 633}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 20 and name H ))
3.300 1.400 1.400 peak 633 spectrum 1 weight 0.10000E+01 volume 0.27110E-02 ppm1 0.599 ppm2 8.666 CV 1
ASSI { 639}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 121 and name HG ))
2.100 0.600 0.600 peak 639 spectrum 1 weight 0.10000E+01 volume 0.11325E-01 ppm1 0.596 ppm2 1.585 CV 1
OR { 639}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 121 and name HB2 ))
ASSI { 645}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 39 and name HB3 ))
3.000 1.100 1.100 peak 645 spectrum 1 weight 0.10000E+01 volume 0.25051E-02 ppm1 0.598 ppm2 2.859 CV 1
ASSI { 647}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 20 and name HA ))
2.400 0.700 0.700 peak 647 spectrum 1 weight 0.10000E+01 volume 0.61865E-02 ppm1 0.599 ppm2 3.962 CV 1
ASSI { 649}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 39 and name HB2 ))
3.100 1.200 1.200 peak 649 spectrum 1 weight 0.10000E+01 volume 0.19060E-02 ppm1 0.599 ppm2 3.460 CV 1
ASSI { 652}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 121 and name HG ))
2.000 0.500 0.500 peak 652 spectrum 1 weight 0.10000E+01 volume 0.99343E-02 ppm1 0.726 ppm2 1.589 CV 1
OR { 652}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 121 and name HB2 ))
ASSI { 653}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 121 and name HB3 ))
2.400 0.700 0.700 peak 653 spectrum 1 weight 0.10000E+01 volume 0.78106E-02 ppm1 0.726 ppm2 1.457 CV 1
ASSI { 655}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 85 and name HB2 ))
3.400 1.400 1.400 peak 655 spectrum 1 weight 0.10000E+01 volume 0.15948E-02 ppm1 0.728 ppm2 2.264 CV 1
OR { 655}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 85 and name HG3 ))
OR { 655}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 85 and name HB3 ))
ASSI { 656}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 81 and name HG2 ))
2.600 2.600 3.400 peak 656 spectrum 1 weight 0.10000E+01 volume 0.61069E-03 ppm1 0.727 ppm2 2.837 CV 1
ASSI { 657}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 88 and name HB3 ))
4.900 3.000 1.100 peak 657 spectrum 1 weight 0.10000E+01 volume 0.34689E-03 ppm1 0.731 ppm2 3.198 CV 1
ASSI { 659}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 118 and name HA ))
3.300 1.300 1.300 peak 659 spectrum 1 weight 0.10000E+01 volume 0.94104E-03 ppm1 0.726 ppm2 3.663 CV 1
ASSI { 660}
(( segid " " and resid 121 and name HG ))
( segid " " and resid 121 and name HD2%)
2.400 0.700 0.700 peak 660 spectrum 1 weight 0.10000E+01 volume 0.46040E-02 ppm1 1.571 ppm2 0.603 CV 1
ASSI { 661}
(( segid " " and resid 75 and name HG ))
(( segid " " and resid 74 and name HA ))
3.600 1.600 1.600 peak 661 spectrum 1 weight 0.10000E+01 volume 0.25151E-02 ppm1 1.584 ppm2 4.079 CV 1
ASSI { 662}
(( segid " " and resid 75 and name HG ))
(( segid " " and resid 75 and name HA ))
3.300 1.400 1.400 peak 662 spectrum 1 weight 0.10000E+01 volume 0.11980E-02 ppm1 1.585 ppm2 4.459 CV 1
ASSI { 664}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 21 and name HE% )
4.500 2.600 1.500 peak 664 spectrum 1 weight 0.10000E+01 volume 0.37705E-03 ppm1 4.159 ppm2 6.834 CV 1
ASSI { 667}
(( segid " " and resid 112 and name HA ))
( segid " " and resid 115 and name HG2%)
2.500 0.800 0.800 peak 667 spectrum 1 weight 0.10000E+01 volume 0.30708E-02 ppm1 4.065 ppm2 0.947 CV 1
ASSI { 673}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 127 and name HD3 ))
4.700 2.800 1.300 peak 673 spectrum 1 weight 0.10000E+01 volume 0.40248E-03 ppm1 4.044 ppm2 3.278 CV 1
ASSI { 674}
( segid " " and resid 23 and name HB% )
( segid " " and resid 20 and name HD1%)
3.100 1.200 1.200 peak 674 spectrum 1 weight 0.10000E+01 volume 0.26171E-02 ppm1 1.436 ppm2 0.697 CV 1
ASSI { 675}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 116 and name HB2 ))
3.700 1.700 1.700 peak 675 spectrum 1 weight 0.10000E+01 volume 0.11388E-02 ppm1 1.448 ppm2 2.821 CV 1
ASSI { 678}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 21 and name HB3 ))
4.000 2.000 2.000 peak 678 spectrum 1 weight 0.10000E+01 volume 0.66032E-03 ppm1 1.451 ppm2 3.004 CV 1
OR { 678}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 21 and name HB2 ))
ASSI { 682}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 22 and name HA ))
3.900 1.900 1.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.12304E-02 ppm1 1.435 ppm2 3.711 CV 1
ASSI { 683}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 111 and name H ))
5.000 3.100 1.000 peak 683 spectrum 1 weight 0.10000E+01 volume 0.46431E-03 ppm1 1.444 ppm2 8.982 CV 1
ASSI { 684}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 112 and name H ))
2.400 0.700 0.700 peak 684 spectrum 1 weight 0.10000E+01 volume 0.73985E-02 ppm1 1.444 ppm2 8.524 CV 1
ASSI { 689}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 113 and name H ))
3.500 1.600 1.600 peak 689 spectrum 1 weight 0.10000E+01 volume 0.82300E-03 ppm1 4.061 ppm2 7.551 CV 1
ASSI { 690}
( segid " " and resid 120 and name HB% )
( segid " " and resid 121 and name HD1%)
3.200 1.300 1.300 peak 690 spectrum 1 weight 0.10000E+01 volume 0.35733E-02 ppm1 1.450 ppm2 0.716 CV 1
ASSI { 691}
( segid " " and resid 120 and name HB% )
( segid " " and resid 121 and name HD2%)
2.700 0.900 0.900 peak 691 spectrum 1 weight 0.10000E+01 volume 0.45333E-02 ppm1 1.450 ppm2 0.598 CV 1
ASSI { 692}
( segid " " and resid 112 and name HB% )
( segid " " and resid 115 and name HG2%)
3.100 1.200 1.200 peak 692 spectrum 1 weight 0.10000E+01 volume 0.63002E-02 ppm1 1.439 ppm2 0.958 CV 1
ASSI { 693}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 116 and name HB3 ))
3.900 1.900 1.900 peak 693 spectrum 1 weight 0.10000E+01 volume 0.10070E-02 ppm1 1.450 ppm2 2.666 CV 1
ASSI { 694}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 113 and name H ))
2.800 1.000 1.000 peak 694 spectrum 1 weight 0.10000E+01 volume 0.40472E-02 ppm1 1.445 ppm2 7.546 CV 1
ASSI { 696}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 114 and name HG12))
1.900 1.900 4.100 peak 696 spectrum 1 weight 0.10000E+01 volume 0.35083E-02 ppm1 0.733 ppm2 1.220 CV 1
ASSI { 697}
( segid " " and resid 120 and name HB% )
(( segid " " and resid 118 and name HA ))
3.700 1.700 1.700 peak 697 spectrum 1 weight 0.10000E+01 volume 0.99632E-03 ppm1 1.443 ppm2 3.660 CV 1
ASSI { 700}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name H ))
2.700 0.900 0.900 peak 700 spectrum 1 weight 0.10000E+01 volume 0.37235E-02 ppm1 3.968 ppm2 7.863 CV 1
ASSI { 701}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 24 and name HD21))
3.500 1.500 1.500 peak 701 spectrum 1 weight 0.10000E+01 volume 0.16649E-02 ppm1 3.960 ppm2 8.101 CV 1
ASSI { 703}
( segid " " and resid 119 and name HD1%)
( segid " " and resid 124 and name HG1%)
1.700 0.400 0.500 peak 703 spectrum 1 weight 0.10000E+01 volume 0.20048E-01 ppm1 0.656 ppm2 0.527 CV 1
ASSI { 705}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 129 and name HG2 ))
4.300 2.300 1.700 peak 705 spectrum 1 weight 0.10000E+01 volume 0.10550E-02 ppm1 0.655 ppm2 2.387 CV 1
OR { 705}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 129 and name HG3 ))
ASSI { 709}
( segid " " and resid 119 and name HD1%)
( segid " " and resid 130 and name HD2%)
2.200 0.600 0.600 peak 709 spectrum 1 weight 0.10000E+01 volume 0.14335E-01 ppm1 0.657 ppm2 0.944 CV 1
OR { 709}
( segid " " and resid 119 and name HD1%)
( segid " " and resid 130 and name HD1%)
ASSI { 710}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 127 and name HD3 ))
3.700 1.700 1.700 peak 710 spectrum 1 weight 0.10000E+01 volume 0.14097E-02 ppm1 0.657 ppm2 3.282 CV 1
ASSI { 713}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 119 and name HA ))
2.500 0.800 0.800 peak 713 spectrum 1 weight 0.10000E+01 volume 0.76859E-02 ppm1 0.656 ppm2 4.143 CV 1
ASSI { 714}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 127 and name HA ))
2.600 0.900 0.900 peak 714 spectrum 1 weight 0.10000E+01 volume 0.26684E-02 ppm1 0.656 ppm2 3.746 CV 1
ASSI { 715}
( segid " " and resid 119 and name HD2%)
( segid " " and resid 119 and name HD1%)
1.800 0.400 0.400 peak 715 spectrum 1 weight 0.10000E+01 volume 0.39119E-01 ppm1 0.802 ppm2 0.669 CV 1
ASSI { 716}
( segid " " and resid 119 and name HD2%)
( segid " " and resid 124 and name HG1%)
3.200 1.200 1.200 peak 716 spectrum 1 weight 0.10000E+01 volume 0.91996E-02 ppm1 0.802 ppm2 0.522 CV 1
ASSI { 719}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 21 and name HB2 ))
2.500 0.800 0.800 peak 719 spectrum 1 weight 0.10000E+01 volume 0.22962E-02 ppm1 0.825 ppm2 3.037 CV 1
OR { 719}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 21 and name HB3 ))
ASSI { 722}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 116 and name HB3 ))
4.200 2.200 1.800 peak 722 spectrum 1 weight 0.10000E+01 volume 0.10813E-02 ppm1 0.803 ppm2 2.666 CV 1
ASSI { 725}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 59 and name HA ))
3.400 1.500 1.500 peak 725 spectrum 1 weight 0.10000E+01 volume 0.37634E-02 ppm1 0.822 ppm2 4.194 CV 1
ASSI { 729}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 127 and name H ))
3.400 1.500 1.500 peak 729 spectrum 1 weight 0.10000E+01 volume 0.10816E-02 ppm1 0.655 ppm2 9.028 CV 1
ASSI { 730}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 125 and name H ))
4.500 2.500 1.500 peak 730 spectrum 1 weight 0.10000E+01 volume 0.98610E-03 ppm1 0.655 ppm2 8.860 CV 1
ASSI { 732}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 118 and name H ))
4.300 2.300 1.700 peak 732 spectrum 1 weight 0.10000E+01 volume 0.51175E-03 ppm1 0.656 ppm2 8.394 CV 1
ASSI { 734}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 119 and name H ))
2.200 0.600 0.600 peak 734 spectrum 1 weight 0.10000E+01 volume 0.37195E-02 ppm1 0.656 ppm2 7.871 CV 1
ASSI { 736}
( segid " " and resid 119 and name HD1%)
( segid " " and resid 88 and name HE% )
5.000 3.200 1.000 peak 736 spectrum 1 weight 0.10000E+01 volume 0.45575E-03 ppm1 0.654 ppm2 7.218 CV 1
ASSI { 740}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 126 and name H ))
3.800 1.800 1.800 peak 740 spectrum 1 weight 0.10000E+01 volume 0.47760E-03 ppm1 1.540 ppm2 7.630 CV 1
ASSI { 741}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 119 and name H ))
3.400 1.400 1.400 peak 741 spectrum 1 weight 0.10000E+01 volume 0.26745E-02 ppm1 1.548 ppm2 7.874 CV 1
ASSI { 744}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name H ))
3.200 1.300 1.300 peak 744 spectrum 1 weight 0.10000E+01 volume 0.22537E-02 ppm1 1.556 ppm2 8.588 CV 1
ASSI { 748}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 9 and name HZ3 ))
3.500 1.500 1.500 peak 748 spectrum 1 weight 0.10000E+01 volume 0.38861E-03 ppm1 1.781 ppm2 6.808 CV 1
ASSI { 750}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 27 and name HA ))
3.500 1.500 1.500 peak 750 spectrum 1 weight 0.10000E+01 volume 0.22476E-02 ppm1 4.148 ppm2 3.906 CV 1
ASSI { 753}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 119 and name HA ))
2.700 0.900 0.900 peak 753 spectrum 1 weight 0.10000E+01 volume 0.21809E-02 ppm1 1.546 ppm2 4.140 CV 1
ASSI { 754}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HE2 ))
4.300 2.300 1.700 peak 754 spectrum 1 weight 0.10000E+01 volume 0.10194E-02 ppm1 4.149 ppm2 2.890 CV 1
OR { 754}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HE3 ))
ASSI { 757}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HG2 ))
2.400 0.700 0.700 peak 757 spectrum 1 weight 0.10000E+01 volume 0.79267E-02 ppm1 4.150 ppm2 2.270 CV 1
OR { 757}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HG3 ))
ASSI { 758}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB2 ))
2.300 0.600 0.600 peak 758 spectrum 1 weight 0.10000E+01 volume 0.10553E-01 ppm1 4.149 ppm2 1.991 CV 1
OR { 758}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB3 ))
ASSI { 759}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HD3 ))
3.100 1.200 1.200 peak 759 spectrum 1 weight 0.10000E+01 volume 0.58145E-02 ppm1 4.148 ppm2 1.586 CV 1
OR { 759}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HD2 ))
ASSI { 763}
(( segid " " and resid 119 and name HB2 ))
( segid " " and resid 124 and name HG1%)
4.100 2.100 1.900 peak 763 spectrum 1 weight 0.10000E+01 volume 0.13322E-02 ppm1 1.761 ppm2 0.530 CV 1
ASSI { 764}
(( segid " " and resid 119 and name HB2 ))
( segid " " and resid 119 and name HD1%)
2.700 0.900 0.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.28323E-02 ppm1 1.757 ppm2 0.655 CV 1
ASSI { 765}
(( segid " " and resid 119 and name HB2 ))
( segid " " and resid 119 and name HD2%)
2.700 0.900 0.900 peak 765 spectrum 1 weight 0.10000E+01 volume 0.43415E-02 ppm1 1.753 ppm2 0.814 CV 1
ASSI { 767}
(( segid " " and resid 119 and name HB2 ))
(( segid " " and resid 119 and name HB3 ))
2.000 0.500 0.500 peak 767 spectrum 1 weight 0.10000E+01 volume 0.58384E-02 ppm1 1.760 ppm2 1.546 CV 1
OR { 767}
(( segid " " and resid 119 and name HB2 ))
(( segid " " and resid 119 and name HG ))
ASSI { 768}
(( segid " " and resid 119 and name HG ))
( segid " " and resid 119 and name HD1%)
2.100 0.600 0.600 peak 768 spectrum 1 weight 0.10000E+01 volume 0.71757E-02 ppm1 1.549 ppm2 0.660 CV 1
ASSI { 769}
(( segid " " and resid 119 and name HG ))
( segid " " and resid 124 and name HG1%)
2.800 1.000 1.000 peak 769 spectrum 1 weight 0.10000E+01 volume 0.30760E-02 ppm1 1.548 ppm2 0.520 CV 1
ASSI { 773}
(( segid " " and resid 118 and name HB2 ))
(( segid " " and resid 118 and name H ))
3.300 1.300 1.300 peak 773 spectrum 1 weight 0.10000E+01 volume 0.33756E-03 ppm1 2.025 ppm2 8.398 CV 1
ASSI { 774}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name H ))
3.100 1.200 1.200 peak 774 spectrum 1 weight 0.10000E+01 volume 0.62802E-03 ppm1 0.734 ppm2 8.297 CV 1
ASSI { 779}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 117 and name H ))
3.200 1.200 1.200 peak 779 spectrum 1 weight 0.10000E+01 volume 0.11481E-02 ppm1 4.003 ppm2 7.539 CV 1
ASSI { 784}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 117 and name H ))
3.200 1.300 1.300 peak 784 spectrum 1 weight 0.10000E+01 volume 0.10729E-02 ppm1 4.300 ppm2 7.532 CV 1
ASSI { 785}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 116 and name H ))
2.700 0.900 0.900 peak 785 spectrum 1 weight 0.10000E+01 volume 0.25294E-02 ppm1 4.293 ppm2 8.117 CV 1
ASSI { 787}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 118 and name H ))
4.100 2.100 1.900 peak 787 spectrum 1 weight 0.10000E+01 volume 0.30928E-03 ppm1 4.303 ppm2 8.371 CV 1
ASSI { 794}
(( segid " " and resid 1 and name HB3 ))
(( segid " " and resid 1 and name HA ))
3.000 1.100 1.100 peak 794 spectrum 1 weight 0.10000E+01 volume 0.16225E-02 ppm1 2.662 ppm2 4.602 CV 1
ASSI { 795}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 116 and name HB3 ))
3.200 1.200 1.200 peak 795 spectrum 1 weight 0.10000E+01 volume 0.21095E-02 ppm1 4.293 ppm2 2.671 CV 1
ASSI { 796}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 116 and name HB2 ))
2.700 0.900 0.900 peak 796 spectrum 1 weight 0.10000E+01 volume 0.16592E-02 ppm1 4.293 ppm2 2.813 CV 1
ASSI { 806}
(( segid " " and resid 68 and name HA ))
( segid " " and resid 63 and name HG1%)
3.500 1.500 1.500 peak 806 spectrum 1 weight 0.10000E+01 volume 0.13811E-02 ppm1 4.296 ppm2 0.914 CV 1
OR { 806}
(( segid " " and resid 68 and name HA ))
( segid " " and resid 63 and name HG2%)
ASSI { 807}
(( segid " " and resid 116 and name HB3 ))
( segid " " and resid 119 and name HD1%)
5.400 3.700 0.600 peak 807 spectrum 1 weight 0.10000E+01 volume 0.33293E-03 ppm1 2.664 ppm2 0.640 CV 1
ASSI { 811}
(( segid " " and resid 116 and name HA ))
( segid " " and resid 124 and name HG1%)
5.200 3.400 0.800 peak 811 spectrum 1 weight 0.10000E+01 volume 0.40295E-03 ppm1 4.290 ppm2 0.527 CV 1
ASSI { 812}
(( segid " " and resid 116 and name HA ))
( segid " " and resid 119 and name HD1%)
2.900 1.100 1.100 peak 812 spectrum 1 weight 0.10000E+01 volume 0.10967E-02 ppm1 4.296 ppm2 0.666 CV 1
ASSI { 814}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 118 and name HB2 ))
3.000 1.200 1.200 peak 814 spectrum 1 weight 0.10000E+01 volume 0.60280E-03 ppm1 3.357 ppm2 2.017 CV 1
ASSI { 817}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 130 and name HG ))
4.800 2.900 1.200 peak 817 spectrum 1 weight 0.10000E+01 volume 0.40580E-03 ppm1 3.354 ppm2 1.622 CV 1
ASSI { 826}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HG3 ))
2.100 0.600 0.600 peak 826 spectrum 1 weight 0.10000E+01 volume 0.13379E-01 ppm1 2.235 ppm2 1.952 CV 1
OR { 826}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HG2 ))
ASSI { 827}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HB2 ))
1.600 0.300 0.600 peak 827 spectrum 1 weight 0.10000E+01 volume 0.22481E-01 ppm1 2.236 ppm2 1.718 CV 1
ASSI { 829}
(( segid " " and resid 7 and name HB3 ))
( segid " " and resid 8 and name HG2%)
4.200 2.200 1.800 peak 829 spectrum 1 weight 0.10000E+01 volume 0.15221E-02 ppm1 2.233 ppm2 1.254 CV 1
ASSI { 835}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 124 and name HG1%)
4.500 2.500 1.500 peak 835 spectrum 1 weight 0.10000E+01 volume 0.56711E-03 ppm1 2.214 ppm2 0.525 CV 1
ASSI { 841}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 130 and name HG ))
3.100 1.200 1.200 peak 841 spectrum 1 weight 0.10000E+01 volume 0.46110E-02 ppm1 1.125 ppm2 1.627 CV 1
ASSI { 844}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HG ))
2.200 0.600 0.600 peak 844 spectrum 1 weight 0.10000E+01 volume 0.84459E-02 ppm1 1.105 ppm2 2.171 CV 1
OR { 844}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HB2 ))
ASSI { 847}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 8 and name HA ))
4.300 2.400 1.700 peak 847 spectrum 1 weight 0.10000E+01 volume 0.79888E-03 ppm1 2.233 ppm2 4.200 CV 1
OR { 847}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 8 and name HB ))
ASSI { 848}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HD2 ))
3.800 1.800 1.800 peak 848 spectrum 1 weight 0.10000E+01 volume 0.18500E-02 ppm1 2.234 ppm2 3.815 CV 1
ASSI { 849}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HD3 ))
3.600 1.700 1.700 peak 849 spectrum 1 weight 0.10000E+01 volume 0.18746E-02 ppm1 2.233 ppm2 3.556 CV 1
ASSI { 851}
(( segid " " and resid 115 and name HB ))
(( segid " " and resid 115 and name HA ))
2.900 1.000 1.000 peak 851 spectrum 1 weight 0.10000E+01 volume 0.10669E-02 ppm1 2.220 ppm2 3.352 CV 1
ASSI { 852}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HA ))
2.700 0.900 0.900 peak 852 spectrum 1 weight 0.10000E+01 volume 0.43620E-02 ppm1 1.088 ppm2 4.122 CV 1
ASSI { 853}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 112 and name HA ))
3.000 1.200 1.200 peak 853 spectrum 1 weight 0.10000E+01 volume 0.32475E-02 ppm1 1.125 ppm2 4.065 CV 1
ASSI { 855}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 127 and name HA ))
4.400 2.400 1.600 peak 855 spectrum 1 weight 0.10000E+01 volume 0.83444E-03 ppm1 1.128 ppm2 3.725 CV 1
ASSI { 856}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 115 and name HA ))
2.500 0.800 0.800 peak 856 spectrum 1 weight 0.10000E+01 volume 0.47232E-02 ppm1 1.127 ppm2 3.348 CV 1
ASSI { 857}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HA ))
2.400 0.700 0.700 peak 857 spectrum 1 weight 0.10000E+01 volume 0.43145E-02 ppm1 1.104 ppm2 4.255 CV 1
ASSI { 859}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 101 and name HA ))
3.000 1.100 1.100 peak 859 spectrum 1 weight 0.10000E+01 volume 0.17733E-02 ppm1 1.102 ppm2 3.625 CV 1
ASSI { 862}
( segid " " and resid 63 and name HG1%)
( segid " " and resid 51 and name HG2%)
2.900 1.000 1.000 peak 862 spectrum 1 weight 0.10000E+01 volume 0.16413E-01 ppm1 0.939 ppm2 0.673 CV 1
ASSI { 863}
( segid " " and resid 115 and name HG2%)
( segid " " and resid 115 and name HG1%)
1.800 0.400 0.400 peak 863 spectrum 1 weight 0.10000E+01 volume 0.27103E-01 ppm1 0.957 ppm2 1.126 CV 1
ASSI { 865}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 33 and name HB ))
2.000 0.500 0.500 peak 865 spectrum 1 weight 0.10000E+01 volume 0.90511E-02 ppm1 0.955 ppm2 2.335 CV 1
ASSI { 867}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name HB2 ))
2.700 0.900 0.900 peak 867 spectrum 1 weight 0.10000E+01 volume 0.11113E-01 ppm1 0.948 ppm2 1.904 CV 1
ASSI { 870}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 115 and name HA ))
2.700 0.900 0.900 peak 870 spectrum 1 weight 0.10000E+01 volume 0.56487E-02 ppm1 0.958 ppm2 3.342 CV 1
ASSI { 871}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 116 and name HB2 ))
3.400 1.400 1.400 peak 871 spectrum 1 weight 0.10000E+01 volume 0.13718E-02 ppm1 0.960 ppm2 2.828 CV 1
ASSI { 872}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 116 and name HB3 ))
4.300 2.300 1.700 peak 872 spectrum 1 weight 0.10000E+01 volume 0.10065E-02 ppm1 0.951 ppm2 2.658 CV 1
ASSI { 873}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 24 and name HB2 ))
3.700 1.700 1.700 peak 873 spectrum 1 weight 0.10000E+01 volume 0.30732E-02 ppm1 0.973 ppm2 2.489 CV 1
ASSI { 874}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 27 and name HB ))
2.000 0.500 0.500 peak 874 spectrum 1 weight 0.10000E+01 volume 0.18742E-01 ppm1 0.974 ppm2 2.108 CV 1
ASSI { 875}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 127 and name HB3 ))
2.500 0.800 0.800 peak 875 spectrum 1 weight 0.10000E+01 volume 0.89126E-02 ppm1 0.961 ppm2 1.862 CV 1
OR { 875}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 127 and name HB2 ))
ASSI { 876}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 127 and name HG2 ))
2.100 0.600 0.600 peak 876 spectrum 1 weight 0.10000E+01 volume 0.81421E-02 ppm1 0.957 ppm2 1.743 CV 1
ASSI { 878}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 63 and name HB ))
1.900 0.500 0.500 peak 878 spectrum 1 weight 0.10000E+01 volume 0.22337E-01 ppm1 0.940 ppm2 2.212 CV 1
ASSI { 882}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 27 and name HA ))
2.500 0.800 0.800 peak 882 spectrum 1 weight 0.10000E+01 volume 0.11301E-01 ppm1 0.974 ppm2 3.891 CV 1
ASSI { 885}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 118 and name H ))
3.900 1.900 1.900 peak 885 spectrum 1 weight 0.10000E+01 volume 0.38206E-03 ppm1 3.355 ppm2 8.398 CV 1
ASSI { 893}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 66 and name HD% )
4.300 2.300 1.700 peak 893 spectrum 1 weight 0.10000E+01 volume 0.90733E-03 ppm1 2.211 ppm2 7.291 CV 1
ASSI { 894}
(( segid " " and resid 97 and name HB ))
( segid " " and resid 88 and name HE% )
4.300 2.300 1.700 peak 894 spectrum 1 weight 0.10000E+01 volume 0.55292E-03 ppm1 2.213 ppm2 7.191 CV 1
ASSI { 896}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 115 and name H ))
2.100 0.600 0.600 peak 896 spectrum 1 weight 0.10000E+01 volume 0.57967E-02 ppm1 1.127 ppm2 8.553 CV 1
ASSI { 903}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 88 and name H ))
4.300 2.300 1.700 peak 903 spectrum 1 weight 0.10000E+01 volume 0.97785E-03 ppm1 1.102 ppm2 8.893 CV 1
ASSI { 904}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name H ))
3.700 1.700 1.700 peak 904 spectrum 1 weight 0.10000E+01 volume 0.23647E-02 ppm1 1.104 ppm2 8.672 CV 1
ASSI { 905}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 90 and name H ))
4.200 2.200 1.800 peak 905 spectrum 1 weight 0.10000E+01 volume 0.11772E-02 ppm1 1.103 ppm2 7.908 CV 1
ASSI { 907}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 107 and name H ))
5.500 3.800 0.500 peak 907 spectrum 1 weight 0.10000E+01 volume 0.49992E-03 ppm1 1.107 ppm2 7.642 CV 1
ASSI { 909}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 104 and name H ))
3.800 1.800 1.800 peak 909 spectrum 1 weight 0.10000E+01 volume 0.13090E-02 ppm1 1.103 ppm2 7.366 CV 1
ASSI { 910}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 91 and name HD% )
2.700 0.900 0.900 peak 910 spectrum 1 weight 0.10000E+01 volume 0.55698E-02 ppm1 1.103 ppm2 7.078 CV 1
OR { 910}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 91 and name HZ ))
ASSI { 912}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 18 and name H ))
3.900 1.900 1.900 peak 912 spectrum 1 weight 0.10000E+01 volume 0.17108E-02 ppm1 0.955 ppm2 8.326 CV 1
ASSI { 916}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 28 and name H ))
3.000 1.100 1.100 peak 916 spectrum 1 weight 0.10000E+01 volume 0.60382E-02 ppm1 0.973 ppm2 8.616 CV 1
ASSI { 919}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 116 and name H ))
2.300 0.700 0.700 peak 919 spectrum 1 weight 0.10000E+01 volume 0.41714E-02 ppm1 0.960 ppm2 8.105 CV 1
ASSI { 923}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 27 and name H ))
2.200 0.600 0.600 peak 923 spectrum 1 weight 0.10000E+01 volume 0.95521E-02 ppm1 0.975 ppm2 7.302 CV 1
ASSI { 927}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 64 and name H ))
2.600 0.800 0.800 peak 927 spectrum 1 weight 0.10000E+01 volume 0.36500E-02 ppm1 0.938 ppm2 8.280 CV 1
ASSI { 931}
(( segid " " and resid 114 and name HB ))
(( segid " " and resid 114 and name HG12))
3.300 1.400 1.400 peak 931 spectrum 1 weight 0.10000E+01 volume 0.94235E-03 ppm1 2.257 ppm2 1.245 CV 1
ASSI { 933}
(( segid " " and resid 114 and name HB ))
( segid " " and resid 114 and name HG2%)
2.200 0.600 0.600 peak 933 spectrum 1 weight 0.10000E+01 volume 0.70044E-02 ppm1 2.260 ppm2 0.943 CV 1
OR { 933}
(( segid " " and resid 114 and name HB ))
( segid " " and resid 114 and name HD1%)
ASSI { 935}
(( segid " " and resid 47 and name HB2 ))
( segid " " and resid 51 and name HG2%)
3.800 1.800 1.800 peak 935 spectrum 1 weight 0.10000E+01 volume 0.19131E-02 ppm1 1.866 ppm2 0.668 CV 1
OR { 935}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 51 and name HG2%)
ASSI { 936}
(( segid " " and resid 114 and name HG13))
( segid " " and resid 114 and name HD1%)
2.200 0.600 0.600 peak 936 spectrum 1 weight 0.10000E+01 volume 0.92599E-02 ppm1 1.856 ppm2 0.953 CV 1
OR { 936}
(( segid " " and resid 114 and name HG13))
( segid " " and resid 114 and name HG2%)
ASSI { 938}
(( segid " " and resid 114 and name HG13))
(( segid " " and resid 114 and name HG12))
2.000 0.500 0.500 peak 938 spectrum 1 weight 0.10000E+01 volume 0.25842E-02 ppm1 1.856 ppm2 1.247 CV 1
ASSI { 939}
(( segid " " and resid 114 and name HG12))
( segid " " and resid 114 and name HD1%)
2.200 0.600 0.600 peak 939 spectrum 1 weight 0.10000E+01 volume 0.55759E-02 ppm1 1.242 ppm2 0.954 CV 1
OR { 939}
(( segid " " and resid 114 and name HG12))
( segid " " and resid 114 and name HG2%)
ASSI { 947}
(( segid " " and resid 114 and name HG13))
(( segid " " and resid 114 and name HA ))
2.800 1.000 1.000 peak 947 spectrum 1 weight 0.10000E+01 volume 0.17269E-02 ppm1 1.857 ppm2 3.888 CV 1
ASSI { 948}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 111 and name HA ))
4.800 2.900 1.200 peak 948 spectrum 1 weight 0.10000E+01 volume 0.41207E-03 ppm1 1.244 ppm2 3.998 CV 1
ASSI { 951}
(( segid " " and resid 127 and name HB2 ))
(( segid " " and resid 126 and name HA ))
4.700 2.700 1.300 peak 951 spectrum 1 weight 0.10000E+01 volume 0.72612E-03 ppm1 1.877 ppm2 4.558 CV 1
OR { 951}
(( segid " " and resid 127 and name HB3 ))
(( segid " " and resid 126 and name HA ))
ASSI { 952}
( segid " " and resid 36 and name HG2%)
( segid " " and resid 20 and name HD2%)
3.100 1.200 1.200 peak 952 spectrum 1 weight 0.10000E+01 volume 0.68668E-02 ppm1 0.971 ppm2 0.612 CV 1
ASSI { 953}
( segid " " and resid 114 and name HG2%)
( segid " " and resid 84 and name HD2%)
2.300 0.700 0.700 peak 953 spectrum 1 weight 0.10000E+01 volume 0.58691E-02 ppm1 0.949 ppm2 0.610 CV 1
ASSI { 954}
( segid " " and resid 114 and name HG2%)
( segid " " and resid 118 and name HD1%)
2.400 0.700 0.700 peak 954 spectrum 1 weight 0.10000E+01 volume 0.45012E-02 ppm1 0.947 ppm2 0.518 CV 1
ASSI { 956}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 114 and name HG12))
2.100 0.600 0.600 peak 956 spectrum 1 weight 0.10000E+01 volume 0.66098E-02 ppm1 0.951 ppm2 1.231 CV 1
ASSI { 960}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 115 and name HA ))
3.000 1.100 1.100 peak 960 spectrum 1 weight 0.10000E+01 volume 0.13188E-02 ppm1 0.951 ppm2 3.349 CV 1
ASSI { 961}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 114 and name HA ))
2.500 0.800 0.800 peak 961 spectrum 1 weight 0.10000E+01 volume 0.36996E-02 ppm1 0.950 ppm2 3.879 CV 1
ASSI { 962}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 111 and name HA ))
3.000 1.200 1.200 peak 962 spectrum 1 weight 0.10000E+01 volume 0.35278E-02 ppm1 0.949 ppm2 3.991 CV 1
ASSI { 965}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 114 and name H ))
3.300 1.300 1.300 peak 965 spectrum 1 weight 0.10000E+01 volume 0.34000E-02 ppm1 0.950 ppm2 8.099 CV 1
ASSI { 966}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 115 and name H ))
2.800 1.000 1.000 peak 966 spectrum 1 weight 0.10000E+01 volume 0.26719E-02 ppm1 0.952 ppm2 8.561 CV 1
ASSI { 968}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 76 and name HH2 ))
3.000 1.100 1.100 peak 968 spectrum 1 weight 0.10000E+01 volume 0.56745E-03 ppm1 1.242 ppm2 6.876 CV 1
ASSI { 969}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 76 and name HZ2 ))
4.000 2.000 2.000 peak 969 spectrum 1 weight 0.10000E+01 volume 0.51860E-03 ppm1 1.240 ppm2 7.085 CV 1
OR { 969}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 76 and name HZ3 ))
ASSI { 970}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 114 and name H ))
4.100 2.100 1.900 peak 970 spectrum 1 weight 0.10000E+01 volume 0.94908E-03 ppm1 1.238 ppm2 8.096 CV 1
ASSI { 971}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 115 and name H ))
4.700 2.800 1.300 peak 971 spectrum 1 weight 0.10000E+01 volume 0.44004E-03 ppm1 1.237 ppm2 8.552 CV 1
ASSI { 972}
(( segid " " and resid 128 and name HB3 ))
(( segid " " and resid 128 and name H ))
2.800 1.000 1.000 peak 972 spectrum 1 weight 0.10000E+01 volume 0.28408E-02 ppm1 1.864 ppm2 8.605 CV 1
OR { 972}
(( segid " " and resid 128 and name HB2 ))
(( segid " " and resid 128 and name H ))
ASSI { 973}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 48 and name H ))
2.800 1.000 1.000 peak 973 spectrum 1 weight 0.10000E+01 volume 0.19767E-02 ppm1 1.880 ppm2 8.332 CV 1
OR { 973}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 48 and name H ))
ASSI { 976}
(( segid " " and resid 114 and name HB ))
(( segid " " and resid 114 and name H ))
2.900 1.000 1.000 peak 976 spectrum 1 weight 0.10000E+01 volume 0.11882E-02 ppm1 2.259 ppm2 8.097 CV 1
ASSI { 977}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 115 and name H ))
4.300 2.300 1.700 peak 977 spectrum 1 weight 0.10000E+01 volume 0.20195E-03 ppm1 3.882 ppm2 8.551 CV 1
ASSI { 978}
(( segid " " and resid 114 and name HB ))
(( segid " " and resid 115 and name H ))
2.800 1.000 1.000 peak 978 spectrum 1 weight 0.10000E+01 volume 0.10106E-02 ppm1 2.251 ppm2 8.553 CV 1
ASSI { 979}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 111 and name H ))
2.900 2.900 3.100 peak 979 spectrum 1 weight 0.10000E+01 volume 0.26524E-03 ppm1 0.954 ppm2 8.986 CV 1
ASSI { 982}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 114 and name H ))
3.200 1.300 1.300 peak 982 spectrum 1 weight 0.10000E+01 volume 0.26942E-02 ppm1 0.953 ppm2 8.096 CV 1
ASSI { 983}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 109 and name H ))
2.200 2.200 3.800 peak 983 spectrum 1 weight 0.10000E+01 volume 0.14182E-02 ppm1 0.952 ppm2 7.628 CV 1
ASSI { 985}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 76 and name HZ2 ))
3.200 1.300 1.300 peak 985 spectrum 1 weight 0.10000E+01 volume 0.14989E-02 ppm1 0.953 ppm2 7.094 CV 1
ASSI { 986}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 76 and name HH2 ))
3.100 1.200 1.200 peak 986 spectrum 1 weight 0.10000E+01 volume 0.13754E-02 ppm1 0.954 ppm2 6.894 CV 1
ASSI { 987}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 111 and name HA ))
2.600 0.900 0.900 peak 987 spectrum 1 weight 0.10000E+01 volume 0.40107E-02 ppm1 0.953 ppm2 4.013 CV 1
ASSI { 988}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 114 and name HA ))
3.600 1.600 1.600 peak 988 spectrum 1 weight 0.10000E+01 volume 0.27941E-02 ppm1 0.952 ppm2 3.872 CV 1
ASSI { 991}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 111 and name HD2 ))
2.700 2.700 3.300 peak 991 spectrum 1 weight 0.10000E+01 volume 0.39560E-03 ppm1 0.957 ppm2 3.250 CV 1
OR { 991}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 111 and name HD3 ))
ASSI { 992}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 109 and name HD2 ))
2.800 0.900 0.900 peak 992 spectrum 1 weight 0.10000E+01 volume 0.30984E-02 ppm1 0.953 ppm2 2.744 CV 1
ASSI { 994}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 109 and name HD3 ))
3.000 1.100 1.100 peak 994 spectrum 1 weight 0.10000E+01 volume 0.16896E-02 ppm1 0.954 ppm2 2.432 CV 1
ASSI { 995}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 114 and name HB ))
2.300 0.700 0.700 peak 995 spectrum 1 weight 0.10000E+01 volume 0.51017E-02 ppm1 0.952 ppm2 2.232 CV 1
ASSI { 996}
( segid " " and resid 114 and name HD1%)
( segid " " and resid 102 and name HE% )
2.300 0.600 0.600 peak 996 spectrum 1 weight 0.10000E+01 volume 0.63057E-02 ppm1 0.953 ppm2 2.166 CV 1
ASSI { 997}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 101 and name HB ))
2.900 1.000 1.000 peak 997 spectrum 1 weight 0.10000E+01 volume 0.27064E-02 ppm1 0.954 ppm2 2.040 CV 1
ASSI { 998}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 114 and name HG13))
2.200 0.600 0.600 peak 998 spectrum 1 weight 0.10000E+01 volume 0.73204E-02 ppm1 0.953 ppm2 1.857 CV 1
ASSI { 1001}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 114 and name HG12))
2.200 0.600 0.600 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.69365E-02 ppm1 0.953 ppm2 1.241 CV 1
ASSI { 1003}
( segid " " and resid 114 and name HD1%)
( segid " " and resid 84 and name HD2%)
3.100 1.200 1.200 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.25876E-02 ppm1 0.953 ppm2 0.607 CV 1
ASSI { 1004}
( segid " " and resid 114 and name HD1%)
( segid " " and resid 118 and name HD1%)
2.100 2.100 3.900 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.17456E-02 ppm1 0.955 ppm2 0.537 CV 1
ASSI { 1007}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name H ))
3.300 1.400 1.400 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.10347E-02 ppm1 4.327 ppm2 7.543 CV 1
ASSI { 1009}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 113 and name H ))
4.700 2.700 1.300 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.69520E-03 ppm1 3.382 ppm2 7.549 CV 1
OR { 1009}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 113 and name H ))
ASSI { 1010}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HD2 ))
3.900 1.900 1.900 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.13233E-02 ppm1 4.323 ppm2 3.383 CV 1
OR { 1010}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HD3 ))
ASSI { 1011}
(( segid " " and resid 113 and name HA ))
( segid " " and resid 112 and name HB% )
3.300 1.300 1.300 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.21314E-02 ppm1 4.316 ppm2 1.459 CV 1
ASSI { 1013}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HG3 ))
3.000 1.100 1.100 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.19645E-02 ppm1 4.327 ppm2 1.916 CV 1
OR { 1013}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HG2 ))
ASSI { 1014}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HB2 ))
3.000 1.100 1.100 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.17274E-02 ppm1 4.324 ppm2 2.212 CV 1
OR { 1014}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HB3 ))
ASSI { 1016}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 109 and name HD3 ))
3.900 1.900 1.900 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.43428E-03 ppm1 3.366 ppm2 2.388 CV 1
OR { 1016}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 109 and name HD3 ))
ASSI { 1018}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 113 and name HB3 ))
3.200 1.300 1.300 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.13470E-02 ppm1 3.390 ppm2 2.210 CV 1
OR { 1018}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 113 and name HB2 ))
OR { 1018}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 113 and name HB3 ))
OR { 1018}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 113 and name HB2 ))
ASSI { 1019}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 113 and name HG2 ))
2.500 0.800 0.800 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.43999E-02 ppm1 3.370 ppm2 1.913 CV 1
OR { 1019}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 113 and name HG2 ))
OR { 1019}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 113 and name HG3 ))
OR { 1019}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 113 and name HG3 ))
ASSI { 1023}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 74 and name HA ))
4.300 2.300 1.700 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.52076E-03 ppm1 3.383 ppm2 4.082 CV 1
OR { 1023}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 74 and name HA ))
ASSI { 1024}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 114 and name HA ))
4.200 2.200 1.800 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.63308E-03 ppm1 3.390 ppm2 3.906 CV 1
OR { 1024}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 114 and name HA ))
ASSI { 1036}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 114 and name H ))
4.700 2.800 1.300 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.48281E-03 ppm1 3.376 ppm2 8.098 CV 1
OR { 1036}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 114 and name H ))
ASSI { 1039}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 111 and name H ))
3.400 1.500 1.500 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.64744E-03 ppm1 3.994 ppm2 8.993 CV 1
ASSI { 1041}
(( segid " " and resid 111 and name HB2 ))
(( segid " " and resid 111 and name H ))
3.000 1.200 1.200 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.90034E-03 ppm1 1.941 ppm2 9.000 CV 1
ASSI { 1044}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 9 and name HZ3 ))
3.700 1.700 1.700 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.38815E-03 ppm1 3.983 ppm2 6.819 CV 1
ASSI { 1048}
(( segid " " and resid 110 and name HB3 ))
(( segid " " and resid 111 and name H ))
4.000 2.000 2.000 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.57337E-03 ppm1 3.992 ppm2 9.006 CV 1
ASSI { 1051}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 102 and name HG2 ))
4.300 2.300 1.700 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.52851E-03 ppm1 4.444 ppm2 2.725 CV 1
ASSI { 1052}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 102 and name HG3 ))
4.500 2.600 1.500 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.25263E-03 ppm1 4.443 ppm2 2.619 CV 1
ASSI { 1053}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 110 and name HB3 ))
3.300 1.400 1.400 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.13804E-02 ppm1 4.446 ppm2 3.995 CV 1
ASSI { 1057}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 64 and name H ))
3.000 1.100 1.100 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.14304E-02 ppm1 4.001 ppm2 8.287 CV 1
ASSI { 1059}
(( segid " " and resid 110 and name HB3 ))
(( segid " " and resid 110 and name HB2 ))
2.700 0.900 0.900 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.12194E-02 ppm1 3.987 ppm2 4.296 CV 1
ASSI { 1062}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HB3 ))
1.700 0.400 0.500 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.12570E-01 ppm1 4.001 ppm2 3.767 CV 1
ASSI { 1067}
(( segid " " and resid 109 and name HB2 ))
(( segid " " and resid 109 and name H ))
3.800 1.800 1.800 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.50677E-03 ppm1 1.785 ppm2 7.634 CV 1
ASSI { 1068}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 109 and name H ))
3.900 1.900 1.900 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.49411E-03 ppm1 1.486 ppm2 7.635 CV 1
ASSI { 1070}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HG2 ))
3.500 1.500 1.500 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.10833E-02 ppm1 4.617 ppm2 1.380 CV 1
ASSI { 1071}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HB3 ))
3.000 1.100 1.100 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.20402E-02 ppm1 4.606 ppm2 1.476 CV 1
OR { 1071}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HG3 ))
ASSI { 1072}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HB2 ))
3.000 1.200 1.200 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.18286E-02 ppm1 4.613 ppm2 1.790 CV 1
ASSI { 1073}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HD2 ))
4.300 2.300 1.700 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.89645E-03 ppm1 4.618 ppm2 2.787 CV 1
ASSI { 1074}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HD3 ))
4.500 2.600 1.500 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.54768E-03 ppm1 4.612 ppm2 2.423 CV 1
ASSI { 1076}
(( segid " " and resid 109 and name HB2 ))
(( segid " " and resid 114 and name H ))
4.200 2.200 1.800 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.41626E-03 ppm1 1.760 ppm2 8.101 CV 1
ASSI { 1084}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 17 and name H ))
4.700 2.700 1.300 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.41074E-03 ppm1 1.493 ppm2 8.765 CV 1
ASSI { 1085}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 109 and name H ))
4.400 2.400 1.600 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.33946E-03 ppm1 2.783 ppm2 7.636 CV 1
ASSI { 1086}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 76 and name HZ2 ))
3.400 1.400 1.400 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.83634E-03 ppm1 2.783 ppm2 7.096 CV 1
ASSI { 1087}
(( segid " " and resid 109 and name HD3 ))
(( segid " " and resid 109 and name H ))
4.300 2.300 1.700 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.39681E-03 ppm1 2.424 ppm2 7.639 CV 1
ASSI { 1088}
(( segid " " and resid 109 and name HD3 ))
(( segid " " and resid 76 and name HZ2 ))
3.500 1.500 1.500 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.73649E-03 ppm1 2.424 ppm2 7.092 CV 1
ASSI { 1089}
(( segid " " and resid 109 and name HD3 ))
(( segid " " and resid 76 and name HH2 ))
4.000 2.000 2.000 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.36432E-03 ppm1 2.426 ppm2 6.893 CV 1
ASSI { 1090}
(( segid " " and resid 109 and name HD3 ))
(( segid " " and resid 109 and name HE ))
4.000 2.000 2.000 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.25979E-03 ppm1 2.428 ppm2 6.497 CV 1
ASSI { 1094}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 109 and name HD2 ))
4.300 2.300 1.700 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.38462E-03 ppm1 1.482 ppm2 2.782 CV 1
ASSI { 1095}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 109 and name HD3 ))
3.700 1.700 1.700 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.33491E-03 ppm1 1.484 ppm2 2.428 CV 1
ASSI { 1098}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 109 and name HB2 ))
2.700 0.900 0.900 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.83193E-03 ppm1 1.476 ppm2 1.781 CV 1
ASSI { 1100}
(( segid " " and resid 84 and name HG ))
( segid " " and resid 84 and name HD2%)
2.600 0.800 0.800 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.34847E-02 ppm1 1.466 ppm2 0.621 CV 1
ASSI { 1101}
(( segid " " and resid 84 and name HG ))
( segid " " and resid 118 and name HD1%)
2.900 1.100 1.100 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.22873E-02 ppm1 1.464 ppm2 0.521 CV 1
ASSI { 1103}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 73 and name HG12))
1.400 0.200 0.800 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.26156E-01 ppm1 1.387 ppm2 1.137 CV 1
ASSI { 1108}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 81 and name HB3 ))
3.100 1.200 1.200 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.12585E-02 ppm1 1.389 ppm2 1.984 CV 1
ASSI { 1111}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 109 and name HD3 ))
3.200 1.300 1.300 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.11242E-02 ppm1 1.474 ppm2 2.423 CV 1
ASSI { 1113}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 109 and name HD2 ))
3.200 1.300 1.300 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.82505E-03 ppm1 1.464 ppm2 2.785 CV 1
ASSI { 1114}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 109 and name HD2 ))
3.300 1.400 1.400 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.85093E-03 ppm1 1.370 ppm2 2.787 CV 1
ASSI { 1119}
(( segid " " and resid 59 and name HG ))
(( segid " " and resid 59 and name HA ))
3.300 1.300 1.300 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.15266E-02 ppm1 1.472 ppm2 4.192 CV 1
ASSI { 1120}
(( segid " " and resid 109 and name HD2 ))
( segid " " and resid 107 and name HB% )
3.300 1.400 1.400 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.78931E-03 ppm1 2.785 ppm2 1.161 CV 1
ASSI { 1123}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 109 and name HB2 ))
3.400 1.400 1.400 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.12096E-02 ppm1 2.787 ppm2 1.783 CV 1
ASSI { 1124}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 109 and name HG3 ))
2.800 1.000 1.000 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.22049E-02 ppm1 2.786 ppm2 1.474 CV 1
OR { 1124}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 109 and name HB3 ))
ASSI { 1126}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 109 and name HD3 ))
2.000 0.500 0.500 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.32203E-02 ppm1 2.787 ppm2 2.428 CV 1
ASSI { 1127}
(( segid " " and resid 109 and name HD3 ))
(( segid " " and resid 109 and name HB2 ))
3.500 1.500 1.500 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.10939E-02 ppm1 2.425 ppm2 1.788 CV 1
ASSI { 1128}
(( segid " " and resid 109 and name HD3 ))
(( segid " " and resid 109 and name HG3 ))
2.800 1.000 1.000 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.19262E-02 ppm1 2.425 ppm2 1.471 CV 1
OR { 1128}
(( segid " " and resid 109 and name HD3 ))
(( segid " " and resid 109 and name HB3 ))
ASSI { 1129}
(( segid " " and resid 109 and name HD3 ))
(( segid " " and resid 109 and name HG2 ))
3.000 1.100 1.100 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.16405E-02 ppm1 2.424 ppm2 1.379 CV 1
ASSI { 1134}
(( segid " " and resid 108 and name HA ))
( segid " " and resid 105 and name HG2%)
2.800 1.000 1.000 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.29109E-02 ppm1 4.079 ppm2 1.037 CV 1
OR { 1134}
(( segid " " and resid 108 and name HA ))
( segid " " and resid 105 and name HD1%)
ASSI { 1135}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HB3 ))
2.500 0.800 0.800 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.47739E-02 ppm1 4.080 ppm2 1.735 CV 1
OR { 1135}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HB2 ))
ASSI { 1136}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HD3 ))
3.000 1.100 1.100 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.45399E-02 ppm1 4.079 ppm2 1.596 CV 1
OR { 1136}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HD2 ))
ASSI { 1137}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HE3 ))
3.700 1.700 1.700 peak 1137 spectrum 1 weight 0.10000E+01 volume 0.38987E-03 ppm1 4.081 ppm2 3.004 CV 1
OR { 1137}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HE2 ))
ASSI { 1139}
(( segid " " and resid 108 and name HB3 ))
(( segid " " and resid 109 and name H ))
3.800 1.800 1.800 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.16402E-02 ppm1 1.732 ppm2 7.635 CV 1
OR { 1139}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 109 and name H ))
ASSI { 1142}
(( segid " " and resid 7 and name HB2 ))
( segid " " and resid 8 and name HG2%)
4.300 2.400 1.700 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.12726E-02 ppm1 1.720 ppm2 1.260 CV 1
ASSI { 1143}
(( segid " " and resid 7 and name HB2 ))
( segid " " and resid 43 and name HG1%)
2.700 0.900 0.900 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.39028E-02 ppm1 1.719 ppm2 0.734 CV 1
OR { 1143}
(( segid " " and resid 7 and name HB2 ))
( segid " " and resid 43 and name HG2%)
ASSI { 1144}
(( segid " " and resid 108 and name HB2 ))
( segid " " and resid 107 and name HB% )
4.300 2.300 1.700 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.10971E-02 ppm1 1.731 ppm2 1.151 CV 1
OR { 1144}
(( segid " " and resid 108 and name HB3 ))
( segid " " and resid 107 and name HB% )
ASSI { 1145}
(( segid " " and resid 108 and name HB3 ))
( segid " " and resid 105 and name HG2%)
3.800 1.800 1.800 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.14779E-02 ppm1 1.727 ppm2 1.018 CV 1
OR { 1145}
(( segid " " and resid 108 and name HB2 ))
( segid " " and resid 105 and name HG2%)
OR { 1145}
(( segid " " and resid 108 and name HB2 ))
( segid " " and resid 105 and name HD1%)
OR { 1145}
(( segid " " and resid 108 and name HB3 ))
( segid " " and resid 105 and name HD1%)
ASSI { 1146}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 64 and name HG3 ))
2.200 0.600 0.600 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.11359E-01 ppm1 1.735 ppm2 1.438 CV 1
OR { 1146}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 64 and name HG2 ))
ASSI { 1148}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HD3 ))
2.500 0.800 0.800 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.57646E-02 ppm1 1.742 ppm2 3.201 CV 1
OR { 1148}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HD2 ))
ASSI { 1152}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 64 and name HA ))
2.400 0.700 0.700 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.44985E-02 ppm1 1.740 ppm2 4.105 CV 1
ASSI { 1153}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HA ))
2.500 0.800 0.800 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.51341E-02 ppm1 1.742 ppm2 4.310 CV 1
ASSI { 1155}
(( segid " " and resid 50 and name HG13))
( segid " " and resid 50 and name HD1%)
2.100 0.500 0.500 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.10031E-01 ppm1 1.615 ppm2 0.900 CV 1
OR { 1155}
(( segid " " and resid 50 and name HG13))
( segid " " and resid 50 and name HG2%)
ASSI { 1159}
(( segid " " and resid 108 and name HD2 ))
(( segid " " and resid 108 and name HE2 ))
2.200 0.600 0.600 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.11556E-01 ppm1 1.594 ppm2 2.986 CV 1
OR { 1159}
(( segid " " and resid 108 and name HD3 ))
(( segid " " and resid 108 and name HE3 ))
OR { 1159}
(( segid " " and resid 108 and name HD2 ))
(( segid " " and resid 108 and name HE3 ))
OR { 1159}
(( segid " " and resid 108 and name HD3 ))
(( segid " " and resid 108 and name HE2 ))
ASSI { 1160}
(( segid " " and resid 111 and name HG3 ))
(( segid " " and resid 111 and name HD3 ))
2.800 1.000 1.000 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.36672E-02 ppm1 1.625 ppm2 3.235 CV 1
ASSI { 1167}
(( segid " " and resid 108 and name HD2 ))
(( segid " " and resid 108 and name H ))
3.700 1.700 1.700 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.20502E-02 ppm1 1.596 ppm2 8.182 CV 1
OR { 1167}
(( segid " " and resid 108 and name HD3 ))
(( segid " " and resid 108 and name H ))
ASSI { 1170}
(( segid " " and resid 107 and name HA ))
( segid " " and resid 107 and name HB% )
2.300 0.700 0.700 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.71385E-02 ppm1 4.459 ppm2 1.160 CV 1
ASSI { 1171}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 108 and name HB2 ))
4.200 2.300 1.800 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.17721E-02 ppm1 4.461 ppm2 1.732 CV 1
OR { 1171}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 108 and name HB3 ))
ASSI { 1175}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 108 and name HE2 ))
4.800 2.800 1.200 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.25104E-03 ppm1 1.158 ppm2 2.978 CV 1
OR { 1175}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 108 and name HE3 ))
ASSI { 1177}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 80 and name HG2 ))
3.900 1.900 1.900 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.35463E-03 ppm1 1.155 ppm2 2.652 CV 1
ASSI { 1179}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 109 and name HD3 ))
3.500 1.500 1.500 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.82125E-03 ppm1 1.157 ppm2 2.432 CV 1
ASSI { 1180}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 114 and name HB ))
3.600 1.600 1.600 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.58685E-03 ppm1 1.155 ppm2 2.273 CV 1
ASSI { 1181}
( segid " " and resid 107 and name HB% )
( segid " " and resid 102 and name HE% )
4.000 2.000 2.000 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.68970E-03 ppm1 1.156 ppm2 2.161 CV 1
ASSI { 1184}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 105 and name HG12))
2.900 1.000 1.000 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.25092E-02 ppm1 1.155 ppm2 1.586 CV 1
ASSI { 1191}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 80 and name HE22))
3.200 1.300 1.300 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.12135E-02 ppm1 1.155 ppm2 6.598 CV 1
ASSI { 1193}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 80 and name HE21))
3.000 1.200 1.200 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.15809E-02 ppm1 1.156 ppm2 7.453 CV 1
ASSI { 1195}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 106 and name H ))
5.400 3.600 0.600 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.34318E-03 ppm1 1.156 ppm2 9.156 CV 1
ASSI { 1196}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name H ))
3.200 1.300 1.300 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.10642E-02 ppm1 4.063 ppm2 9.157 CV 1
ASSI { 1198}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 106 and name H ))
3.000 1.100 1.100 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.26259E-02 ppm1 1.310 ppm2 9.156 CV 1
ASSI { 1199}
(( segid " " and resid 106 and name HA ))
( segid " " and resid 107 and name HB% )
4.300 2.400 1.700 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.85099E-03 ppm1 4.060 ppm2 1.137 CV 1
ASSI { 1201}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 105 and name HG12))
4.600 2.600 1.400 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.47997E-03 ppm1 4.060 ppm2 1.595 CV 1
ASSI { 1202}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 105 and name HB ))
4.900 3.100 1.100 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.43199E-03 ppm1 4.063 ppm2 1.975 CV 1
ASSI { 1203}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 106 and name HG2%)
2.300 0.700 0.700 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.86930E-02 ppm1 4.367 ppm2 1.315 CV 1
ASSI { 1204}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 107 and name HB% )
4.400 2.500 1.600 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.12886E-02 ppm1 4.366 ppm2 1.159 CV 1
ASSI { 1205}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 105 and name HG2%)
4.500 2.500 1.500 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.82288E-03 ppm1 4.366 ppm2 1.048 CV 1
OR { 1205}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 105 and name HD1%)
ASSI { 1206}
(( segid " " and resid 106 and name HB ))
(( segid " " and resid 105 and name HB ))
5.200 3.400 0.800 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.52838E-03 ppm1 4.370 ppm2 1.999 CV 1
ASSI { 1207}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 108 and name HE2 ))
3.900 1.900 1.900 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.81539E-03 ppm1 1.311 ppm2 2.978 CV 1
OR { 1207}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 108 and name HE3 ))
ASSI { 1208}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 80 and name HG3 ))
4.500 2.500 1.500 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.37324E-03 ppm1 1.310 ppm2 2.827 CV 1
ASSI { 1209}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 80 and name HG2 ))
3.700 1.700 1.700 peak 1209 spectrum 1 weight 0.10000E+01 volume 0.45928E-03 ppm1 1.311 ppm2 2.649 CV 1
ASSI { 1210}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 80 and name HB3 ))
2.500 2.500 3.500 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.63958E-03 ppm1 1.308 ppm2 2.529 CV 1
ASSI { 1211}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 83 and name HB3 ))
3.200 1.300 1.300 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.10221E-02 ppm1 1.311 ppm2 2.194 CV 1
ASSI { 1212}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 105 and name HB ))
4.500 2.600 1.500 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.13103E-02 ppm1 1.310 ppm2 1.967 CV 1
ASSI { 1213}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name HB ))
3.000 1.100 1.100 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.20085E-02 ppm1 4.063 ppm2 4.369 CV 1
ASSI { 1216}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 105 and name HA ))
4.000 2.000 2.000 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.29294E-02 ppm1 1.308 ppm2 4.219 CV 1
ASSI { 1217}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 106 and name HA ))
2.700 0.900 0.900 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.86998E-02 ppm1 1.310 ppm2 4.064 CV 1
ASSI { 1220}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 108 and name H ))
4.700 2.700 1.300 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.58425E-03 ppm1 1.311 ppm2 8.174 CV 1
ASSI { 1222}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 107 and name H ))
2.600 0.900 0.900 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.28053E-02 ppm1 1.310 ppm2 7.633 CV 1
ASSI { 1224}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 106 and name H ))
5.200 3.400 0.800 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.22651E-03 ppm1 1.954 ppm2 9.162 CV 1
ASSI { 1225}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 32 and name H ))
3.300 3.300 2.700 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.13673E-03 ppm1 1.005 ppm2 9.074 CV 1
ASSI { 1226}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name H ))
2.300 0.700 0.700 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.47638E-02 ppm1 4.239 ppm2 8.682 CV 1
ASSI { 1228}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 106 and name H ))
4.100 2.100 1.900 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.85635E-03 ppm1 1.031 ppm2 9.157 CV 1
ASSI { 1229}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 106 and name H ))
5.000 3.200 1.000 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.56573E-03 ppm1 1.048 ppm2 9.149 CV 1
ASSI { 1230}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 107 and name H ))
3.400 1.500 1.500 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.17760E-02 ppm1 1.048 ppm2 7.629 CV 1
ASSI { 1231}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HD1 ))
3.700 1.700 1.700 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.12452E-02 ppm1 4.239 ppm2 6.975 CV 1
ASSI { 1234}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name H ))
3.500 1.500 1.500 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.75068E-03 ppm1 4.239 ppm2 8.346 CV 1
ASSI { 1239}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 107 and name H ))
2.900 1.100 1.100 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.23291E-02 ppm1 1.031 ppm2 7.632 CV 1
ASSI { 1240}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 105 and name H ))
2.500 0.800 0.800 peak 1240 spectrum 1 weight 0.10000E+01 volume 0.45299E-02 ppm1 1.031 ppm2 8.069 CV 1
ASSI { 1241}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 102 and name H ))
3.900 1.900 1.900 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.86051E-03 ppm1 1.030 ppm2 8.592 CV 1
ASSI { 1242}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 80 and name HE21))
3.600 1.700 1.700 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.79016E-03 ppm1 1.030 ppm2 7.476 CV 1
ASSI { 1243}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 104 and name H ))
4.000 2.000 2.000 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.12025E-02 ppm1 1.030 ppm2 7.366 CV 1
ASSI { 1246}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 8 and name HG2%)
2.500 0.800 0.800 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.90336E-02 ppm1 4.239 ppm2 1.253 CV 1
ASSI { 1247}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HG12))
3.700 1.700 1.700 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.63038E-03 ppm1 4.225 ppm2 1.584 CV 1
ASSI { 1248}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HB ))
3.000 1.100 1.100 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.90862E-03 ppm1 4.220 ppm2 1.965 CV 1
ASSI { 1251}
(( segid " " and resid 105 and name HB ))
( segid " " and resid 105 and name HG2%)
2.400 0.700 0.700 peak 1251 spectrum 1 weight 0.10000E+01 volume 0.54632E-02 ppm1 1.957 ppm2 1.038 CV 1
OR { 1251}
(( segid " " and resid 105 and name HB ))
( segid " " and resid 105 and name HD1%)
ASSI { 1252}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 105 and name HG13))
3.200 1.300 1.300 peak 1252 spectrum 1 weight 0.10000E+01 volume 0.43919E-03 ppm1 1.953 ppm2 1.402 CV 1
ASSI { 1253}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 105 and name HG12))
3.400 1.400 1.400 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.76573E-03 ppm1 1.959 ppm2 1.571 CV 1
ASSI { 1256}
(( segid " " and resid 103 and name HD2 ))
(( segid " " and resid 103 and name HG2 ))
1.800 0.400 0.400 peak 1256 spectrum 1 weight 0.10000E+01 volume 0.44908E-01 ppm1 1.598 ppm2 1.449 CV 1
OR { 1256}
(( segid " " and resid 103 and name HD3 ))
(( segid " " and resid 103 and name HG2 ))
OR { 1256}
(( segid " " and resid 103 and name HD2 ))
(( segid " " and resid 103 and name HG3 ))
OR { 1256}
(( segid " " and resid 103 and name HD3 ))
(( segid " " and resid 103 and name HG3 ))
ASSI { 1257}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 105 and name HG12))
2.200 0.600 0.600 peak 1257 spectrum 1 weight 0.10000E+01 volume 0.56884E-02 ppm1 1.051 ppm2 1.580 CV 1
ASSI { 1260}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 105 and name HA ))
3.900 1.900 1.900 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.17427E-02 ppm1 1.046 ppm2 4.216 CV 1
ASSI { 1262}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 105 and name HG12))
2.300 0.700 0.700 peak 1262 spectrum 1 weight 0.10000E+01 volume 0.61572E-02 ppm1 1.031 ppm2 1.589 CV 1
ASSI { 1263}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 105 and name HG13))
3.000 1.100 1.100 peak 1263 spectrum 1 weight 0.10000E+01 volume 0.60178E-02 ppm1 1.031 ppm2 1.424 CV 1
ASSI { 1265}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 105 and name HB ))
2.300 0.700 0.700 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.51797E-02 ppm1 1.031 ppm2 1.961 CV 1
ASSI { 1266}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 108 and name HE3 ))
3.500 1.500 1.500 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.84087E-03 ppm1 1.031 ppm2 2.980 CV 1
OR { 1266}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 108 and name HE2 ))
ASSI { 1268}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 102 and name HG3 ))
3.600 1.600 1.600 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.12151E-02 ppm1 1.031 ppm2 2.587 CV 1
ASSI { 1269}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 109 and name HD3 ))
3.700 1.700 1.700 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.98629E-03 ppm1 1.030 ppm2 2.422 CV 1
ASSI { 1270}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 105 and name HA ))
3.400 1.400 1.400 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.21892E-02 ppm1 1.031 ppm2 4.216 CV 1
ASSI { 1272}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 101 and name HA ))
2.500 2.500 3.500 peak 1272 spectrum 1 weight 0.10000E+01 volume 0.78276E-03 ppm1 1.030 ppm2 3.619 CV 1
ASSI { 1273}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HG13))
2.200 0.600 0.600 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.54625E-02 ppm1 1.010 ppm2 2.107 CV 1
OR { 1273}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HB ))
ASSI { 1275}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name H ))
3.200 1.300 1.300 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.16599E-02 ppm1 2.889 ppm2 7.483 CV 1
OR { 1275}
(( segid " " and resid 103 and name HE3 ))
(( segid " " and resid 103 and name H ))
ASSI { 1277}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 34 and name H ))
3.300 1.300 1.300 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.66651E-03 ppm1 2.885 ppm2 8.005 CV 1
ASSI { 1278}
(( segid " " and resid 104 and name HB2 ))
(( segid " " and resid 103 and name H ))
4.600 2.600 1.400 peak 1278 spectrum 1 weight 0.10000E+01 volume 0.47777E-03 ppm1 2.600 ppm2 7.508 CV 1
ASSI { 1279}
(( segid " " and resid 104 and name HB2 ))
(( segid " " and resid 100 and name H ))
2.800 2.800 3.200 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.31616E-03 ppm1 2.619 ppm2 7.759 CV 1
ASSI { 1282}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HA ))
3.600 1.600 1.600 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.16101E-02 ppm1 2.889 ppm2 4.154 CV 1
ASSI { 1284}
(( segid " " and resid 104 and name HB3 ))
( segid " " and resid 87 and name HD1%)
2.900 1.000 1.000 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.17415E-02 ppm1 2.899 ppm2 1.086 CV 1
ASSI { 1285}
(( segid " " and resid 31 and name HB3 ))
( segid " " and resid 33 and name HG1%)
2.900 1.100 1.100 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.18700E-02 ppm1 2.889 ppm2 0.973 CV 1
OR { 1285}
(( segid " " and resid 31 and name HB3 ))
( segid " " and resid 33 and name HG2%)
ASSI { 1286}
(( segid " " and resid 103 and name HE3 ))
(( segid " " and resid 103 and name HB3 ))
2.800 1.000 1.000 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.52453E-02 ppm1 2.889 ppm2 1.811 CV 1
OR { 1286}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HB3 ))
OR { 1286}
(( segid " " and resid 103 and name HE3 ))
(( segid " " and resid 103 and name HB2 ))
OR { 1286}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HB2 ))
ASSI { 1287}
(( segid " " and resid 103 and name HE3 ))
(( segid " " and resid 103 and name HD3 ))
1.800 0.400 0.400 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.33299E-01 ppm1 2.889 ppm2 1.587 CV 1
OR { 1287}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HD2 ))
OR { 1287}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HD3 ))
OR { 1287}
(( segid " " and resid 103 and name HE3 ))
(( segid " " and resid 103 and name HD2 ))
ASSI { 1288}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HG3 ))
2.000 0.500 0.500 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.22077E-01 ppm1 2.889 ppm2 1.449 CV 1
OR { 1288}
(( segid " " and resid 103 and name HE3 ))
(( segid " " and resid 103 and name HG3 ))
OR { 1288}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HG2 ))
OR { 1288}
(( segid " " and resid 103 and name HE3 ))
(( segid " " and resid 103 and name HG2 ))
ASSI { 1289}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 34 and name HG3 ))
3.300 1.400 1.400 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.10680E-02 ppm1 2.886 ppm2 2.239 CV 1
OR { 1289}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 34 and name HB2 ))
ASSI { 1291}
(( segid " " and resid 126 and name HB3 ))
(( segid " " and resid 125 and name H ))
5.200 3.400 0.800 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.32529E-03 ppm1 1.964 ppm2 8.856 CV 1
ASSI { 1292}
(( segid " " and resid 103 and name HD3 ))
(( segid " " and resid 103 and name H ))
3.700 1.700 1.700 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.13907E-02 ppm1 1.597 ppm2 7.476 CV 1
OR { 1292}
(( segid " " and resid 103 and name HD2 ))
(( segid " " and resid 103 and name H ))
ASSI { 1299}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 28 and name H ))
3.600 1.600 1.600 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.18289E-02 ppm1 2.113 ppm2 8.607 CV 1
ASSI { 1300}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 111 and name H ))
3.100 1.200 1.200 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.20345E-02 ppm1 2.159 ppm2 9.003 CV 1
ASSI { 1301}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 102 and name H ))
3.100 1.200 1.200 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.26373E-02 ppm1 2.159 ppm2 8.580 CV 1
ASSI { 1302}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 110 and name H ))
4.000 2.000 2.000 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.44163E-03 ppm1 2.158 ppm2 8.362 CV 1
ASSI { 1304}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 99 and name H ))
4.600 2.600 1.400 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.45611E-03 ppm1 2.158 ppm2 7.832 CV 1
ASSI { 1305}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 109 and name H ))
3.300 1.400 1.400 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.11818E-02 ppm1 2.159 ppm2 7.632 CV 1
ASSI { 1306}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 103 and name H ))
4.200 2.200 1.800 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.12340E-02 ppm1 2.158 ppm2 7.471 CV 1
ASSI { 1307}
(( segid " " and resid 102 and name HG2 ))
(( segid " " and resid 102 and name H ))
2.500 0.800 0.800 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.15072E-02 ppm1 2.735 ppm2 8.588 CV 1
ASSI { 1313}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 110 and name HA ))
3.300 1.400 1.400 peak 1313 spectrum 1 weight 0.10000E+01 volume 0.12267E-02 ppm1 2.159 ppm2 4.447 CV 1
ASSI { 1317}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 111 and name HD3 ))
3.800 1.800 1.800 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.20928E-02 ppm1 2.159 ppm2 3.241 CV 1
ASSI { 1318}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 108 and name HE3 ))
4.300 2.300 1.700 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.42463E-03 ppm1 2.158 ppm2 3.032 CV 1
ASSI { 1320}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 102 and name HG2 ))
2.200 0.600 0.600 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.56214E-02 ppm1 2.159 ppm2 2.738 CV 1
ASSI { 1321}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 102 and name HG3 ))
3.000 1.100 1.100 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.56881E-02 ppm1 2.159 ppm2 2.585 CV 1
ASSI { 1322}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 111 and name HB3 ))
2.800 1.000 1.000 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.77722E-02 ppm1 2.159 ppm2 1.899 CV 1
OR { 1322}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 111 and name HB2 ))
ASSI { 1324}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 111 and name HG3 ))
2.700 0.900 0.900 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.42556E-02 ppm1 2.159 ppm2 1.609 CV 1
ASSI { 1326}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 114 and name HG12))
4.200 2.200 1.800 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.17232E-02 ppm1 2.160 ppm2 1.270 CV 1
ASSI { 1330}
(( segid " " and resid 102 and name HG2 ))
( segid " " and resid 102 and name HE% )
2.500 0.800 0.800 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.42147E-02 ppm1 2.737 ppm2 2.161 CV 1
OR { 1330}
(( segid " " and resid 102 and name HG2 ))
(( segid " " and resid 102 and name HB2 ))
OR { 1330}
(( segid " " and resid 102 and name HG2 ))
(( segid " " and resid 102 and name HB3 ))
ASSI { 1331}
(( segid " " and resid 102 and name HG2 ))
(( segid " " and resid 102 and name HA ))
3.200 1.300 1.300 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.13870E-02 ppm1 2.737 ppm2 4.037 CV 1
ASSI { 1332}
(( segid " " and resid 102 and name HG3 ))
(( segid " " and resid 102 and name HA ))
3.800 1.800 1.800 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.16009E-02 ppm1 2.582 ppm2 4.039 CV 1
ASSI { 1333}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 27 and name HA ))
2.700 0.900 0.900 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.26653E-02 ppm1 2.110 ppm2 3.896 CV 1
ASSI { 1337}
(( segid " " and resid 128 and name HA ))
(( segid " " and resid 128 and name HG3 ))
2.900 1.000 1.000 peak 1337 spectrum 1 weight 0.10000E+01 volume 0.36874E-02 ppm1 4.047 ppm2 1.623 CV 1
OR { 1337}
(( segid " " and resid 128 and name HA ))
(( segid " " and resid 128 and name HG2 ))
ASSI { 1338}
(( segid " " and resid 128 and name HA ))
(( segid " " and resid 128 and name HB2 ))
2.400 0.700 0.700 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.73464E-02 ppm1 4.047 ppm2 1.877 CV 1
OR { 1338}
(( segid " " and resid 128 and name HA ))
(( segid " " and resid 128 and name HB3 ))
ASSI { 1340}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HB3 ))
2.300 0.700 0.700 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.64735E-02 ppm1 4.045 ppm2 2.169 CV 1
OR { 1340}
(( segid " " and resid 102 and name HA ))
( segid " " and resid 102 and name HE% )
ASSI { 1343}
(( segid " " and resid 128 and name HA ))
(( segid " " and resid 128 and name HD2 ))
4.200 2.200 1.800 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.13711E-02 ppm1 4.045 ppm2 3.205 CV 1
OR { 1343}
(( segid " " and resid 128 and name HA ))
(( segid " " and resid 128 and name HD3 ))
ASSI { 1344}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 101 and name H ))
3.500 1.500 1.500 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.52989E-03 ppm1 3.625 ppm2 8.302 CV 1
ASSI { 1346}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 101 and name H ))
3.800 1.800 1.800 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.17940E-02 ppm1 1.022 ppm2 8.299 CV 1
ASSI { 1347}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 101 and name H ))
3.900 1.900 1.900 peak 1347 spectrum 1 weight 0.10000E+01 volume 0.14422E-02 ppm1 0.985 ppm2 8.302 CV 1
ASSI { 1350}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 102 and name H ))
3.100 1.200 1.200 peak 1350 spectrum 1 weight 0.10000E+01 volume 0.18902E-02 ppm1 0.984 ppm2 8.586 CV 1
ASSI { 1353}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 21 and name H ))
3.700 1.700 1.700 peak 1353 spectrum 1 weight 0.10000E+01 volume 0.84722E-03 ppm1 1.012 ppm2 8.933 CV 1
ASSI { 1354}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 100 and name H ))
4.900 3.100 1.100 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.61193E-03 ppm1 0.989 ppm2 7.752 CV 1
ASSI { 1359}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name H ))
3.500 1.500 1.500 peak 1359 spectrum 1 weight 0.10000E+01 volume 0.20302E-02 ppm1 1.011 ppm2 8.101 CV 1
ASSI { 1362}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 21 and name HD% )
2.300 0.700 0.700 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.26502E-02 ppm1 1.010 ppm2 6.899 CV 1
ASSI { 1363}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 80 and name HE21))
4.200 2.200 1.800 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.45813E-03 ppm1 1.023 ppm2 7.482 CV 1
ASSI { 1366}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 54 and name HD1%)
2.300 0.600 0.600 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.36976E-02 ppm1 1.010 ppm2 0.421 CV 1
OR { 1366}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 54 and name HD2%)
ASSI { 1369}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 88 and name HB3 ))
4.100 2.100 1.900 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.96937E-03 ppm1 1.022 ppm2 3.177 CV 1
ASSI { 1373}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 21 and name HB3 ))
2.600 0.800 0.800 peak 1373 spectrum 1 weight 0.10000E+01 volume 0.15939E-02 ppm1 1.011 ppm2 3.040 CV 1
OR { 1373}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 21 and name HB2 ))
ASSI { 1377}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 101 and name HA ))
2.700 0.900 0.900 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.24864E-02 ppm1 0.986 ppm2 3.626 CV 1
ASSI { 1381}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 101 and name HB ))
2.300 0.600 0.600 peak 1381 spectrum 1 weight 0.10000E+01 volume 0.45295E-02 ppm1 0.984 ppm2 2.043 CV 1
ASSI { 1384}
(( segid " " and resid 101 and name HB ))
(( segid " " and resid 98 and name HA ))
3.000 1.100 1.100 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.62444E-03 ppm1 2.043 ppm2 3.995 CV 1
ASSI { 1387}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 87 and name HB3 ))
4.100 2.100 1.900 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.59713E-03 ppm1 3.633 ppm2 1.475 CV 1
ASSI { 1388}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name H ))
3.100 1.200 1.200 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.14770E-02 ppm1 3.940 ppm2 7.746 CV 1
ASSI { 1390}
(( segid " " and resid 100 and name HB3 ))
(( segid " " and resid 100 and name H ))
4.500 2.500 1.500 peak 1390 spectrum 1 weight 0.10000E+01 volume 0.70547E-03 ppm1 0.994 ppm2 7.749 CV 1
ASSI { 1392}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 100 and name HB2 ))
3.600 1.600 1.600 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.53637E-03 ppm1 7.077 ppm2 2.292 CV 1
ASSI { 1395}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 100 and name HB3 ))
4.000 2.000 2.000 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.10883E-02 ppm1 7.077 ppm2 1.011 CV 1
ASSI { 1396}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 100 and name HA ))
4.400 2.500 1.600 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.35669E-03 ppm1 7.083 ppm2 3.945 CV 1
ASSI { 1397}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 97 and name HA ))
4.100 2.100 1.900 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.33349E-03 ppm1 7.081 ppm2 3.656 CV 1
ASSI { 1399}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 103 and name HB3 ))
2.700 0.900 0.900 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.43523E-02 ppm1 3.942 ppm2 1.822 CV 1
OR { 1399}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 103 and name HB2 ))
ASSI { 1400}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 103 and name HE3 ))
3.400 1.500 1.500 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.11754E-02 ppm1 3.946 ppm2 2.893 CV 1
OR { 1400}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 103 and name HE2 ))
ASSI { 1402}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 12 and name H ))
4.800 2.900 1.200 peak 1402 spectrum 1 weight 0.10000E+01 volume 0.47217E-03 ppm1 2.295 ppm2 8.969 CV 1
ASSI { 1405}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 91 and name HB3 ))
3.400 1.400 1.400 peak 1405 spectrum 1 weight 0.10000E+01 volume 0.45903E-03 ppm1 2.296 ppm2 2.704 CV 1
ASSI { 1407}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 11 and name HB3 ))
2.500 0.800 0.800 peak 1407 spectrum 1 weight 0.10000E+01 volume 0.35134E-02 ppm1 2.289 ppm2 2.011 CV 1
ASSI { 1410}
(( segid " " and resid 100 and name HB3 ))
(( segid " " and resid 100 and name HB2 ))
2.500 0.800 0.800 peak 1410 spectrum 1 weight 0.10000E+01 volume 0.12013E-02 ppm1 1.011 ppm2 2.271 CV 1
ASSI { 1415}
(( segid " " and resid 99 and name HA2 ))
(( segid " " and resid 99 and name HA3 ))
2.800 1.000 1.000 peak 1415 spectrum 1 weight 0.10000E+01 volume 0.72651E-03 ppm1 3.826 ppm2 3.620 CV 1
ASSI { 1418}
(( segid " " and resid 98 and name HA ))
( segid " " and resid 98 and name HD2%)
2.300 0.700 0.700 peak 1418 spectrum 1 weight 0.10000E+01 volume 0.64708E-02 ppm1 3.984 ppm2 0.865 CV 1
OR { 1418}
(( segid " " and resid 98 and name HA ))
( segid " " and resid 98 and name HD1%)
ASSI { 1419}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 20 and name HD1%)
2.200 0.600 0.600 peak 1419 spectrum 1 weight 0.10000E+01 volume 0.66502E-02 ppm1 3.959 ppm2 0.669 CV 1
ASSI { 1422}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB2 ))
2.400 0.700 0.700 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.66480E-02 ppm1 3.969 ppm2 2.154 CV 1
OR { 1422}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HG3 ))
ASSI { 1423}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HG2 ))
3.000 1.100 1.100 peak 1423 spectrum 1 weight 0.10000E+01 volume 0.54289E-02 ppm1 3.969 ppm2 1.994 CV 1
OR { 1423}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 57 and name HE% )
ASSI { 1424}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 22 and name HD1%)
2.200 0.600 0.600 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.11037E-01 ppm1 1.451 ppm2 0.946 CV 1
OR { 1424}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 22 and name HD2%)
ASSI { 1425}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HG ))
3.100 1.200 1.200 peak 1425 spectrum 1 weight 0.10000E+01 volume 0.22646E-02 ppm1 1.451 ppm2 2.052 CV 1
ASSI { 1426}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 102 and name HG2 ))
4.300 2.300 1.700 peak 1426 spectrum 1 weight 0.10000E+01 volume 0.80949E-03 ppm1 1.440 ppm2 2.724 CV 1
ASSI { 1427}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 111 and name HD2 ))
4.100 2.100 1.900 peak 1427 spectrum 1 weight 0.10000E+01 volume 0.45597E-03 ppm1 1.424 ppm2 3.259 CV 1
OR { 1427}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 111 and name HD3 ))
ASSI { 1428}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HA ))
2.500 0.800 0.800 peak 1428 spectrum 1 weight 0.10000E+01 volume 0.15826E-02 ppm1 1.450 ppm2 3.725 CV 1
ASSI { 1431}
(( segid " " and resid 98 and name HB3 ))
(( segid " " and resid 111 and name HD3 ))
3.100 1.200 1.200 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.59073E-03 ppm1 1.833 ppm2 3.241 CV 1
ASSI { 1433}
(( segid " " and resid 98 and name HB3 ))
(( segid " " and resid 98 and name HB2 ))
1.900 0.400 0.400 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.42432E-02 ppm1 1.842 ppm2 1.435 CV 1
ASSI { 1434}
(( segid " " and resid 37 and name HB3 ))
( segid " " and resid 37 and name HD2%)
2.100 0.500 0.500 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.85995E-02 ppm1 1.855 ppm2 0.837 CV 1
OR { 1434}
(( segid " " and resid 37 and name HB3 ))
( segid " " and resid 37 and name HD1%)
ASSI { 1435}
(( segid " " and resid 98 and name HB3 ))
( segid " " and resid 98 and name HD1%)
2.300 0.700 0.700 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.85806E-02 ppm1 1.834 ppm2 0.875 CV 1
OR { 1435}
(( segid " " and resid 98 and name HB3 ))
( segid " " and resid 98 and name HD2%)
ASSI { 1437}
(( segid " " and resid 98 and name HG ))
( segid " " and resid 98 and name HD1%)
1.900 0.500 0.500 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.14052E-01 ppm1 1.723 ppm2 0.876 CV 1
OR { 1437}
(( segid " " and resid 98 and name HG ))
( segid " " and resid 98 and name HD2%)
ASSI { 1441}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 102 and name HG2 ))
3.800 1.800 1.800 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.10191E-02 ppm1 0.851 ppm2 2.744 CV 1
ASSI { 1452}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 47 and name HA ))
3.400 1.400 1.400 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 0.852 ppm2 3.738 CV 1
ASSI { 1455}
( segid " " and resid 98 and name HD1%)
( segid " " and resid 84 and name HD2%)
3.300 1.400 1.400 peak 1455 spectrum 1 weight 0.10000E+01 volume 0.45514E-02 ppm1 0.894 ppm2 0.652 CV 1
ASSI { 1459}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 102 and name HG2 ))
3.300 1.400 1.400 peak 1459 spectrum 1 weight 0.10000E+01 volume 0.11831E-02 ppm1 0.892 ppm2 2.737 CV 1
ASSI { 1463}
( segid " " and resid 98 and name HD2%)
( segid " " and resid 131 and name HE% )
4.600 2.600 1.400 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.11167E-02 ppm1 0.851 ppm2 6.739 CV 1
ASSI { 1467}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 101 and name H ))
4.100 2.100 1.900 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.12968E-02 ppm1 0.852 ppm2 8.324 CV 1
ASSI { 1474}
(( segid " " and resid 98 and name HB3 ))
(( segid " " and resid 98 and name H ))
3.400 1.400 1.400 peak 1474 spectrum 1 weight 0.10000E+01 volume 0.27378E-02 ppm1 1.834 ppm2 8.576 CV 1
ASSI { 1476}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 36 and name H ))
4.100 2.100 1.900 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.11294E-02 ppm1 1.851 ppm2 8.122 CV 1
ASSI { 1478}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 36 and name HG2%)
2.200 0.600 0.600 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.10482E-01 ppm1 3.661 ppm2 0.992 CV 1
OR { 1478}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 36 and name HD1%)
ASSI { 1479}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HB ))
2.700 0.900 0.900 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.20000E-02 ppm1 3.664 ppm2 2.207 CV 1
ASSI { 1480}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 44 and name HB2 ))
1.700 0.400 0.500 peak 1480 spectrum 1 weight 0.10000E+01 volume 0.17637E-01 ppm1 2.187 ppm2 1.885 CV 1
OR { 1480}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 44 and name HG3 ))
ASSI { 1484}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 123 and name HB3 ))
4.900 3.000 1.100 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.15272E-02 ppm1 1.049 ppm2 0.652 CV 1
OR { 1484}
( segid " " and resid 97 and name HG1%)
( segid " " and resid 123 and name HD2%)
ASSI { 1486}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 97 and name HB ))
2.100 0.600 0.600 peak 1486 spectrum 1 weight 0.10000E+01 volume 0.76056E-02 ppm1 1.050 ppm2 2.209 CV 1
ASSI { 1489}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 98 and name HB2 ))
3.000 1.100 1.100 peak 1489 spectrum 1 weight 0.10000E+01 volume 0.39611E-02 ppm1 1.050 ppm2 1.441 CV 1
ASSI { 1490}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 132 and name HE2 ))
3.600 3.600 2.400 peak 1490 spectrum 1 weight 0.10000E+01 volume 0.65696E-03 ppm1 1.049 ppm2 3.029 CV 1
OR { 1490}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 132 and name HE3 ))
ASSI { 1491}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 88 and name HB2 ))
4.200 2.200 1.800 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.57424E-03 ppm1 1.051 ppm2 2.915 CV 1
ASSI { 1493}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 91 and name HB3 ))
4.800 2.900 1.200 peak 1493 spectrum 1 weight 0.10000E+01 volume 0.63860E-03 ppm1 1.051 ppm2 2.657 CV 1
ASSI { 1495}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 130 and name HA ))
3.200 1.300 1.300 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.13259E-02 ppm1 1.051 ppm2 4.298 CV 1
ASSI { 1501}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 92 and name HB2 ))
3.000 1.100 1.100 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.56361E-02 ppm1 0.999 ppm2 1.501 CV 1
ASSI { 1502}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 97 and name HB ))
2.100 0.600 0.600 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.93101E-02 ppm1 1.000 ppm2 2.208 CV 1
ASSI { 1504}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 51 and name HA ))
2.900 1.000 1.000 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.21129E-02 ppm1 0.997 ppm2 3.010 CV 1
ASSI { 1505}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 91 and name HB3 ))
3.300 1.400 1.400 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.14005E-02 ppm1 1.000 ppm2 2.687 CV 1
ASSI { 1507}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 88 and name HA ))
2.300 0.700 0.700 peak 1507 spectrum 1 weight 0.10000E+01 volume 0.46974E-02 ppm1 1.001 ppm2 3.956 CV 1
ASSI { 1509}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 91 and name HB2 ))
2.900 1.000 1.000 peak 1509 spectrum 1 weight 0.10000E+01 volume 0.15409E-02 ppm1 1.000 ppm2 3.366 CV 1
ASSI { 1510}
( segid " " and resid 97 and name HG2%)
( segid " " and resid 88 and name HE% )
3.000 1.100 1.100 peak 1510 spectrum 1 weight 0.10000E+01 volume 0.33153E-02 ppm1 1.000 ppm2 7.183 CV 1
ASSI { 1513}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 101 and name H ))
3.800 1.800 1.800 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.13153E-02 ppm1 0.998 ppm2 8.321 CV 1
ASSI { 1515}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 88 and name H ))
4.800 2.900 1.200 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.55781E-03 ppm1 1.000 ppm2 8.898 CV 1
ASSI { 1516}
( segid " " and resid 97 and name HG1%)
( segid " " and resid 88 and name HE% )
2.600 0.800 0.800 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.31646E-02 ppm1 1.050 ppm2 7.200 CV 1
ASSI { 1517}
( segid " " and resid 97 and name HG1%)
( segid " " and resid 88 and name HD% )
2.600 0.900 0.900 peak 1517 spectrum 1 weight 0.10000E+01 volume 0.28717E-02 ppm1 1.050 ppm2 7.063 CV 1
OR { 1517}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 88 and name HZ ))
ASSI { 1520}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 101 and name H ))
4.500 2.600 1.500 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.61930E-03 ppm1 1.052 ppm2 8.302 CV 1
ASSI { 1521}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 88 and name H ))
5.900 4.300 0.100 peak 1521 spectrum 1 weight 0.10000E+01 volume 0.25891E-03 ppm1 1.046 ppm2 8.890 CV 1
ASSI { 1528}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 100 and name HD2 ))
4.400 2.400 1.600 peak 1528 spectrum 1 weight 0.10000E+01 volume 0.27649E-03 ppm1 2.567 ppm2 7.081 CV 1
OR { 1528}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 100 and name HD2 ))
ASSI { 1529}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name H ))
3.100 1.200 1.200 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.25355E-02 ppm1 4.541 ppm2 7.865 CV 1
ASSI { 1530}
(( segid " " and resid 79 and name HB3 ))
(( segid " " and resid 80 and name H ))
4.200 2.200 1.800 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.66475E-03 ppm1 2.699 ppm2 7.868 CV 1
ASSI { 1531}
(( segid " " and resid 95 and name HA ))
( segid " " and resid 97 and name HG1%)
4.100 2.100 1.900 peak 1531 spectrum 1 weight 0.10000E+01 volume 0.85625E-03 ppm1 4.531 ppm2 1.002 CV 1
OR { 1531}
(( segid " " and resid 95 and name HA ))
( segid " " and resid 97 and name HG2%)
ASSI { 1532}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 60 and name HB% )
4.100 2.100 1.900 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.10926E-02 ppm1 4.542 ppm2 1.234 CV 1
ASSI { 1533}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 132 and name HB3 ))
3.200 3.200 2.800 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.29622E-02 ppm1 4.538 ppm2 1.848 CV 1
OR { 1533}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 132 and name HB2 ))
ASSI { 1534}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 132 and name HD2 ))
3.400 1.500 1.500 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.20828E-02 ppm1 4.535 ppm2 1.737 CV 1
OR { 1534}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 132 and name HD3 ))
ASSI { 1535}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 95 and name HB3 ))
2.500 0.800 0.800 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.76117E-02 ppm1 4.537 ppm2 2.790 CV 1
OR { 1535}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 95 and name HB2 ))
ASSI { 1540}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HB3 ))
3.800 1.800 1.800 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.66370E-03 ppm1 4.523 ppm2 4.178 CV 1
ASSI { 1541}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HB2 ))
3.800 1.800 1.800 peak 1541 spectrum 1 weight 0.10000E+01 volume 0.46438E-03 ppm1 4.532 ppm2 4.013 CV 1
ASSI { 1542}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 27 and name HG1%)
2.600 0.900 0.900 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.69718E-02 ppm1 4.933 ppm2 0.980 CV 1
ASSI { 1547}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HB3 ))
2.000 0.500 0.500 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.91120E-02 ppm1 2.840 ppm2 2.473 CV 1
ASSI { 1549}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 93 and name HA ))
3.900 1.900 1.900 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.46775E-03 ppm1 2.472 ppm2 4.927 CV 1
ASSI { 1553}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 25 and name HG3 ))
3.700 1.700 1.700 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.85217E-03 ppm1 2.483 ppm2 1.140 CV 1
ASSI { 1555}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 64 and name HB2 ))
5.200 3.400 0.800 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.31202E-03 ppm1 2.481 ppm2 1.825 CV 1
ASSI { 1561}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 92 and name H ))
3.800 1.800 1.800 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.14623E-02 ppm1 1.528 ppm2 7.834 CV 1
ASSI { 1563}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 92 and name HG3 ))
2.500 0.800 0.800 peak 1563 spectrum 1 weight 0.10000E+01 volume 0.40664E-02 ppm1 2.910 ppm2 1.522 CV 1
OR { 1563}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 92 and name HB2 ))
ASSI { 1564}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 92 and name HG2 ))
2.900 1.000 1.000 peak 1564 spectrum 1 weight 0.10000E+01 volume 0.22860E-02 ppm1 2.911 ppm2 1.272 CV 1
ASSI { 1566}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 92 and name HB3 ))
2.800 1.000 1.000 peak 1566 spectrum 1 weight 0.10000E+01 volume 0.21950E-02 ppm1 2.909 ppm2 1.102 CV 1
ASSI { 1567}
(( segid " " and resid 92 and name HD3 ))
(( segid " " and resid 92 and name HG2 ))
2.500 0.800 0.800 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.23518E-02 ppm1 3.033 ppm2 1.272 CV 1
ASSI { 1568}
(( segid " " and resid 92 and name HD3 ))
(( segid " " and resid 92 and name HB3 ))
3.000 1.100 1.100 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.19917E-02 ppm1 3.033 ppm2 1.090 CV 1
ASSI { 1569}
(( segid " " and resid 92 and name HD3 ))
(( segid " " and resid 92 and name HB2 ))
2.800 1.000 1.000 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.34608E-02 ppm1 3.033 ppm2 1.531 CV 1
OR { 1569}
(( segid " " and resid 92 and name HD3 ))
(( segid " " and resid 92 and name HG3 ))
ASSI { 1570}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 89 and name HB3 ))
4.200 2.200 1.800 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.61376E-03 ppm1 2.904 ppm2 2.198 CV 1
ASSI { 1571}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 89 and name HB2 ))
5.200 3.400 0.800 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.48013E-03 ppm1 2.911 ppm2 2.038 CV 1
ASSI { 1573}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 92 and name HD3 ))
1.600 0.300 0.600 peak 1573 spectrum 1 weight 0.10000E+01 volume 0.12179E-01 ppm1 2.910 ppm2 3.036 CV 1
ASSI { 1574}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 89 and name HA ))
3.200 1.300 1.300 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.13655E-02 ppm1 2.910 ppm2 3.745 CV 1
ASSI { 1575}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 92 and name HA ))
4.400 2.400 1.600 peak 1575 spectrum 1 weight 0.10000E+01 volume 0.79140E-03 ppm1 2.910 ppm2 3.597 CV 1
ASSI { 1576}
(( segid " " and resid 92 and name HD3 ))
(( segid " " and resid 89 and name HA ))
2.700 0.900 0.900 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.15134E-02 ppm1 3.035 ppm2 3.743 CV 1
ASSI { 1578}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 92 and name HB3 ))
2.300 0.700 0.700 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.41100E-02 ppm1 1.268 ppm2 1.094 CV 1
ASSI { 1579}
(( segid " " and resid 92 and name HG2 ))
( segid " " and resid 97 and name HG2%)
3.300 1.300 1.300 peak 1579 spectrum 1 weight 0.10000E+01 volume 0.40012E-02 ppm1 1.265 ppm2 0.951 CV 1
ASSI { 1580}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 92 and name HG3 ))
1.800 0.400 0.400 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.10288E-01 ppm1 1.272 ppm2 1.508 CV 1
OR { 1580}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 92 and name HB2 ))
ASSI { 1581}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 93 and name HB3 ))
5.200 3.400 0.800 peak 1581 spectrum 1 weight 0.10000E+01 volume 0.30864E-03 ppm1 1.281 ppm2 2.457 CV 1
ASSI { 1585}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 89 and name HA ))
3.500 1.500 1.500 peak 1585 spectrum 1 weight 0.10000E+01 volume 0.52963E-03 ppm1 1.268 ppm2 3.757 CV 1
ASSI { 1586}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 92 and name HA ))
3.800 1.800 1.800 peak 1586 spectrum 1 weight 0.10000E+01 volume 0.10013E-02 ppm1 1.269 ppm2 3.599 CV 1
ASSI { 1588}
(( segid " " and resid 92 and name HG3 ))
(( segid " " and resid 92 and name HB3 ))
3.000 1.100 1.100 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.34263E-02 ppm1 1.518 ppm2 1.094 CV 1
ASSI { 1589}
(( segid " " and resid 48 and name HG3 ))
(( segid " " and resid 48 and name HG2 ))
1.400 0.300 0.800 peak 1589 spectrum 1 weight 0.10000E+01 volume 0.29465E-01 ppm1 1.512 ppm2 1.337 CV 1
ASSI { 1591}
(( segid " " and resid 48 and name HG3 ))
(( segid " " and resid 48 and name HE3 ))
2.600 0.800 0.800 peak 1591 spectrum 1 weight 0.10000E+01 volume 0.10713E-01 ppm1 1.511 ppm2 2.977 CV 1
OR { 1591}
(( segid " " and resid 48 and name HG3 ))
(( segid " " and resid 48 and name HE2 ))
ASSI { 1592}
(( segid " " and resid 133 and name HG3 ))
(( segid " " and resid 134 and name HD3 ))
3.600 1.600 1.600 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.13179E-02 ppm1 1.514 ppm2 3.229 CV 1
OR { 1592}
(( segid " " and resid 133 and name HG3 ))
(( segid " " and resid 134 and name HD2 ))
OR { 1592}
(( segid " " and resid 133 and name HG2 ))
(( segid " " and resid 134 and name HD3 ))
OR { 1592}
(( segid " " and resid 133 and name HG2 ))
(( segid " " and resid 134 and name HD2 ))
ASSI { 1593}
(( segid " " and resid 48 and name HG3 ))
(( segid " " and resid 48 and name HA ))
2.800 1.000 1.000 peak 1593 spectrum 1 weight 0.10000E+01 volume 0.27778E-02 ppm1 1.513 ppm2 3.887 CV 1
ASSI { 1594}
(( segid " " and resid 92 and name HG3 ))
(( segid " " and resid 89 and name HA ))
4.100 2.100 1.900 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.12919E-02 ppm1 1.519 ppm2 3.740 CV 1
ASSI { 1595}
(( segid " " and resid 92 and name HG3 ))
(( segid " " and resid 92 and name HA ))
3.600 1.600 1.600 peak 1595 spectrum 1 weight 0.10000E+01 volume 0.14521E-02 ppm1 1.520 ppm2 3.596 CV 1
ASSI { 1598}
(( segid " " and resid 92 and name HB3 ))
(( segid " " and resid 92 and name HB2 ))
2.100 0.500 0.500 peak 1598 spectrum 1 weight 0.10000E+01 volume 0.40650E-02 ppm1 1.096 ppm2 1.523 CV 1
OR { 1598}
(( segid " " and resid 92 and name HB3 ))
(( segid " " and resid 92 and name HG3 ))
ASSI { 1599}
(( segid " " and resid 92 and name HB3 ))
(( segid " " and resid 97 and name HB ))
4.500 2.500 1.500 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.51151E-03 ppm1 1.106 ppm2 2.199 CV 1
ASSI { 1602}
(( segid " " and resid 92 and name HB3 ))
(( segid " " and resid 89 and name HA ))
3.300 1.400 1.400 peak 1602 spectrum 1 weight 0.10000E+01 volume 0.58062E-03 ppm1 1.097 ppm2 3.738 CV 1
ASSI { 1603}
(( segid " " and resid 92 and name HB3 ))
(( segid " " and resid 92 and name HA ))
2.900 1.100 1.100 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.12510E-02 ppm1 1.097 ppm2 3.597 CV 1
ASSI { 1604}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 92 and name HD3 ))
3.300 1.400 1.400 peak 1604 spectrum 1 weight 0.10000E+01 volume 0.21359E-02 ppm1 1.525 ppm2 3.035 CV 1
ASSI { 1605}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 92 and name HA ))
2.800 1.000 1.000 peak 1605 spectrum 1 weight 0.10000E+01 volume 0.16343E-02 ppm1 1.528 ppm2 3.595 CV 1
ASSI { 1606}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 92 and name HG2 ))
3.000 1.100 1.100 peak 1606 spectrum 1 weight 0.10000E+01 volume 0.31517E-02 ppm1 1.529 ppm2 1.268 CV 1
ASSI { 1607}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 97 and name HG2%)
2.700 0.900 0.900 peak 1607 spectrum 1 weight 0.10000E+01 volume 0.43963E-02 ppm1 3.594 ppm2 1.022 CV 1
OR { 1607}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 97 and name HG1%)
ASSI { 1609}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HB2 ))
2.700 0.900 0.900 peak 1609 spectrum 1 weight 0.10000E+01 volume 0.25504E-02 ppm1 3.593 ppm2 1.523 CV 1
OR { 1609}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HG3 ))
ASSI { 1610}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 97 and name HB ))
2.900 1.100 1.100 peak 1610 spectrum 1 weight 0.10000E+01 volume 0.70820E-03 ppm1 3.593 ppm2 2.209 CV 1
ASSI { 1611}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HD3 ))
5.400 3.600 0.600 peak 1611 spectrum 1 weight 0.10000E+01 volume 0.36275E-03 ppm1 3.596 ppm2 3.030 CV 1
ASSI { 1614}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 88 and name HE% )
4.700 2.800 1.300 peak 1614 spectrum 1 weight 0.10000E+01 volume 0.37967E-03 ppm1 3.598 ppm2 7.213 CV 1
ASSI { 1617}
(( segid " " and resid 92 and name HB2 ))
( segid " " and resid 88 and name HE% )
3.800 1.900 1.900 peak 1617 spectrum 1 weight 0.10000E+01 volume 0.63870E-03 ppm1 1.526 ppm2 7.202 CV 1
ASSI { 1618}
(( segid " " and resid 92 and name HB3 ))
( segid " " and resid 88 and name HE% )
3.600 1.600 1.600 peak 1618 spectrum 1 weight 0.10000E+01 volume 0.58975E-03 ppm1 1.099 ppm2 7.222 CV 1
ASSI { 1621}
(( segid " " and resid 92 and name HG2 ))
( segid " " and resid 88 and name HE% )
4.300 2.300 1.700 peak 1621 spectrum 1 weight 0.10000E+01 volume 0.71003E-03 ppm1 1.261 ppm2 7.212 CV 1
ASSI { 1624}
(( segid " " and resid 92 and name HG3 ))
( segid " " and resid 88 and name HE% )
4.500 2.500 1.500 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.69616E-03 ppm1 1.519 ppm2 7.214 CV 1
ASSI { 1626}
(( segid " " and resid 92 and name HD3 ))
( segid " " and resid 88 and name HE% )
3.200 1.300 1.300 peak 1626 spectrum 1 weight 0.10000E+01 volume 0.15782E-02 ppm1 3.033 ppm2 7.209 CV 1
ASSI { 1627}
(( segid " " and resid 92 and name HD3 ))
( segid " " and resid 88 and name HD% )
2.500 2.500 3.500 peak 1627 spectrum 1 weight 0.10000E+01 volume 0.69880E-03 ppm1 3.034 ppm2 7.039 CV 1
ASSI { 1628}
(( segid " " and resid 92 and name HD2 ))
( segid " " and resid 88 and name HE% )
3.000 1.100 1.100 peak 1628 spectrum 1 weight 0.10000E+01 volume 0.16737E-02 ppm1 2.911 ppm2 7.216 CV 1
ASSI { 1629}
(( segid " " and resid 92 and name HD2 ))
(( segid " " and resid 88 and name HZ ))
3.200 1.300 1.300 peak 1629 spectrum 1 weight 0.10000E+01 volume 0.91826E-03 ppm1 2.905 ppm2 7.067 CV 1
ASSI { 1632}
(( segid " " and resid 91 and name HB2 ))
( segid " " and resid 91 and name HD% )
3.300 1.300 1.300 peak 1632 spectrum 1 weight 0.10000E+01 volume 0.11177E-02 ppm1 3.371 ppm2 7.094 CV 1
ASSI { 1633}
(( segid " " and resid 91 and name HB3 ))
( segid " " and resid 91 and name HD% )
3.500 1.500 1.500 peak 1633 spectrum 1 weight 0.10000E+01 volume 0.62911E-03 ppm1 2.691 ppm2 7.097 CV 1
ASSI { 1637}
( segid " " and resid 66 and name HE% )
( segid " " and resid 66 and name HD% )
1.900 0.500 0.500 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.10222E-01 ppm1 7.091 ppm2 7.290 CV 1
ASSI { 1639}
(( segid " " and resid 79 and name HB3 ))
( segid " " and resid 82 and name HD1%)
3.400 1.500 1.500 peak 1639 spectrum 1 weight 0.10000E+01 volume 0.17731E-02 ppm1 2.691 ppm2 0.987 CV 1
OR { 1639}
(( segid " " and resid 79 and name HB3 ))
( segid " " and resid 82 and name HD2%)
ASSI { 1640}
(( segid " " and resid 116 and name HB3 ))
(( segid " " and resid 127 and name HB3 ))
5.400 3.600 0.600 peak 1640 spectrum 1 weight 0.10000E+01 volume 0.67456E-03 ppm1 2.690 ppm2 1.823 CV 1
OR { 1640}
(( segid " " and resid 116 and name HB3 ))
(( segid " " and resid 127 and name HB2 ))
ASSI { 1642}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 66 and name HZ ))
2.000 0.500 0.500 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.83065E-02 ppm1 7.090 ppm2 6.948 CV 1
ASSI { 1645}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 33 and name H ))
4.000 2.000 2.000 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.32753E-03 ppm1 7.296 ppm2 7.978 CV 1
ASSI { 1649}
(( segid " " and resid 66 and name HZ ))
( segid " " and resid 66 and name HD% )
3.500 1.500 1.500 peak 1649 spectrum 1 weight 0.10000E+01 volume 0.12030E-02 ppm1 6.934 ppm2 7.291 CV 1
ASSI { 1653}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 65 and name HB3 ))
3.100 1.200 1.200 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.96441E-03 ppm1 7.092 ppm2 2.399 CV 1
ASSI { 1656}
( segid " " and resid 91 and name HD% )
(( segid " " and resid 90 and name HB2 ))
3.400 1.400 1.400 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.59530E-03 ppm1 7.077 ppm2 1.774 CV 1
ASSI { 1657}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 54 and name HG ))
4.100 2.100 1.900 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.78347E-03 ppm1 7.087 ppm2 1.679 CV 1
ASSI { 1661}
( segid " " and resid 66 and name HE% )
( segid " " and resid 51 and name HG2%)
2.700 0.900 0.900 peak 1661 spectrum 1 weight 0.10000E+01 volume 0.21227E-02 ppm1 7.090 ppm2 0.672 CV 1
ASSI { 1662}
( segid " " and resid 66 and name HE% )
( segid " " and resid 60 and name HB% )
2.700 0.900 0.900 peak 1662 spectrum 1 weight 0.10000E+01 volume 0.51972E-02 ppm1 7.091 ppm2 1.253 CV 1
ASSI { 1663}
( segid " " and resid 66 and name HE% )
( segid " " and resid 54 and name HD1%)
2.500 0.800 0.800 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.24413E-02 ppm1 7.091 ppm2 0.436 CV 1
ASSI { 1665}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 51 and name HG12))
3.800 1.800 1.800 peak 1665 spectrum 1 weight 0.10000E+01 volume 0.62312E-03 ppm1 7.291 ppm2 1.495 CV 1
ASSI { 1666}
( segid " " and resid 66 and name HD% )
( segid " " and resid 32 and name HG1%)
2.900 1.000 1.000 peak 1666 spectrum 1 weight 0.10000E+01 volume 0.29414E-02 ppm1 7.294 ppm2 1.282 CV 1
ASSI { 1667}
( segid " " and resid 66 and name HD% )
( segid " " and resid 33 and name HG1%)
2.400 0.700 0.700 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.51697E-02 ppm1 7.293 ppm2 0.945 CV 1
OR { 1667}
( segid " " and resid 66 and name HD% )
( segid " " and resid 33 and name HG2%)
ASSI { 1669}
( segid " " and resid 66 and name HD% )
( segid " " and resid 51 and name HG2%)
2.600 0.800 0.800 peak 1669 spectrum 1 weight 0.10000E+01 volume 0.33203E-02 ppm1 7.294 ppm2 0.669 CV 1
ASSI { 1670}
( segid " " and resid 66 and name HD% )
( segid " " and resid 54 and name HD1%)
3.900 1.900 1.900 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.95214E-03 ppm1 7.294 ppm2 0.438 CV 1
ASSI { 1671}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 51 and name HG13))
3.600 1.600 1.600 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.42213E-03 ppm1 7.296 ppm2 0.096 CV 1
ASSI { 1674}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 67 and name HB2 ))
4.500 2.500 1.500 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.30402E-03 ppm1 7.297 ppm2 2.080 CV 1
ASSI { 1677}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 66 and name HB3 ))
2.500 0.800 0.800 peak 1677 spectrum 1 weight 0.10000E+01 volume 0.21056E-02 ppm1 7.293 ppm2 3.368 CV 1
ASSI { 1678}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 66 and name HB2 ))
2.800 1.000 1.000 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.22928E-02 ppm1 7.294 ppm2 2.898 CV 1
ASSI { 1679}
(( segid " " and resid 66 and name HZ ))
(( segid " " and resid 54 and name HB3 ))
3.700 1.700 1.700 peak 1679 spectrum 1 weight 0.10000E+01 volume 0.48498E-03 ppm1 6.932 ppm2 1.946 CV 1
ASSI { 1683}
(( segid " " and resid 66 and name HZ ))
( segid " " and resid 54 and name HD1%)
3.100 1.200 1.200 peak 1683 spectrum 1 weight 0.10000E+01 volume 0.19404E-02 ppm1 6.933 ppm2 0.436 CV 1
ASSI { 1684}
(( segid " " and resid 90 and name HG2 ))
( segid " " and resid 91 and name HD% )
4.200 2.200 1.800 peak 1684 spectrum 1 weight 0.10000E+01 volume 0.12612E-02 ppm1 1.027 ppm2 7.094 CV 1
ASSI { 1686}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 49 and name H ))
3.900 1.900 1.900 peak 1686 spectrum 1 weight 0.10000E+01 volume 0.99450E-03 ppm1 1.685 ppm2 7.739 CV 1
OR { 1686}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 49 and name H ))
ASSI { 1688}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 91 and name H ))
4.400 2.400 1.600 peak 1688 spectrum 1 weight 0.10000E+01 volume 0.70940E-03 ppm1 1.026 ppm2 7.751 CV 1
ASSI { 1689}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 90 and name H ))
3.500 1.500 1.500 peak 1689 spectrum 1 weight 0.10000E+01 volume 0.11485E-02 ppm1 1.027 ppm2 7.908 CV 1
ASSI { 1691}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 89 and name HG2 ))
5.300 3.500 0.700 peak 1691 spectrum 1 weight 0.10000E+01 volume 0.17789E-03 ppm1 1.028 ppm2 2.431 CV 1
ASSI { 1692}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 89 and name HB3 ))
4.300 2.300 1.700 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.48878E-03 ppm1 1.035 ppm2 2.170 CV 1
ASSI { 1693}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 86 and name HB3 ))
4.500 2.600 1.500 peak 1693 spectrum 1 weight 0.10000E+01 volume 0.53142E-03 ppm1 1.020 ppm2 2.007 CV 1
OR { 1693}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 86 and name HB2 ))
ASSI { 1694}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 90 and name HG3 ))
1.700 0.400 0.500 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.14133E-01 ppm1 1.026 ppm2 1.691 CV 1
ASSI { 1695}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 90 and name HB3 ))
2.900 1.100 1.100 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.32945E-02 ppm1 1.026 ppm2 1.478 CV 1
ASSI { 1697}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 87 and name HA ))
4.700 2.700 1.300 peak 1697 spectrum 1 weight 0.10000E+01 volume 0.57318E-03 ppm1 1.023 ppm2 4.245 CV 1
ASSI { 1700}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HB2 ))
2.200 0.600 0.600 peak 1700 spectrum 1 weight 0.10000E+01 volume 0.33763E-02 ppm1 1.687 ppm2 2.164 CV 1
OR { 1700}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HG3 ))
ASSI { 1701}
(( segid " " and resid 57 and name HB3 ))
( segid " " and resid 57 and name HE% )
2.400 0.700 0.700 peak 1701 spectrum 1 weight 0.10000E+01 volume 0.34364E-02 ppm1 1.687 ppm2 1.983 CV 1
OR { 1701}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HG2 ))
ASSI { 1704}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 48 and name HE2 ))
3.600 3.600 2.400 peak 1704 spectrum 1 weight 0.10000E+01 volume 0.15300E-02 ppm1 1.698 ppm2 3.008 CV 1
OR { 1704}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 48 and name HE2 ))
OR { 1704}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 48 and name HE3 ))
OR { 1704}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 48 and name HE3 ))
ASSI { 1706}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 86 and name HA ))
3.600 1.600 1.600 peak 1706 spectrum 1 weight 0.10000E+01 volume 0.51865E-03 ppm1 1.671 ppm2 4.127 CV 1
ASSI { 1707}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HA ))
3.300 1.400 1.400 peak 1707 spectrum 1 weight 0.10000E+01 volume 0.14831E-02 ppm1 1.684 ppm2 3.963 CV 1
ASSI { 1708}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 90 and name HA ))
3.400 1.500 1.500 peak 1708 spectrum 1 weight 0.10000E+01 volume 0.35760E-02 ppm1 1.689 ppm2 3.742 CV 1
ASSI { 1709}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 44 and name HA ))
4.300 2.300 1.700 peak 1709 spectrum 1 weight 0.10000E+01 volume 0.67512E-03 ppm1 1.691 ppm2 4.347 CV 1
OR { 1709}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 44 and name HA ))
ASSI { 1710}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name H ))
3.900 1.900 1.900 peak 1710 spectrum 1 weight 0.10000E+01 volume 0.65178E-03 ppm1 1.686 ppm2 8.101 CV 1
OR { 1710}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 45 and name H ))
ASSI { 1711}
(( segid " " and resid 90 and name HB3 ))
(( segid " " and resid 90 and name H ))
4.000 2.000 2.000 peak 1711 spectrum 1 weight 0.10000E+01 volume 0.15530E-02 ppm1 1.473 ppm2 7.910 CV 1
ASSI { 1712}
(( segid " " and resid 90 and name HB3 ))
(( segid " " and resid 91 and name H ))
4.100 2.100 1.900 peak 1712 spectrum 1 weight 0.10000E+01 volume 0.72912E-03 ppm1 1.471 ppm2 7.743 CV 1
ASSI { 1714}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name H ))
2.800 1.000 1.000 peak 1714 spectrum 1 weight 0.10000E+01 volume 0.28243E-02 ppm1 3.745 ppm2 7.904 CV 1
ASSI { 1717}
(( segid " " and resid 89 and name HG3 ))
( segid " " and resid 123 and name HD1%)
3.600 1.600 1.600 peak 1717 spectrum 1 weight 0.10000E+01 volume 0.84082E-03 ppm1 2.519 ppm2 0.810 CV 1
ASSI { 1722}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name HB2 ))
2.300 0.700 0.700 peak 1722 spectrum 1 weight 0.10000E+01 volume 0.50395E-02 ppm1 2.518 ppm2 2.039 CV 1
ASSI { 1728}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 88 and name HB3 ))
4.000 2.000 2.000 peak 1728 spectrum 1 weight 0.10000E+01 volume 0.52420E-03 ppm1 2.510 ppm2 3.193 CV 1
ASSI { 1730}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 92 and name HD2 ))
4.900 3.000 1.100 peak 1730 spectrum 1 weight 0.10000E+01 volume 0.56477E-03 ppm1 2.517 ppm2 2.900 CV 1
ASSI { 1731}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 92 and name HD3 ))
4.000 2.000 2.000 peak 1731 spectrum 1 weight 0.10000E+01 volume 0.74355E-03 ppm1 2.397 ppm2 3.040 CV 1
ASSI { 1732}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name HA ))
3.100 1.200 1.200 peak 1732 spectrum 1 weight 0.10000E+01 volume 0.26283E-02 ppm1 2.519 ppm2 3.746 CV 1
ASSI { 1733}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 89 and name HA ))
2.700 0.900 0.900 peak 1733 spectrum 1 weight 0.10000E+01 volume 0.30541E-02 ppm1 2.395 ppm2 3.747 CV 1
ASSI { 1735}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 86 and name HA ))
3.300 1.400 1.400 peak 1735 spectrum 1 weight 0.10000E+01 volume 0.92950E-03 ppm1 2.514 ppm2 4.124 CV 1
ASSI { 1736}
(( segid " " and resid 89 and name HG3 ))
( segid " " and resid 88 and name HE% )
4.600 2.600 1.400 peak 1736 spectrum 1 weight 0.10000E+01 volume 0.66185E-03 ppm1 2.519 ppm2 7.216 CV 1
ASSI { 1737}
(( segid " " and resid 89 and name HG3 ))
( segid " " and resid 88 and name HD% )
3.300 1.300 1.300 peak 1737 spectrum 1 weight 0.10000E+01 volume 0.89123E-03 ppm1 2.518 ppm2 7.035 CV 1
ASSI { 1738}
(( segid " " and resid 89 and name HG2 ))
( segid " " and resid 88 and name HE% )
3.600 1.600 1.600 peak 1738 spectrum 1 weight 0.10000E+01 volume 0.85460E-03 ppm1 2.396 ppm2 7.225 CV 1
ASSI { 1739}
(( segid " " and resid 89 and name HG2 ))
( segid " " and resid 88 and name HD% )
2.900 1.000 1.000 peak 1739 spectrum 1 weight 0.10000E+01 volume 0.11690E-02 ppm1 2.397 ppm2 7.039 CV 1
ASSI { 1741}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name H ))
2.300 0.700 0.700 peak 1741 spectrum 1 weight 0.10000E+01 volume 0.25355E-02 ppm1 2.519 ppm2 8.180 CV 1
ASSI { 1742}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 90 and name H ))
4.000 2.000 2.000 peak 1742 spectrum 1 weight 0.10000E+01 volume 0.90275E-03 ppm1 2.517 ppm2 7.912 CV 1
ASSI { 1745}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 89 and name H ))
2.800 1.000 1.000 peak 1745 spectrum 1 weight 0.10000E+01 volume 0.29562E-02 ppm1 2.395 ppm2 8.180 CV 1
ASSI { 1749}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 88 and name H ))
4.900 3.000 1.100 peak 1749 spectrum 1 weight 0.10000E+01 volume 0.32232E-03 ppm1 2.515 ppm2 8.890 CV 1
ASSI { 1756}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 67 and name HG3 ))
2.000 0.500 0.500 peak 1756 spectrum 1 weight 0.10000E+01 volume 0.18815E-01 ppm1 2.170 ppm2 2.419 CV 1
OR { 1756}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 1757}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 67 and name HB2 ))
1.400 0.200 0.800 peak 1757 spectrum 1 weight 0.10000E+01 volume 0.34599E-01 ppm1 2.169 ppm2 2.064 CV 1
ASSI { 1759}
(( segid " " and resid 67 and name HB2 ))
( segid " " and resid 63 and name HG2%)
2.500 0.800 0.800 peak 1759 spectrum 1 weight 0.10000E+01 volume 0.28515E-02 ppm1 2.043 ppm2 0.978 CV 1
ASSI { 1761}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HG2 ))
2.500 0.800 0.800 peak 1761 spectrum 1 weight 0.10000E+01 volume 0.44824E-02 ppm1 3.746 ppm2 1.024 CV 1
ASSI { 1762}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 92 and name HG3 ))
3.400 1.500 1.500 peak 1762 spectrum 1 weight 0.10000E+01 volume 0.40954E-02 ppm1 3.746 ppm2 1.499 CV 1
OR { 1762}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 92 and name HB2 ))
ASSI { 1763}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HB2 ))
2.900 1.100 1.100 peak 1763 spectrum 1 weight 0.10000E+01 volume 0.38437E-02 ppm1 3.744 ppm2 1.778 CV 1
ASSI { 1766}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 89 and name HB3 ))
2.400 0.700 0.700 peak 1766 spectrum 1 weight 0.10000E+01 volume 0.35102E-02 ppm1 3.750 ppm2 2.188 CV 1
ASSI { 1767}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 89 and name HB2 ))
3.000 1.100 1.100 peak 1767 spectrum 1 weight 0.10000E+01 volume 0.32923E-02 ppm1 3.746 ppm2 2.036 CV 1
ASSI { 1771}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 88 and name HD% )
3.300 1.400 1.400 peak 1771 spectrum 1 weight 0.10000E+01 volume 0.12864E-02 ppm1 3.939 ppm2 7.036 CV 1
ASSI { 1778}
( segid " " and resid 88 and name HD% )
(( segid " " and resid 88 and name HB3 ))
3.500 1.500 1.500 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.43361E-03 ppm1 7.044 ppm2 3.186 CV 1
ASSI { 1779}
( segid " " and resid 88 and name HD% )
(( segid " " and resid 88 and name HB2 ))
3.100 1.200 1.200 peak 1779 spectrum 1 weight 0.10000E+01 volume 0.65745E-03 ppm1 7.041 ppm2 2.966 CV 1
ASSI { 1781}
( segid " " and resid 88 and name HD% )
( segid " " and resid 123 and name HD2%)
3.300 1.400 1.400 peak 1781 spectrum 1 weight 0.10000E+01 volume 0.10419E-02 ppm1 7.039 ppm2 0.631 CV 1
OR { 1781}
( segid " " and resid 88 and name HD% )
(( segid " " and resid 123 and name HB3 ))
ASSI { 1787}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 123 and name HB3 ))
3.300 1.400 1.400 peak 1787 spectrum 1 weight 0.10000E+01 volume 0.58461E-03 ppm1 7.205 ppm2 0.651 CV 1
OR { 1787}
( segid " " and resid 88 and name HE% )
( segid " " and resid 123 and name HD2%)
ASSI { 1798}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 89 and name H ))
3.800 1.800 1.800 peak 1798 spectrum 1 weight 0.10000E+01 volume 0.48306E-03 ppm1 3.942 ppm2 8.195 CV 1
ASSI { 1799}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HB2 ))
2.900 1.100 1.100 peak 1799 spectrum 1 weight 0.10000E+01 volume 0.77386E-03 ppm1 3.941 ppm2 2.964 CV 1
ASSI { 1800}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HB3 ))
3.600 1.600 1.600 peak 1800 spectrum 1 weight 0.10000E+01 volume 0.85818E-03 ppm1 3.939 ppm2 3.192 CV 1
ASSI { 1804}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 118 and name HD1%)
4.800 2.800 1.200 peak 1804 spectrum 1 weight 0.10000E+01 volume 0.49953E-03 ppm1 3.935 ppm2 0.517 CV 1
ASSI { 1805}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name H ))
3.700 1.700 1.700 peak 1805 spectrum 1 weight 0.10000E+01 volume 0.75324E-03 ppm1 2.051 ppm2 8.670 CV 1
ASSI { 1807}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 19 and name HG3 ))
3.100 1.200 1.200 peak 1807 spectrum 1 weight 0.10000E+01 volume 0.10526E-02 ppm1 3.959 ppm2 2.344 CV 1
ASSI { 1808}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HB3 ))
2.300 0.700 0.700 peak 1808 spectrum 1 weight 0.10000E+01 volume 0.85333E-03 ppm1 1.143 ppm2 2.057 CV 1
ASSI { 1809}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HG ))
3.700 1.700 1.700 peak 1809 spectrum 1 weight 0.10000E+01 volume 0.24616E-03 ppm1 1.146 ppm2 1.697 CV 1
ASSI { 1810}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 20 and name HD2%)
2.900 1.000 1.000 peak 1810 spectrum 1 weight 0.10000E+01 volume 0.18948E-02 ppm1 1.148 ppm2 0.645 CV 1
OR { 1810}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 20 and name HD1%)
ASSI { 1811}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 36 and name HG2%)
3.700 1.700 1.700 peak 1811 spectrum 1 weight 0.10000E+01 volume 0.97505E-03 ppm1 1.153 ppm2 1.015 CV 1
OR { 1811}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 36 and name HD1%)
ASSI { 1812}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 20 and name HD1%)
3.100 1.200 1.200 peak 1812 spectrum 1 weight 0.10000E+01 volume 0.16394E-02 ppm1 2.056 ppm2 0.629 CV 1
OR { 1812}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 20 and name HD2%)
ASSI { 1816}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 21 and name H ))
4.500 2.500 1.500 peak 1816 spectrum 1 weight 0.10000E+01 volume 0.24459E-03 ppm1 1.151 ppm2 8.930 CV 1
ASSI { 1818}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 21 and name H ))
3.800 1.800 1.800 peak 1818 spectrum 1 weight 0.10000E+01 volume 0.54919E-03 ppm1 3.965 ppm2 8.933 CV 1
ASSI { 1819}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name H ))
2.900 1.000 1.000 peak 1819 spectrum 1 weight 0.10000E+01 volume 0.18714E-02 ppm1 3.961 ppm2 8.655 CV 1
ASSI { 1822}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 24 and name HD22))
2.900 1.000 1.000 peak 1822 spectrum 1 weight 0.10000E+01 volume 0.35222E-02 ppm1 0.668 ppm2 7.483 CV 1
ASSI { 1823}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 21 and name HD% )
5.400 3.600 0.600 peak 1823 spectrum 1 weight 0.10000E+01 volume 0.35630E-03 ppm1 0.664 ppm2 6.898 CV 1
ASSI { 1826}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 39 and name HB3 ))
3.300 1.400 1.400 peak 1826 spectrum 1 weight 0.10000E+01 volume 0.25073E-02 ppm1 0.668 ppm2 2.866 CV 1
ASSI { 1828}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 20 and name HG ))
2.100 0.500 0.500 peak 1828 spectrum 1 weight 0.10000E+01 volume 0.87368E-02 ppm1 0.668 ppm2 1.690 CV 1
ASSI { 1830}
( segid " " and resid 119 and name HD1%)
( segid " " and resid 130 and name HD2%)
2.400 0.700 0.700 peak 1830 spectrum 1 weight 0.10000E+01 volume 0.13546E-01 ppm1 0.675 ppm2 0.898 CV 1
ASSI { 1831}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 20 and name HB2 ))
3.000 1.100 1.100 peak 1831 spectrum 1 weight 0.10000E+01 volume 0.52149E-02 ppm1 0.669 ppm2 1.146 CV 1
ASSI { 1832}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 24 and name HB2 ))
3.700 1.700 1.700 peak 1832 spectrum 1 weight 0.10000E+01 volume 0.11972E-02 ppm1 0.668 ppm2 2.472 CV 1
ASSI { 1834}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 36 and name HG12))
3.400 1.400 1.400 peak 1834 spectrum 1 weight 0.10000E+01 volume 0.22252E-02 ppm1 0.669 ppm2 2.247 CV 1
ASSI { 1835}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 36 and name HA ))
3.200 1.300 1.300 peak 1835 spectrum 1 weight 0.10000E+01 volume 0.21726E-02 ppm1 0.668 ppm2 3.660 CV 1
ASSI { 1836}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 24 and name H ))
3.800 1.800 1.800 peak 1836 spectrum 1 weight 0.10000E+01 volume 0.13962E-02 ppm1 0.667 ppm2 7.293 CV 1
ASSI { 1838}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 24 and name HD21))
2.600 0.900 0.900 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.26962E-02 ppm1 0.668 ppm2 8.105 CV 1
ASSI { 1847}
(( segid " " and resid 127 and name HD2 ))
(( segid " " and resid 116 and name H ))
4.500 2.500 1.500 peak 1847 spectrum 1 weight 0.10000E+01 volume 0.32717E-03 ppm1 3.253 ppm2 8.125 CV 1
OR { 1847}
(( segid " " and resid 127 and name HD3 ))
(( segid " " and resid 116 and name H ))
ASSI { 1848}
(( segid " " and resid 86 and name HG2 ))
(( segid " " and resid 87 and name H ))
4.500 2.500 1.500 peak 1848 spectrum 1 weight 0.10000E+01 volume 0.93432E-03 ppm1 1.802 ppm2 8.669 CV 1
ASSI { 1850}
(( segid " " and resid 98 and name HG ))
(( segid " " and resid 111 and name HE ))
4.500 2.600 1.500 peak 1850 spectrum 1 weight 0.10000E+01 volume 0.59501E-03 ppm1 1.666 ppm2 7.406 CV 1
ASSI { 1854}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 30 and name H ))
5.100 3.300 0.900 peak 1854 spectrum 1 weight 0.10000E+01 volume 0.55112E-03 ppm1 1.992 ppm2 7.491 CV 1
OR { 1854}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 30 and name H ))
ASSI { 1858}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 87 and name H ))
3.700 1.700 1.700 peak 1858 spectrum 1 weight 0.10000E+01 volume 0.61602E-03 ppm1 4.133 ppm2 8.690 CV 1
ASSI { 1859}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HG2 ))
2.900 1.000 1.000 peak 1859 spectrum 1 weight 0.10000E+01 volume 0.34494E-02 ppm1 4.139 ppm2 2.451 CV 1
ASSI { 1860}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HG3 ))
2.700 0.900 0.900 peak 1860 spectrum 1 weight 0.10000E+01 volume 0.47159E-02 ppm1 4.139 ppm2 2.300 CV 1
ASSI { 1861}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB2 ))
2.600 0.800 0.800 peak 1861 spectrum 1 weight 0.10000E+01 volume 0.46765E-02 ppm1 4.139 ppm2 2.130 CV 1
ASSI { 1862}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB3 ))
2.600 0.800 0.800 peak 1862 spectrum 1 weight 0.10000E+01 volume 0.69506E-02 ppm1 4.139 ppm2 1.984 CV 1
ASSI { 1863}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 15 and name HB% )
2.600 0.800 0.800 peak 1863 spectrum 1 weight 0.10000E+01 volume 0.51546E-02 ppm1 4.140 ppm2 1.576 CV 1
ASSI { 1866}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HD2 ))
4.400 2.400 1.600 peak 1866 spectrum 1 weight 0.10000E+01 volume 0.10864E-02 ppm1 4.135 ppm2 3.228 CV 1
OR { 1866}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HD3 ))
ASSI { 1870}
(( segid " " and resid 86 and name HG2 ))
(( segid " " and resid 86 and name HA ))
2.600 0.800 0.800 peak 1870 spectrum 1 weight 0.10000E+01 volume 0.28944E-02 ppm1 1.804 ppm2 4.134 CV 1
ASSI { 1871}
(( segid " " and resid 82 and name HG ))
(( segid " " and resid 82 and name HA ))
3.500 1.500 1.500 peak 1871 spectrum 1 weight 0.10000E+01 volume 0.27211E-02 ppm1 1.808 ppm2 4.210 CV 1
ASSI { 1872}
(( segid " " and resid 86 and name HG3 ))
(( segid " " and resid 86 and name HA ))
2.900 1.100 1.100 peak 1872 spectrum 1 weight 0.10000E+01 volume 0.33223E-02 ppm1 1.662 ppm2 4.126 CV 1
ASSI { 1874}
(( segid " " and resid 86 and name HG2 ))
(( segid " " and resid 86 and name HB2 ))
2.200 0.600 0.600 peak 1874 spectrum 1 weight 0.10000E+01 volume 0.93902E-02 ppm1 1.802 ppm2 2.010 CV 1
OR { 1874}
(( segid " " and resid 86 and name HG2 ))
(( segid " " and resid 86 and name HB3 ))
ASSI { 1876}
(( segid " " and resid 86 and name HG3 ))
(( segid " " and resid 86 and name HB3 ))
2.100 0.500 0.500 peak 1876 spectrum 1 weight 0.10000E+01 volume 0.13039E-01 ppm1 1.661 ppm2 2.013 CV 1
OR { 1876}
(( segid " " and resid 86 and name HG3 ))
(( segid " " and resid 86 and name HB2 ))
ASSI { 1877}
(( segid " " and resid 82 and name HG ))
( segid " " and resid 82 and name HD1%)
1.900 0.500 0.500 peak 1877 spectrum 1 weight 0.10000E+01 volume 0.19078E-01 ppm1 1.807 ppm2 0.962 CV 1
OR { 1877}
(( segid " " and resid 82 and name HG ))
( segid " " and resid 82 and name HD2%)
ASSI { 1881}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 86 and name H ))
3.800 1.800 1.800 peak 1881 spectrum 1 weight 0.10000E+01 volume 0.74752E-03 ppm1 2.486 ppm2 8.369 CV 1
ASSI { 1882}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 86 and name H ))
4.100 2.100 1.900 peak 1882 spectrum 1 weight 0.10000E+01 volume 0.70063E-03 ppm1 2.310 ppm2 8.369 CV 1
ASSI { 1883}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name H ))
3.900 1.900 1.900 peak 1883 spectrum 1 weight 0.10000E+01 volume 0.19824E-02 ppm1 2.490 ppm2 8.130 CV 1
ASSI { 1884}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name H ))
3.800 1.800 1.800 peak 1884 spectrum 1 weight 0.10000E+01 volume 0.18101E-02 ppm1 2.310 ppm2 8.130 CV 1
ASSI { 1885}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HE21))
3.000 1.200 1.200 peak 1885 spectrum 1 weight 0.10000E+01 volume 0.56466E-03 ppm1 2.223 ppm2 6.841 CV 1
OR { 1885}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HE21))
ASSI { 1886}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HE22))
4.700 2.800 1.300 peak 1886 spectrum 1 weight 0.10000E+01 volume 0.62101E-03 ppm1 2.256 ppm2 7.228 CV 1
OR { 1886}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HE22))
ASSI { 1891}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 86 and name H ))
2.800 1.000 1.000 peak 1891 spectrum 1 weight 0.10000E+01 volume 0.13667E-02 ppm1 2.249 ppm2 8.367 CV 1
OR { 1891}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 86 and name H ))
ASSI { 1892}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 87 and name H ))
4.500 2.600 1.500 peak 1892 spectrum 1 weight 0.10000E+01 volume 0.38218E-03 ppm1 2.253 ppm2 8.668 CV 1
OR { 1892}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 87 and name H ))
ASSI { 1895}
(( segid " " and resid 85 and name HG2 ))
( segid " " and resid 88 and name HD% )
5.700 4.000 0.300 peak 1895 spectrum 1 weight 0.10000E+01 volume 0.31687E-03 ppm1 2.491 ppm2 7.043 CV 1
ASSI { 1896}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HE21))
3.200 1.300 1.300 peak 1896 spectrum 1 weight 0.10000E+01 volume 0.12577E-02 ppm1 2.310 ppm2 6.840 CV 1
ASSI { 1900}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HG2 ))
2.300 0.700 0.700 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.65557E-02 ppm1 3.820 ppm2 2.223 CV 1
ASSI { 1905}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name H ))
2.700 0.900 0.900 peak 1905 spectrum 1 weight 0.10000E+01 volume 0.25857E-02 ppm1 3.845 ppm2 8.133 CV 1
ASSI { 1906}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 88 and name H ))
3.700 1.700 1.700 peak 1906 spectrum 1 weight 0.10000E+01 volume 0.51760E-03 ppm1 3.842 ppm2 8.903 CV 1
ASSI { 1908}
(( segid " " and resid 85 and name HG2 ))
( segid " " and resid 123 and name HD1%)
3.800 1.800 1.800 peak 1908 spectrum 1 weight 0.10000E+01 volume 0.26719E-02 ppm1 2.490 ppm2 0.798 CV 1
ASSI { 1909}
(( segid " " and resid 85 and name HG2 ))
( segid " " and resid 123 and name HD2%)
3.400 1.400 1.400 peak 1909 spectrum 1 weight 0.10000E+01 volume 0.35940E-02 ppm1 2.489 ppm2 0.624 CV 1
OR { 1909}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 123 and name HB3 ))
ASSI { 1910}
(( segid " " and resid 85 and name HG3 ))
( segid " " and resid 82 and name HD2%)
4.100 2.100 1.900 peak 1910 spectrum 1 weight 0.10000E+01 volume 0.16738E-02 ppm1 2.306 ppm2 0.953 CV 1
OR { 1910}
(( segid " " and resid 85 and name HG3 ))
( segid " " and resid 82 and name HD1%)
ASSI { 1911}
(( segid " " and resid 85 and name HG3 ))
( segid " " and resid 123 and name HD1%)
2.300 0.700 0.700 peak 1911 spectrum 1 weight 0.10000E+01 volume 0.23624E-02 ppm1 2.309 ppm2 0.800 CV 1
ASSI { 1912}
(( segid " " and resid 85 and name HG3 ))
( segid " " and resid 123 and name HD2%)
2.700 0.900 0.900 peak 1912 spectrum 1 weight 0.10000E+01 volume 0.33209E-02 ppm1 2.309 ppm2 0.626 CV 1
OR { 1912}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 123 and name HB3 ))
ASSI { 1917}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 118 and name HG ))
4.600 2.600 1.400 peak 1917 spectrum 1 weight 0.10000E+01 volume 0.11888E-02 ppm1 2.314 ppm2 1.899 CV 1
ASSI { 1921}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 123 and name HG ))
4.500 2.500 1.500 peak 1921 spectrum 1 weight 0.10000E+01 volume 0.44606E-03 ppm1 2.314 ppm2 1.344 CV 1
ASSI { 1922}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HG3 ))
1.600 0.300 0.600 peak 1922 spectrum 1 weight 0.10000E+01 volume 0.15853E-01 ppm1 2.489 ppm2 2.304 CV 1
OR { 1922}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HB2 ))
ASSI { 1923}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HG2 ))
1.600 0.300 0.600 peak 1923 spectrum 1 weight 0.10000E+01 volume 0.13353E-01 ppm1 2.310 ppm2 2.487 CV 1
ASSI { 1925}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 88 and name HB3 ))
4.100 2.100 1.900 peak 1925 spectrum 1 weight 0.10000E+01 volume 0.43983E-03 ppm1 2.308 ppm2 3.199 CV 1
ASSI { 1926}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 82 and name HA ))
4.200 2.200 1.800 peak 1926 spectrum 1 weight 0.10000E+01 volume 0.91473E-03 ppm1 2.490 ppm2 4.216 CV 1
ASSI { 1927}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HA ))
3.600 1.600 1.600 peak 1927 spectrum 1 weight 0.10000E+01 volume 0.20412E-02 ppm1 2.489 ppm2 3.847 CV 1
ASSI { 1928}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 82 and name HA ))
4.600 2.600 1.400 peak 1928 spectrum 1 weight 0.10000E+01 volume 0.78615E-03 ppm1 2.311 ppm2 4.206 CV 1
ASSI { 1930}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HA ))
2.600 0.800 0.800 peak 1930 spectrum 1 weight 0.10000E+01 volume 0.18902E-02 ppm1 2.309 ppm2 3.845 CV 1
ASSI { 1931}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 82 and name HA ))
3.100 1.200 1.200 peak 1931 spectrum 1 weight 0.10000E+01 volume 0.13467E-02 ppm1 2.237 ppm2 4.216 CV 1
OR { 1931}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 82 and name HA ))
ASSI { 1932}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HA ))
2.700 0.900 0.900 peak 1932 spectrum 1 weight 0.10000E+01 volume 0.23311E-02 ppm1 2.230 ppm2 3.844 CV 1
OR { 1932}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HA ))
ASSI { 1933}
(( segid " " and resid 36 and name HG12))
(( segid " " and resid 36 and name HA ))
3.300 1.400 1.400 peak 1933 spectrum 1 weight 0.10000E+01 volume 0.57334E-03 ppm1 2.256 ppm2 3.636 CV 1
ASSI { 1934}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 53 and name HB3 ))
2.300 0.700 0.700 peak 1934 spectrum 1 weight 0.10000E+01 volume 0.23870E-02 ppm1 2.206 ppm2 2.890 CV 1
ASSI { 1936}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 82 and name HB3 ))
3.800 1.800 1.800 peak 1936 spectrum 1 weight 0.10000E+01 volume 0.23147E-02 ppm1 2.225 ppm2 1.719 CV 1
OR { 1936}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 82 and name HB3 ))
ASSI { 1937}
(( segid " " and resid 36 and name HG12))
( segid " " and resid 36 and name HD1%)
2.200 0.600 0.600 peak 1937 spectrum 1 weight 0.10000E+01 volume 0.41599E-02 ppm1 2.256 ppm2 1.001 CV 1
OR { 1937}
(( segid " " and resid 36 and name HG12))
( segid " " and resid 36 and name HG2%)
ASSI { 1941}
( segid " " and resid 84 and name HD1%)
( segid " " and resid 84 and name HD2%)
2.300 0.600 0.600 peak 1941 spectrum 1 weight 0.10000E+01 volume 0.11581E-01 ppm1 1.087 ppm2 0.607 CV 1
ASSI { 1944}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 9 and name HZ2 ))
3.300 1.400 1.400 peak 1944 spectrum 1 weight 0.10000E+01 volume 0.17254E-02 ppm1 1.072 ppm2 6.902 CV 1
ASSI { 1950}
(( segid " " and resid 118 and name HB2 ))
(( segid " " and resid 118 and name HB3 ))
2.500 0.800 0.800 peak 1950 spectrum 1 weight 0.10000E+01 volume 0.73805E-03 ppm1 2.042 ppm2 1.571 CV 1
ASSI { 1951}
(( segid " " and resid 84 and name HB3 ))
(( segid " " and resid 84 and name HG ))
3.400 1.500 1.500 peak 1951 spectrum 1 weight 0.10000E+01 volume 0.56239E-03 ppm1 2.049 ppm2 1.482 CV 1
ASSI { 1953}
(( segid " " and resid 84 and name HB2 ))
(( segid " " and resid 84 and name HB3 ))
2.400 0.700 0.700 peak 1953 spectrum 1 weight 0.10000E+01 volume 0.12352E-02 ppm1 1.814 ppm2 2.039 CV 1
ASSI { 1965}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 56 and name HB3 ))
3.400 1.400 1.400 peak 1965 spectrum 1 weight 0.10000E+01 volume 0.52486E-02 ppm1 4.018 ppm2 1.853 CV 1
ASSI { 1968}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB3 ))
2.700 0.900 0.900 peak 1968 spectrum 1 weight 0.10000E+01 volume 0.18203E-02 ppm1 4.017 ppm2 2.897 CV 1
ASSI { 1973}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 21 and name H ))
4.400 2.400 1.600 peak 1973 spectrum 1 weight 0.10000E+01 volume 0.30845E-03 ppm1 4.018 ppm2 8.941 CV 1
ASSI { 1974}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HA ))
3.100 1.200 1.200 peak 1974 spectrum 1 weight 0.10000E+01 volume 0.17536E-02 ppm1 2.375 ppm2 4.001 CV 1
ASSI { 1975}
(( segid " " and resid 14 and name HB2 ))
( segid " " and resid 15 and name HB% )
4.200 2.200 1.800 peak 1975 spectrum 1 weight 0.10000E+01 volume 0.91085E-03 ppm1 2.388 ppm2 1.578 CV 1
ASSI { 1977}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HA ))
3.200 1.200 1.200 peak 1977 spectrum 1 weight 0.10000E+01 volume 0.12754E-02 ppm1 2.392 ppm2 4.250 CV 1
OR { 1977}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HA ))
ASSI { 1978}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 84 and name HA ))
4.000 2.000 2.000 peak 1978 spectrum 1 weight 0.10000E+01 volume 0.80326E-03 ppm1 2.394 ppm2 4.141 CV 1
ASSI { 1979}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 9 and name HE3 ))
2.900 1.100 1.100 peak 1979 spectrum 1 weight 0.10000E+01 volume 0.85390E-03 ppm1 2.400 ppm2 7.074 CV 1
OR { 1979}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 9 and name HE3 ))
ASSI { 1982}
(( segid " " and resid 12 and name HG2 ))
( segid " " and resid 15 and name HB% )
3.500 1.500 1.500 peak 1982 spectrum 1 weight 0.10000E+01 volume 0.22317E-02 ppm1 2.447 ppm2 1.574 CV 1
ASSI { 1986}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 12 and name HG3 ))
1.500 0.300 0.700 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.48566E-01 ppm1 2.449 ppm2 2.299 CV 1
ASSI { 1989}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 20 and name H ))
3.900 1.900 1.900 peak 1989 spectrum 1 weight 0.10000E+01 volume 0.12872E-02 ppm1 2.467 ppm2 8.668 CV 1
ASSI { 1991}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 12 and name H ))
4.000 2.000 2.000 peak 1991 spectrum 1 weight 0.10000E+01 volume 0.13357E-02 ppm1 2.452 ppm2 8.967 CV 1
ASSI { 1997}
(( segid " " and resid 37 and name HG ))
( segid " " and resid 66 and name HD% )
5.000 3.100 1.000 peak 1997 spectrum 1 weight 0.10000E+01 volume 0.58780E-03 ppm1 1.693 ppm2 7.295 CV 1
ASSI { 2001}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 85 and name HE22))
4.600 2.600 1.400 peak 2001 spectrum 1 weight 0.10000E+01 volume 0.12734E-02 ppm1 0.974 ppm2 7.235 CV 1
ASSI { 2002}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 88 and name H ))
4.000 2.000 2.000 peak 2002 spectrum 1 weight 0.10000E+01 volume 0.39516E-03 ppm1 0.931 ppm2 8.869 CV 1
ASSI { 2003}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 79 and name HA ))
4.300 2.300 1.700 peak 2003 spectrum 1 weight 0.10000E+01 volume 0.12859E-02 ppm1 0.939 ppm2 4.508 CV 1
ASSI { 2009}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 82 and name HB3 ))
1.900 0.400 0.400 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.67111E-02 ppm1 1.917 ppm2 1.697 CV 1
ASSI { 2012}
(( segid " " and resid 54 and name HB3 ))
( segid " " and resid 54 and name HD1%)
2.700 0.900 0.900 peak 2012 spectrum 1 weight 0.10000E+01 volume 0.21733E-02 ppm1 1.934 ppm2 0.418 CV 1
OR { 2012}
(( segid " " and resid 54 and name HB3 ))
( segid " " and resid 54 and name HD2%)
ASSI { 2015}
(( segid " " and resid 82 and name HB3 ))
(( segid " " and resid 79 and name HA ))
3.600 1.600 1.600 peak 2015 spectrum 1 weight 0.10000E+01 volume 0.44537E-03 ppm1 1.688 ppm2 4.532 CV 1
ASSI { 2016}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 82 and name HA ))
2.800 0.900 0.900 peak 2016 spectrum 1 weight 0.10000E+01 volume 0.17388E-02 ppm1 1.918 ppm2 4.220 CV 1
ASSI { 2017}
(( segid " " and resid 54 and name HB3 ))
(( segid " " and resid 55 and name H ))
3.900 1.900 1.900 peak 2017 spectrum 1 weight 0.10000E+01 volume 0.52050E-03 ppm1 1.917 ppm2 7.496 CV 1
ASSI { 2025}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 82 and name HB2 ))
3.900 1.900 1.900 peak 2025 spectrum 1 weight 0.10000E+01 volume 0.11842E-02 ppm1 4.538 ppm2 1.923 CV 1
ASSI { 2028}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB2 ))
3.600 1.600 1.600 peak 2028 spectrum 1 weight 0.10000E+01 volume 0.12835E-02 ppm1 4.543 ppm2 2.584 CV 1
ASSI { 2030}
(( segid " " and resid 79 and name HB3 ))
(( segid " " and resid 79 and name HA ))
3.100 1.200 1.200 peak 2030 spectrum 1 weight 0.10000E+01 volume 0.14604E-02 ppm1 2.715 ppm2 4.549 CV 1
ASSI { 2036}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 76 and name HH2 ))
3.100 1.200 1.200 peak 2036 spectrum 1 weight 0.10000E+01 volume 0.90961E-03 ppm1 7.105 ppm2 6.888 CV 1
ASSI { 2037}
( segid " " and resid 21 and name HD% )
( segid " " and resid 66 and name HE% )
3.900 1.900 1.900 peak 2037 spectrum 1 weight 0.10000E+01 volume 0.93109E-03 ppm1 6.910 ppm2 7.093 CV 1
ASSI { 2038}
(( segid " " and resid 76 and name HH2 ))
(( segid " " and resid 76 and name HZ3 ))
3.000 1.200 1.200 peak 2038 spectrum 1 weight 0.10000E+01 volume 0.10021E-02 ppm1 6.893 ppm2 7.086 CV 1
OR { 2038}
(( segid " " and resid 76 and name HH2 ))
(( segid " " and resid 76 and name HZ2 ))
ASSI { 2039}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 76 and name HZ2 ))
5.100 3.200 0.900 peak 2039 spectrum 1 weight 0.10000E+01 volume 0.35692E-03 ppm1 7.349 ppm2 7.099 CV 1
ASSI { 2042}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 76 and name HE3 ))
6.000 4.500 0.000 peak 2042 spectrum 1 weight 0.10000E+01 volume 0.10285E-03 ppm1 7.102 ppm2 7.366 CV 1
OR { 2042}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 76 and name HD1 ))
ASSI { 2043}
(( segid " " and resid 76 and name HH2 ))
(( segid " " and resid 76 and name HE3 ))
5.400 3.700 0.600 peak 2043 spectrum 1 weight 0.10000E+01 volume 0.16943E-03 ppm1 6.898 ppm2 7.374 CV 1
ASSI { 2050}
(( segid " " and resid 76 and name HD1 ))
( segid " " and resid 74 and name HG1%)
3.200 1.300 1.300 peak 2050 spectrum 1 weight 0.10000E+01 volume 0.16153E-02 ppm1 7.357 ppm2 0.893 CV 1
OR { 2050}
(( segid " " and resid 76 and name HD1 ))
( segid " " and resid 74 and name HG2%)
ASSI { 2059}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 56 and name HG3 ))
4.100 2.100 1.900 peak 2059 spectrum 1 weight 0.10000E+01 volume 0.40143E-03 ppm1 3.158 ppm2 2.146 CV 1
ASSI { 2062}
(( segid " " and resid 72 and name HB2 ))
( segid " " and resid 120 and name HB% )
5.500 3.800 0.500 peak 2062 spectrum 1 weight 0.10000E+01 volume 0.36673E-03 ppm1 3.060 ppm2 1.471 CV 1
ASSI { 2069}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 76 and name HB3 ))
4.400 2.500 1.600 peak 2069 spectrum 1 weight 0.10000E+01 volume 0.29204E-03 ppm1 7.358 ppm2 3.095 CV 1
OR { 2069}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 76 and name HB2 ))
ASSI { 2072}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 109 and name HG2 ))
4.300 2.400 1.700 peak 2072 spectrum 1 weight 0.10000E+01 volume 0.42714E-03 ppm1 7.102 ppm2 1.340 CV 1
ASSI { 2073}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 114 and name HG12))
4.000 2.000 2.000 peak 2073 spectrum 1 weight 0.10000E+01 volume 0.44698E-03 ppm1 7.107 ppm2 1.205 CV 1
ASSI { 2074}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 114 and name HG13))
4.400 2.500 1.600 peak 2074 spectrum 1 weight 0.10000E+01 volume 0.35178E-03 ppm1 7.104 ppm2 1.840 CV 1
ASSI { 2075}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 84 and name HB3 ))
4.900 3.000 1.100 peak 2075 spectrum 1 weight 0.10000E+01 volume 0.28013E-03 ppm1 7.114 ppm2 2.082 CV 1
ASSI { 2079}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 80 and name HB2 ))
6.000 5.000 0.000 peak 2079 spectrum 1 weight 0.10000E+01 volume 0.14689E-03 ppm1 3.145 ppm2 2.425 CV 1
ASSI { 2080}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 80 and name HB3 ))
4.500 2.500 1.500 peak 2080 spectrum 1 weight 0.10000E+01 volume 0.23345E-03 ppm1 3.150 ppm2 2.584 CV 1
ASSI { 2081}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 114 and name HA ))
4.600 2.600 1.400 peak 2081 spectrum 1 weight 0.10000E+01 volume 0.51010E-03 ppm1 7.110 ppm2 3.869 CV 1
ASSI { 2083}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 75 and name HA ))
4.700 2.700 1.300 peak 2083 spectrum 1 weight 0.10000E+01 volume 0.36336E-03 ppm1 7.358 ppm2 4.461 CV 1
ASSI { 2085}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 71 and name HA ))
5.400 3.700 0.600 peak 2085 spectrum 1 weight 0.10000E+01 volume 0.30884E-03 ppm1 3.152 ppm2 4.321 CV 1
ASSI { 2093}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 76 and name HE3 ))
4.500 2.500 1.500 peak 2093 spectrum 1 weight 0.10000E+01 volume 0.20737E-03 ppm1 3.060 ppm2 7.360 CV 1
OR { 2093}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 76 and name HD1 ))
ASSI { 2100}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HD1 ))
3.600 1.600 1.600 peak 2100 spectrum 1 weight 0.10000E+01 volume 0.70998E-03 ppm1 4.936 ppm2 7.377 CV 1
ASSI { 2101}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HD2 ))
3.200 1.300 1.300 peak 2101 spectrum 1 weight 0.10000E+01 volume 0.10230E-02 ppm1 4.940 ppm2 3.988 CV 1
OR { 2101}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HD3 ))
ASSI { 2104}
(( segid " " and resid 75 and name HB3 ))
(( segid " " and resid 76 and name H ))
4.300 2.300 1.700 peak 2104 spectrum 1 weight 0.10000E+01 volume 0.98333E-03 ppm1 1.675 ppm2 8.655 CV 1
ASSI { 2105}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 76 and name H ))
4.300 2.300 1.700 peak 2105 spectrum 1 weight 0.10000E+01 volume 0.10788E-02 ppm1 1.563 ppm2 8.654 CV 1
ASSI { 2107}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name H ))
3.100 1.200 1.200 peak 2107 spectrum 1 weight 0.10000E+01 volume 0.13167E-02 ppm1 1.565 ppm2 8.387 CV 1
ASSI { 2110}
(( segid " " and resid 138 and name HB3 ))
(( segid " " and resid 136 and name HE3 ))
3.000 1.100 1.100 peak 2110 spectrum 1 weight 0.10000E+01 volume 0.20541E-02 ppm1 1.594 ppm2 2.971 CV 1
OR { 2110}
(( segid " " and resid 138 and name HB2 ))
(( segid " " and resid 136 and name HE2 ))
OR { 2110}
(( segid " " and resid 138 and name HB2 ))
(( segid " " and resid 136 and name HE3 ))
ASSI { 2111}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 74 and name HA ))
4.300 2.300 1.700 peak 2111 spectrum 1 weight 0.10000E+01 volume 0.10665E-02 ppm1 1.562 ppm2 4.104 CV 1
ASSI { 2113}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HB2 ))
2.500 0.800 0.800 peak 2113 spectrum 1 weight 0.10000E+01 volume 0.40577E-02 ppm1 4.450 ppm2 1.909 CV 1
OR { 2113}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HG ))
ASSI { 2114}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HB3 ))
2.500 0.800 0.800 peak 2114 spectrum 1 weight 0.10000E+01 volume 0.36020E-02 ppm1 4.459 ppm2 1.661 CV 1
OR { 2114}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HG ))
ASSI { 2116}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 20 and name HD2%)
3.100 1.200 1.200 peak 2116 spectrum 1 weight 0.10000E+01 volume 0.15480E-02 ppm1 4.450 ppm2 0.603 CV 1
ASSI { 2121}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 74 and name H ))
2.200 0.600 0.600 peak 2121 spectrum 1 weight 0.10000E+01 volume 0.47313E-02 ppm1 0.873 ppm2 8.390 CV 1
ASSI { 2123}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 117 and name HD3 ))
3.900 1.900 1.900 peak 2123 spectrum 1 weight 0.10000E+01 volume 0.21548E-02 ppm1 0.873 ppm2 0.529 CV 1
ASSI { 2125}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 109 and name HD3 ))
2.900 1.100 1.100 peak 2125 spectrum 1 weight 0.10000E+01 volume 0.14850E-02 ppm1 0.879 ppm2 2.427 CV 1
ASSI { 2127}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 30 and name HB3 ))
2.400 0.700 0.700 peak 2127 spectrum 1 weight 0.10000E+01 volume 0.66159E-02 ppm1 0.886 ppm2 1.857 CV 1
ASSI { 2128}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 75 and name HG ))
3.800 1.800 1.800 peak 2128 spectrum 1 weight 0.10000E+01 volume 0.22985E-02 ppm1 0.872 ppm2 1.657 CV 1
OR { 2128}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 75 and name HB3 ))
ASSI { 2132}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 113 and name HD2 ))
3.200 1.300 1.300 peak 2132 spectrum 1 weight 0.10000E+01 volume 0.16271E-02 ppm1 0.873 ppm2 3.385 CV 1
OR { 2132}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 113 and name HD3 ))
ASSI { 2134}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 27 and name HA ))
2.500 0.800 0.800 peak 2134 spectrum 1 weight 0.10000E+01 volume 0.90272E-02 ppm1 0.887 ppm2 3.892 CV 1
ASSI { 2136}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 27 and name H ))
3.200 1.300 1.300 peak 2136 spectrum 1 weight 0.10000E+01 volume 0.41096E-02 ppm1 0.886 ppm2 7.311 CV 1
ASSI { 2137}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 30 and name H ))
3.300 1.400 1.400 peak 2137 spectrum 1 weight 0.10000E+01 volume 0.18936E-02 ppm1 0.885 ppm2 7.487 CV 1
ASSI { 2140}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 28 and name H ))
2.500 0.800 0.800 peak 2140 spectrum 1 weight 0.10000E+01 volume 0.62179E-02 ppm1 0.886 ppm2 8.628 CV 1
ASSI { 2142}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 113 and name HD2 ))
3.100 1.200 1.200 peak 2142 spectrum 1 weight 0.10000E+01 volume 0.19727E-02 ppm1 0.916 ppm2 3.385 CV 1
OR { 2142}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 113 and name HD3 ))
ASSI { 2143}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 74 and name HA ))
2.500 0.800 0.800 peak 2143 spectrum 1 weight 0.10000E+01 volume 0.11163E-01 ppm1 0.916 ppm2 4.103 CV 1
ASSI { 2144}
(( segid " " and resid 74 and name HB ))
(( segid " " and resid 74 and name HA ))
2.400 0.700 0.700 peak 2144 spectrum 1 weight 0.10000E+01 volume 0.42220E-02 ppm1 2.028 ppm2 4.107 CV 1
ASSI { 2145}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 74 and name HB ))
1.900 0.400 0.400 peak 2145 spectrum 1 weight 0.10000E+01 volume 0.22162E-01 ppm1 0.915 ppm2 2.026 CV 1
ASSI { 2148}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 75 and name HG ))
3.700 1.700 1.700 peak 2148 spectrum 1 weight 0.10000E+01 volume 0.21604E-02 ppm1 4.094 ppm2 1.579 CV 1
OR { 2148}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 75 and name HB2 ))
ASSI { 2149}
(( segid " " and resid 74 and name HA ))
( segid " " and resid 74 and name HG1%)
2.400 0.700 0.700 peak 2149 spectrum 1 weight 0.10000E+01 volume 0.14750E-01 ppm1 4.094 ppm2 0.898 CV 1
OR { 2149}
(( segid " " and resid 74 and name HA ))
( segid " " and resid 74 and name HG2%)
ASSI { 2150}
(( segid " " and resid 74 and name HB ))
( segid " " and resid 74 and name HG2%)
1.800 0.400 0.400 peak 2150 spectrum 1 weight 0.10000E+01 volume 0.24431E-01 ppm1 2.027 ppm2 0.898 CV 1
OR { 2150}
(( segid " " and resid 74 and name HB ))
( segid " " and resid 74 and name HG1%)
ASSI { 2152}
(( segid " " and resid 74 and name HB ))
(( segid " " and resid 109 and name HD3 ))
4.000 2.000 2.000 peak 2152 spectrum 1 weight 0.10000E+01 volume 0.65022E-03 ppm1 2.030 ppm2 2.396 CV 1
ASSI { 2154}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 75 and name HG ))
3.100 1.200 1.200 peak 2154 spectrum 1 weight 0.10000E+01 volume 0.40574E-02 ppm1 0.916 ppm2 1.586 CV 1
OR { 2154}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 75 and name HB2 ))
ASSI { 2155}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 109 and name HG2 ))
3.000 1.200 1.200 peak 2155 spectrum 1 weight 0.10000E+01 volume 0.39615E-02 ppm1 0.919 ppm2 1.404 CV 1
ASSI { 2157}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 114 and name HG12))
3.100 3.100 2.900 peak 2157 spectrum 1 weight 0.10000E+01 volume 0.45054E-02 ppm1 0.918 ppm2 1.236 CV 1
ASSI { 2160}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 85 and name HB2 ))
3.400 1.400 1.400 peak 2160 spectrum 1 weight 0.10000E+01 volume 0.98342E-03 ppm1 0.809 ppm2 2.259 CV 1
OR { 2160}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 85 and name HB3 ))
OR { 2160}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 85 and name HG3 ))
ASSI { 2163}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HG13))
1.900 0.400 0.400 peak 2163 spectrum 1 weight 0.10000E+01 volume 0.19099E-01 ppm1 0.809 ppm2 1.395 CV 1
ASSI { 2164}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HG12))
1.800 0.400 0.400 peak 2164 spectrum 1 weight 0.10000E+01 volume 0.22088E-01 ppm1 0.809 ppm2 1.140 CV 1
ASSI { 2168}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HB ))
1.900 0.500 0.500 peak 2168 spectrum 1 weight 0.10000E+01 volume 0.17955E-01 ppm1 0.830 ppm2 1.779 CV 1
ASSI { 2170}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HG13))
2.700 0.900 0.900 peak 2170 spectrum 1 weight 0.10000E+01 volume 0.10565E-01 ppm1 0.830 ppm2 1.396 CV 1
ASSI { 2171}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 114 and name HG12))
2.800 1.000 1.000 peak 2171 spectrum 1 weight 0.10000E+01 volume 0.27211E-02 ppm1 0.829 ppm2 1.234 CV 1
ASSI { 2173}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 73 and name HG13))
2.100 0.600 0.600 peak 2173 spectrum 1 weight 0.10000E+01 volume 0.66017E-02 ppm1 1.774 ppm2 1.395 CV 1
ASSI { 2174}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 73 and name HG13))
3.200 1.300 1.300 peak 2174 spectrum 1 weight 0.10000E+01 volume 0.20187E-02 ppm1 4.142 ppm2 1.393 CV 1
ASSI { 2177}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 73 and name HB ))
2.700 0.900 0.900 peak 2177 spectrum 1 weight 0.10000E+01 volume 0.31823E-02 ppm1 4.140 ppm2 1.778 CV 1
ASSI { 2181}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 74 and name H ))
4.700 2.800 1.300 peak 2181 spectrum 1 weight 0.10000E+01 volume 0.13720E-02 ppm1 0.810 ppm2 8.385 CV 1
ASSI { 2183}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name H ))
2.100 0.600 0.600 peak 2183 spectrum 1 weight 0.10000E+01 volume 0.38904E-02 ppm1 0.830 ppm2 8.386 CV 1
ASSI { 2186}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 109 and name H ))
3.400 1.400 1.400 peak 2186 spectrum 1 weight 0.10000E+01 volume 0.10669E-02 ppm1 1.371 ppm2 7.632 CV 1
ASSI { 2187}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 74 and name H ))
3.200 1.300 1.300 peak 2187 spectrum 1 weight 0.10000E+01 volume 0.15072E-02 ppm1 1.773 ppm2 8.390 CV 1
ASSI { 2189}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 74 and name H ))
2.100 0.600 0.600 peak 2189 spectrum 1 weight 0.10000E+01 volume 0.58271E-02 ppm1 4.141 ppm2 8.388 CV 1
ASSI { 2193}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 80 and name HE21))
4.000 2.000 2.000 peak 2193 spectrum 1 weight 0.10000E+01 volume 0.45227E-03 ppm1 0.825 ppm2 7.456 CV 1
ASSI { 2194}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 76 and name HE3 ))
4.100 2.100 1.900 peak 2194 spectrum 1 weight 0.10000E+01 volume 0.33629E-03 ppm1 0.828 ppm2 7.366 CV 1
ASSI { 2195}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 85 and name HE22))
4.700 2.800 1.300 peak 2195 spectrum 1 weight 0.10000E+01 volume 0.68313E-03 ppm1 0.827 ppm2 7.232 CV 1
ASSI { 2196}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 72 and name HD2 ))
4.900 3.000 1.100 peak 2196 spectrum 1 weight 0.10000E+01 volume 0.44533E-03 ppm1 0.827 ppm2 7.002 CV 1
ASSI { 2197}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 85 and name HE21))
4.700 2.700 1.300 peak 2197 spectrum 1 weight 0.10000E+01 volume 0.45472E-03 ppm1 0.828 ppm2 6.837 CV 1
ASSI { 2198}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 84 and name H ))
4.400 2.400 1.600 peak 2198 spectrum 1 weight 0.10000E+01 volume 0.34055E-03 ppm1 0.809 ppm2 7.988 CV 1
ASSI { 2199}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 80 and name HE21))
4.900 3.000 1.100 peak 2199 spectrum 1 weight 0.10000E+01 volume 0.21543E-03 ppm1 0.809 ppm2 7.451 CV 1
ASSI { 2200}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 85 and name HE22))
6.000 5.100 0.000 peak 2200 spectrum 1 weight 0.10000E+01 volume 0.39528E-04 ppm1 0.811 ppm2 7.239 CV 1
ASSI { 2203}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 80 and name HE22))
5.300 3.600 0.700 peak 2203 spectrum 1 weight 0.10000E+01 volume 0.24946E-03 ppm1 0.809 ppm2 6.601 CV 1
ASSI { 2210}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 81 and name HG2 ))
4.600 2.700 1.400 peak 2210 spectrum 1 weight 0.10000E+01 volume 0.32678E-03 ppm1 0.810 ppm2 2.807 CV 1
ASSI { 2215}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 71 and name HA ))
4.800 2.900 1.200 peak 2215 spectrum 1 weight 0.10000E+01 volume 0.44745E-03 ppm1 0.809 ppm2 4.345 CV 1
ASSI { 2217}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 113 and name HD2 ))
5.300 3.500 0.700 peak 2217 spectrum 1 weight 0.10000E+01 volume 0.38177E-03 ppm1 0.826 ppm2 3.373 CV 1
OR { 2217}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 113 and name HD3 ))
ASSI { 2221}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 72 and name HB2 ))
4.800 2.900 1.200 peak 2221 spectrum 1 weight 0.10000E+01 volume 0.24503E-03 ppm1 4.138 ppm2 3.093 CV 1
OR { 2221}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 72 and name HB3 ))
ASSI { 2228}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 75 and name HA ))
4.300 2.300 1.700 peak 2228 spectrum 1 weight 0.10000E+01 volume 0.69089E-03 ppm1 0.829 ppm2 4.459 CV 1
ASSI { 2229}
(( segid " " and resid 73 and name HB ))
( segid " " and resid 121 and name HD2%)
4.700 2.700 1.300 peak 2229 spectrum 1 weight 0.10000E+01 volume 0.78761E-03 ppm1 1.768 ppm2 0.628 CV 1
ASSI { 2231}
(( segid " " and resid 72 and name HE1 ))
(( segid " " and resid 72 and name HD2 ))
5.200 3.400 0.800 peak 2231 spectrum 1 weight 0.10000E+01 volume 0.25154E-03 ppm1 7.992 ppm2 7.017 CV 1
ASSI { 2235}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 72 and name HB3 ))
2.900 1.100 1.100 peak 2235 spectrum 1 weight 0.10000E+01 volume 0.17015E-02 ppm1 7.007 ppm2 3.143 CV 1
ASSI { 2236}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 72 and name HB2 ))
3.500 1.500 1.500 peak 2236 spectrum 1 weight 0.10000E+01 volume 0.17763E-02 ppm1 7.007 ppm2 3.063 CV 1
ASSI { 2239}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HB3 ))
2.700 0.900 0.900 peak 2239 spectrum 1 weight 0.10000E+01 volume 0.57351E-02 ppm1 4.674 ppm2 3.130 CV 1
ASSI { 2240}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HB2 ))
2.400 0.700 0.700 peak 2240 spectrum 1 weight 0.10000E+01 volume 0.44136E-02 ppm1 4.674 ppm2 3.064 CV 1
ASSI { 2242}
(( segid " " and resid 72 and name HE1 ))
(( segid " " and resid 75 and name HG ))
4.700 2.700 1.300 peak 2242 spectrum 1 weight 0.10000E+01 volume 0.24693E-03 ppm1 7.990 ppm2 1.644 CV 1
OR { 2242}
(( segid " " and resid 72 and name HE1 ))
(( segid " " and resid 75 and name HB3 ))
ASSI { 2243}
(( segid " " and resid 72 and name HE1 ))
( segid " " and resid 120 and name HB% )
5.200 3.400 0.800 peak 2243 spectrum 1 weight 0.10000E+01 volume 0.33651E-03 ppm1 7.990 ppm2 1.446 CV 1
ASSI { 2244}
(( segid " " and resid 72 and name HE1 ))
(( segid " " and resid 117 and name HD2 ))
5.300 3.500 0.700 peak 2244 spectrum 1 weight 0.10000E+01 volume 0.15159E-03 ppm1 7.988 ppm2 1.170 CV 1
ASSI { 2248}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 117 and name HD2 ))
3.900 1.900 1.900 peak 2248 spectrum 1 weight 0.10000E+01 volume 0.47683E-03 ppm1 7.007 ppm2 1.163 CV 1
ASSI { 2249}
(( segid " " and resid 72 and name HD2 ))
( segid " " and resid 120 and name HB% )
3.800 1.800 1.800 peak 2249 spectrum 1 weight 0.10000E+01 volume 0.60331E-03 ppm1 7.005 ppm2 1.426 CV 1
ASSI { 2252}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 73 and name HB ))
3.900 1.900 1.900 peak 2252 spectrum 1 weight 0.10000E+01 volume 0.20894E-02 ppm1 4.674 ppm2 1.769 CV 1
ASSI { 2253}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 73 and name HD1%)
4.100 2.100 1.900 peak 2253 spectrum 1 weight 0.10000E+01 volume 0.19749E-02 ppm1 4.677 ppm2 0.828 CV 1
OR { 2253}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 73 and name HG2%)
ASSI { 2257}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 73 and name HD1%)
3.600 1.600 1.600 peak 2257 spectrum 1 weight 0.10000E+01 volume 0.10051E-02 ppm1 4.170 ppm2 0.823 CV 1
OR { 2257}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 73 and name HG2%)
ASSI { 2258}
(( segid " " and resid 71 and name HA ))
( segid " " and resid 71 and name HG2%)
2.300 0.700 0.700 peak 2258 spectrum 1 weight 0.10000E+01 volume 0.12908E-01 ppm1 4.320 ppm2 1.170 CV 1
ASSI { 2259}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 71 and name HG2%)
1.900 0.500 0.500 peak 2259 spectrum 1 weight 0.10000E+01 volume 0.23900E-01 ppm1 4.171 ppm2 1.170 CV 1
ASSI { 2263}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 121 and name HB2 ))
3.500 1.500 1.500 peak 2263 spectrum 1 weight 0.10000E+01 volume 0.30930E-02 ppm1 4.310 ppm2 1.635 CV 1
ASSI { 2265}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 72 and name HB2 ))
5.400 3.600 0.600 peak 2265 spectrum 1 weight 0.10000E+01 volume 0.43815E-03 ppm1 4.320 ppm2 3.047 CV 1
ASSI { 2267}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 71 and name HA ))
2.100 0.600 0.600 peak 2267 spectrum 1 weight 0.10000E+01 volume 0.80423E-02 ppm1 4.171 ppm2 4.314 CV 1
ASSI { 2273}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 76 and name HB3 ))
4.400 2.400 1.600 peak 2273 spectrum 1 weight 0.10000E+01 volume 0.87592E-03 ppm1 1.166 ppm2 3.033 CV 1
ASSI { 2275}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 71 and name H ))
4.100 2.100 1.900 peak 2275 spectrum 1 weight 0.10000E+01 volume 0.46432E-03 ppm1 4.171 ppm2 8.099 CV 1
ASSI { 2279}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 48 and name H ))
3.700 1.700 1.700 peak 2279 spectrum 1 weight 0.10000E+01 volume 0.52325E-03 ppm1 1.173 ppm2 8.337 CV 1
ASSI { 2280}
(( segid " " and resid 70 and name HA3 ))
( segid " " and resid 63 and name HG1%)
3.400 1.400 1.400 peak 2280 spectrum 1 weight 0.10000E+01 volume 0.97945E-03 ppm1 4.026 ppm2 0.927 CV 1
OR { 2280}
(( segid " " and resid 70 and name HA2 ))
( segid " " and resid 63 and name HG1%)
ASSI { 2282}
(( segid " " and resid 70 and name HA2 ))
( segid " " and resid 71 and name HG2%)
3.900 1.900 1.900 peak 2282 spectrum 1 weight 0.10000E+01 volume 0.12067E-02 ppm1 4.018 ppm2 1.165 CV 1
OR { 2282}
(( segid " " and resid 70 and name HA3 ))
( segid " " and resid 71 and name HG2%)
ASSI { 2295}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB3 ))
2.200 0.600 0.600 peak 2295 spectrum 1 weight 0.10000E+01 volume 0.78512E-02 ppm1 4.402 ppm2 2.167 CV 1
ASSI { 2296}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB2 ))
2.700 0.900 0.900 peak 2296 spectrum 1 weight 0.10000E+01 volume 0.71485E-02 ppm1 4.402 ppm2 2.058 CV 1
ASSI { 2298}
(( segid " " and resid 67 and name HG2 ))
( segid " " and resid 37 and name HD2%)
4.100 2.100 1.900 peak 2298 spectrum 1 weight 0.10000E+01 volume 0.75029E-03 ppm1 2.396 ppm2 0.815 CV 1
OR { 2298}
(( segid " " and resid 67 and name HG3 ))
( segid " " and resid 37 and name HD2%)
ASSI { 2300}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 45 and name HB2 ))
2.700 0.900 0.900 peak 2300 spectrum 1 weight 0.10000E+01 volume 0.34654E-02 ppm1 2.158 ppm2 1.708 CV 1
OR { 2300}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 45 and name HB2 ))
OR { 2300}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 45 and name HB3 ))
OR { 2300}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 45 and name HB3 ))
ASSI { 2302}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HG2 ))
2.900 1.000 1.000 peak 2302 spectrum 1 weight 0.10000E+01 volume 0.17228E-02 ppm1 2.081 ppm2 2.853 CV 1
ASSI { 2303}
(( segid " " and resid 133 and name HA ))
(( segid " " and resid 131 and name HB2 ))
4.200 2.200 1.800 peak 2303 spectrum 1 weight 0.10000E+01 volume 0.74114E-03 ppm1 4.409 ppm2 2.865 CV 1
ASSI { 2305}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 64 and name HA ))
3.600 1.600 1.600 peak 2305 spectrum 1 weight 0.10000E+01 volume 0.18542E-02 ppm1 2.408 ppm2 4.109 CV 1
OR { 2305}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 64 and name HA ))
ASSI { 2313}
(( segid " " and resid 67 and name HG2 ))
( segid " " and resid 66 and name HD% )
4.300 2.300 1.700 peak 2313 spectrum 1 weight 0.10000E+01 volume 0.41945E-03 ppm1 2.414 ppm2 7.285 CV 1
OR { 2313}
(( segid " " and resid 67 and name HG3 ))
( segid " " and resid 66 and name HD% )
ASSI { 2317}
(( segid " " and resid 66 and name HA ))
( segid " " and resid 66 and name HD% )
3.300 1.400 1.400 peak 2317 spectrum 1 weight 0.10000E+01 volume 0.32726E-02 ppm1 4.575 ppm2 7.293 CV 1
ASSI { 2322}
(( segid " " and resid 66 and name HA ))
( segid " " and resid 66 and name HE% )
4.600 2.600 1.400 peak 2322 spectrum 1 weight 0.10000E+01 volume 0.75068E-03 ppm1 4.580 ppm2 7.069 CV 1
ASSI { 2326}
(( segid " " and resid 66 and name HB3 ))
( segid " " and resid 51 and name HG2%)
4.500 2.500 1.500 peak 2326 spectrum 1 weight 0.10000E+01 volume 0.10986E-02 ppm1 3.370 ppm2 0.673 CV 1
ASSI { 2328}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 67 and name HG3 ))
4.900 3.000 1.100 peak 2328 spectrum 1 weight 0.10000E+01 volume 0.46139E-03 ppm1 3.367 ppm2 2.418 CV 1
OR { 2328}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 2329}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 66 and name HB2 ))
2.000 0.500 0.500 peak 2329 spectrum 1 weight 0.10000E+01 volume 0.34089E-02 ppm1 3.368 ppm2 2.896 CV 1
ASSI { 2332}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 51 and name HG2%)
3.400 1.500 1.500 peak 2332 spectrum 1 weight 0.10000E+01 volume 0.14351E-02 ppm1 2.895 ppm2 0.667 CV 1
ASSI { 2334}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 33 and name HG1%)
3.600 1.600 1.600 peak 2334 spectrum 1 weight 0.10000E+01 volume 0.16652E-02 ppm1 2.896 ppm2 0.955 CV 1
OR { 2334}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 33 and name HG2%)
ASSI { 2335}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 63 and name HA ))
5.200 3.400 0.800 peak 2335 spectrum 1 weight 0.10000E+01 volume 0.40915E-03 ppm1 3.367 ppm2 3.963 CV 1
ASSI { 2338}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 55 and name HG1%)
2.400 0.700 0.700 peak 2338 spectrum 1 weight 0.10000E+01 volume 0.54309E-02 ppm1 4.584 ppm2 0.800 CV 1
OR { 2338}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 55 and name HG2%)
ASSI { 2340}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HG3 ))
4.200 2.200 1.800 peak 2340 spectrum 1 weight 0.10000E+01 volume 0.81270E-03 ppm1 4.576 ppm2 2.411 CV 1
OR { 2340}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 2341}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB2 ))
3.300 1.400 1.400 peak 2341 spectrum 1 weight 0.10000E+01 volume 0.19773E-02 ppm1 4.575 ppm2 2.895 CV 1
ASSI { 2342}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB3 ))
2.600 0.800 0.800 peak 2342 spectrum 1 weight 0.10000E+01 volume 0.25292E-02 ppm1 4.580 ppm2 3.375 CV 1
ASSI { 2345}
(( segid " " and resid 91 and name HZ ))
(( segid " " and resid 91 and name HB3 ))
5.200 3.400 0.800 peak 2345 spectrum 1 weight 0.10000E+01 volume 0.31029E-03 ppm1 7.094 ppm2 2.681 CV 1
ASSI { 2346}
(( segid " " and resid 69 and name HA ))
( segid " " and resid 71 and name HG2%)
3.900 1.900 1.900 peak 2346 spectrum 1 weight 0.10000E+01 volume 0.71424E-03 ppm1 4.399 ppm2 1.175 CV 1
ASSI { 2347}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 55 and name HG1%)
4.100 2.100 1.900 peak 2347 spectrum 1 weight 0.10000E+01 volume 0.51100E-03 ppm1 2.410 ppm2 0.801 CV 1
ASSI { 2349}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 60 and name HB% )
2.900 1.100 1.100 peak 2349 spectrum 1 weight 0.10000E+01 volume 0.15415E-02 ppm1 2.410 ppm2 1.239 CV 1
ASSI { 2350}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 64 and name HB3 ))
5.100 3.300 0.900 peak 2350 spectrum 1 weight 0.10000E+01 volume 0.46278E-03 ppm1 2.415 ppm2 1.709 CV 1
OR { 2350}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 64 and name HD2 ))
OR { 2350}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 64 and name HD3 ))
ASSI { 2351}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 61 and name HB3 ))
4.300 2.300 1.700 peak 2351 spectrum 1 weight 0.10000E+01 volume 0.74094E-03 ppm1 4.416 ppm2 2.708 CV 1
OR { 2351}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 61 and name HB2 ))
ASSI { 2352}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 70 and name HA2 ))
3.700 1.700 1.700 peak 2352 spectrum 1 weight 0.10000E+01 volume 0.18820E-02 ppm1 4.400 ppm2 4.034 CV 1
OR { 2352}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 70 and name HA3 ))
ASSI { 2353}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 64 and name HA ))
5.800 4.200 0.200 peak 2353 spectrum 1 weight 0.10000E+01 volume 0.14809E-03 ppm1 2.414 ppm2 4.111 CV 1
ASSI { 2355}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 65 and name HA ))
3.400 1.500 1.500 peak 2355 spectrum 1 weight 0.10000E+01 volume 0.16843E-02 ppm1 2.404 ppm2 4.413 CV 1
ASSI { 2357}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 66 and name HD% )
3.600 1.600 1.600 peak 2357 spectrum 1 weight 0.10000E+01 volume 0.52870E-03 ppm1 2.415 ppm2 7.291 CV 1
ASSI { 2358}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 66 and name H ))
3.100 1.200 1.200 peak 2358 spectrum 1 weight 0.10000E+01 volume 0.78883E-03 ppm1 2.413 ppm2 7.516 CV 1
ASSI { 2367}
(( segid " " and resid 64 and name HB3 ))
( segid " " and resid 63 and name HG1%)
3.900 1.900 1.900 peak 2367 spectrum 1 weight 0.10000E+01 volume 0.23907E-02 ppm1 1.734 ppm2 0.950 CV 1
OR { 2367}
(( segid " " and resid 64 and name HB3 ))
( segid " " and resid 63 and name HG2%)
ASSI { 2368}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HG2 ))
2.400 0.700 0.700 peak 2368 spectrum 1 weight 0.10000E+01 volume 0.53790E-02 ppm1 1.830 ppm2 1.434 CV 1
OR { 2368}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HG3 ))
ASSI { 2369}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HE2 ))
4.000 2.000 2.000 peak 2369 spectrum 1 weight 0.10000E+01 volume 0.17580E-02 ppm1 1.829 ppm2 2.977 CV 1
OR { 2369}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HE3 ))
ASSI { 2370}
(( segid " " and resid 108 and name HB3 ))
(( segid " " and resid 108 and name HE3 ))
3.700 1.800 1.800 peak 2370 spectrum 1 weight 0.10000E+01 volume 0.13351E-02 ppm1 1.728 ppm2 2.972 CV 1
OR { 2370}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HE3 ))
OR { 2370}
(( segid " " and resid 108 and name HB3 ))
(( segid " " and resid 108 and name HE2 ))
OR { 2370}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HE2 ))
ASSI { 2371}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HA ))
2.900 1.000 1.000 peak 2371 spectrum 1 weight 0.10000E+01 volume 0.37722E-02 ppm1 1.826 ppm2 4.106 CV 1
ASSI { 2372}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HA ))
2.400 0.700 0.700 peak 2372 spectrum 1 weight 0.10000E+01 volume 0.31954E-02 ppm1 1.727 ppm2 3.886 CV 1
ASSI { 2374}
(( segid " " and resid 64 and name HG3 ))
( segid " " and resid 63 and name HG1%)
2.600 0.900 0.900 peak 2374 spectrum 1 weight 0.10000E+01 volume 0.52239E-02 ppm1 1.409 ppm2 0.958 CV 1
OR { 2374}
(( segid " " and resid 64 and name HG2 ))
( segid " " and resid 63 and name HG1%)
OR { 2374}
(( segid " " and resid 64 and name HG3 ))
( segid " " and resid 63 and name HG2%)
OR { 2374}
(( segid " " and resid 64 and name HG2 ))
( segid " " and resid 63 and name HG2%)
ASSI { 2375}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 64 and name HA ))
2.900 1.100 1.100 peak 2375 spectrum 1 weight 0.10000E+01 volume 0.31349E-02 ppm1 1.665 ppm2 4.105 CV 1
OR { 2375}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 64 and name HA ))
ASSI { 2376}
(( segid " " and resid 64 and name HE3 ))
(( segid " " and resid 64 and name HA ))
3.800 1.800 1.800 peak 2376 spectrum 1 weight 0.10000E+01 volume 0.18444E-02 ppm1 2.979 ppm2 4.091 CV 1
OR { 2376}
(( segid " " and resid 64 and name HE2 ))
(( segid " " and resid 64 and name HA ))
ASSI { 2377}
(( segid " " and resid 25 and name HE2 ))
(( segid " " and resid 22 and name HA ))
3.200 1.300 1.300 peak 2377 spectrum 1 weight 0.10000E+01 volume 0.23785E-02 ppm1 2.975 ppm2 3.707 CV 1
OR { 2377}
(( segid " " and resid 25 and name HE3 ))
(( segid " " and resid 22 and name HA ))
ASSI { 2382}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 65 and name H ))
4.200 2.200 1.800 peak 2382 spectrum 1 weight 0.10000E+01 volume 0.81083E-03 ppm1 1.663 ppm2 7.692 CV 1
OR { 2382}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 65 and name H ))
ASSI { 2383}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 64 and name H ))
3.300 1.300 1.300 peak 2383 spectrum 1 weight 0.10000E+01 volume 0.18408E-02 ppm1 1.667 ppm2 8.285 CV 1
OR { 2383}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 64 and name H ))
ASSI { 2384}
(( segid " " and resid 48 and name HD2 ))
(( segid " " and resid 52 and name HD2 ))
4.100 2.100 1.900 peak 2384 spectrum 1 weight 0.10000E+01 volume 0.77128E-03 ppm1 1.692 ppm2 7.068 CV 1
OR { 2384}
(( segid " " and resid 48 and name HD3 ))
(( segid " " and resid 52 and name HD2 ))
ASSI { 2386}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 30 and name HE21))
3.300 1.300 1.300 peak 2386 spectrum 1 weight 0.10000E+01 volume 0.67565E-03 ppm1 1.845 ppm2 7.031 CV 1
ASSI { 2387}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 52 and name HD2 ))
4.800 2.900 1.200 peak 2387 spectrum 1 weight 0.10000E+01 volume 0.26334E-03 ppm1 1.728 ppm2 7.060 CV 1
ASSI { 2389}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 63 and name H ))
4.600 2.700 1.400 peak 2389 spectrum 1 weight 0.10000E+01 volume 0.38759E-03 ppm1 1.833 ppm2 8.637 CV 1
ASSI { 2390}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 63 and name H ))
6.000 4.400 0.000 peak 2390 spectrum 1 weight 0.10000E+01 volume 0.32870E-03 ppm1 1.749 ppm2 8.654 CV 1
ASSI { 2391}
(( segid " " and resid 25 and name HE2 ))
(( segid " " and resid 25 and name H ))
5.100 3.300 0.900 peak 2391 spectrum 1 weight 0.10000E+01 volume 0.56538E-03 ppm1 2.965 ppm2 8.043 CV 1
OR { 2391}
(( segid " " and resid 25 and name HE3 ))
(( segid " " and resid 25 and name H ))
ASSI { 2393}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 55 and name HG1%)
2.300 0.700 0.700 peak 2393 spectrum 1 weight 0.10000E+01 volume 0.12958E-01 ppm1 3.967 ppm2 0.803 CV 1
OR { 2393}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 55 and name HG2%)
ASSI { 2395}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 32 and name HG1%)
3.000 1.100 1.100 peak 2395 spectrum 1 weight 0.10000E+01 volume 0.49824E-02 ppm1 3.964 ppm2 1.281 CV 1
ASSI { 2396}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB ))
2.500 0.800 0.800 peak 2396 spectrum 1 weight 0.10000E+01 volume 0.39572E-02 ppm1 3.964 ppm2 2.363 CV 1
ASSI { 2397}
( segid " " and resid 63 and name HG2%)
( segid " " and resid 51 and name HG2%)
2.200 0.600 0.600 peak 2397 spectrum 1 weight 0.10000E+01 volume 0.94218E-02 ppm1 0.962 ppm2 0.678 CV 1
ASSI { 2398}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name HG3 ))
2.800 1.000 1.000 peak 2398 spectrum 1 weight 0.10000E+01 volume 0.72341E-02 ppm1 0.963 ppm2 1.441 CV 1
OR { 2398}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name HG2 ))
ASSI { 2401}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 67 and name HG2 ))
3.400 1.400 1.400 peak 2401 spectrum 1 weight 0.10000E+01 volume 0.17573E-02 ppm1 0.964 ppm2 2.416 CV 1
OR { 2401}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 67 and name HG3 ))
ASSI { 2403}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 66 and name HB2 ))
4.300 2.300 1.700 peak 2403 spectrum 1 weight 0.10000E+01 volume 0.61310E-03 ppm1 0.961 ppm2 2.874 CV 1
ASSI { 2404}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 68 and name HD2 ))
3.900 1.900 1.900 peak 2404 spectrum 1 weight 0.10000E+01 volume 0.67649E-03 ppm1 0.965 ppm2 3.232 CV 1
OR { 2404}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 68 and name HD3 ))
ASSI { 2405}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 66 and name HB3 ))
5.500 3.700 0.500 peak 2405 spectrum 1 weight 0.10000E+01 volume 0.52335E-03 ppm1 0.967 ppm2 3.358 CV 1
ASSI { 2406}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 62 and name HB3 ))
4.400 2.400 1.600 peak 2406 spectrum 1 weight 0.10000E+01 volume 0.13901E-02 ppm1 0.964 ppm2 3.776 CV 1
ASSI { 2407}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 63 and name HA ))
2.300 0.600 0.600 peak 2407 spectrum 1 weight 0.10000E+01 volume 0.90165E-02 ppm1 0.963 ppm2 3.964 CV 1
ASSI { 2411}
( segid " " and resid 63 and name HG2%)
( segid " " and resid 66 and name HD% )
3.600 1.600 1.600 peak 2411 spectrum 1 weight 0.10000E+01 volume 0.12743E-02 ppm1 0.964 ppm2 7.292 CV 1
ASSI { 2412}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 66 and name H ))
4.000 2.000 2.000 peak 2412 spectrum 1 weight 0.10000E+01 volume 0.10890E-02 ppm1 0.964 ppm2 7.505 CV 1
ASSI { 2413}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 67 and name H ))
3.400 1.400 1.400 peak 2413 spectrum 1 weight 0.10000E+01 volume 0.13993E-02 ppm1 0.963 ppm2 7.832 CV 1
ASSI { 2414}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 65 and name H ))
3.900 1.900 1.900 peak 2414 spectrum 1 weight 0.10000E+01 volume 0.10285E-02 ppm1 0.964 ppm2 7.698 CV 1
ASSI { 2415}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name H ))
2.900 1.100 1.100 peak 2415 spectrum 1 weight 0.10000E+01 volume 0.44700E-02 ppm1 0.963 ppm2 8.283 CV 1
ASSI { 2416}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 63 and name H ))
3.200 1.300 1.300 peak 2416 spectrum 1 weight 0.10000E+01 volume 0.65127E-02 ppm1 0.963 ppm2 8.662 CV 1
ASSI { 2418}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name H ))
2.800 1.000 1.000 peak 2418 spectrum 1 weight 0.10000E+01 volume 0.22466E-02 ppm1 3.966 ppm2 7.493 CV 1
ASSI { 2424}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 63 and name H ))
2.600 0.800 0.800 peak 2424 spectrum 1 weight 0.10000E+01 volume 0.17257E-02 ppm1 3.764 ppm2 8.659 CV 1
ASSI { 2426}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB3 ))
2.700 0.900 0.900 peak 2426 spectrum 1 weight 0.10000E+01 volume 0.20343E-02 ppm1 4.585 ppm2 3.768 CV 1
ASSI { 2430}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 64 and name HE2 ))
4.400 2.400 1.600 peak 2430 spectrum 1 weight 0.10000E+01 volume 0.34725E-03 ppm1 3.769 ppm2 2.970 CV 1
OR { 2430}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 64 and name HE3 ))
ASSI { 2431}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 61 and name HB2 ))
4.300 2.300 1.700 peak 2431 spectrum 1 weight 0.10000E+01 volume 0.89713E-03 ppm1 3.763 ppm2 2.705 CV 1
OR { 2431}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 61 and name HB3 ))
ASSI { 2432}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 65 and name HB3 ))
5.100 3.300 0.900 peak 2432 spectrum 1 weight 0.10000E+01 volume 0.49292E-03 ppm1 3.757 ppm2 2.398 CV 1
ASSI { 2433}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 60 and name HB% )
4.700 2.800 1.300 peak 2433 spectrum 1 weight 0.10000E+01 volume 0.73510E-03 ppm1 3.764 ppm2 1.244 CV 1
ASSI { 2434}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 64 and name HG2 ))
3.400 1.500 1.500 peak 2434 spectrum 1 weight 0.10000E+01 volume 0.13910E-02 ppm1 3.765 ppm2 1.442 CV 1
OR { 2434}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 64 and name HG3 ))
ASSI { 2435}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 55 and name HG1%)
3.400 1.500 1.500 peak 2435 spectrum 1 weight 0.10000E+01 volume 0.32795E-02 ppm1 3.764 ppm2 0.808 CV 1
OR { 2435}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 55 and name HG2%)
ASSI { 2436}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 51 and name HG2%)
4.500 2.500 1.500 peak 2436 spectrum 1 weight 0.10000E+01 volume 0.94126E-03 ppm1 3.765 ppm2 0.690 CV 1
ASSI { 2437}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB ))
2.600 0.900 0.900 peak 2437 spectrum 1 weight 0.10000E+01 volume 0.28596E-02 ppm1 3.968 ppm2 2.004 CV 1
ASSI { 2440}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 63 and name H ))
2.600 0.900 0.900 peak 2440 spectrum 1 weight 0.10000E+01 volume 0.24180E-02 ppm1 4.585 ppm2 8.660 CV 1
ASSI { 2442}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 33 and name HG1%)
4.400 2.400 1.600 peak 2442 spectrum 1 weight 0.10000E+01 volume 0.86521E-03 ppm1 2.701 ppm2 0.955 CV 1
OR { 2442}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 33 and name HG2%)
ASSI { 2452}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 55 and name HG1%)
3.300 1.300 1.300 peak 2452 spectrum 1 weight 0.10000E+01 volume 0.23914E-02 ppm1 4.542 ppm2 0.812 CV 1
OR { 2452}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 55 and name HG2%)
ASSI { 2453}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HB2 ))
2.400 0.700 0.700 peak 2453 spectrum 1 weight 0.10000E+01 volume 0.95317E-02 ppm1 4.542 ppm2 2.705 CV 1
OR { 2453}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HB3 ))
ASSI { 2454}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HB3 ))
5.000 3.200 1.000 peak 2454 spectrum 1 weight 0.10000E+01 volume 0.28257E-03 ppm1 4.531 ppm2 3.763 CV 1
ASSI { 2456}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name H ))
2.800 1.000 1.000 peak 2456 spectrum 1 weight 0.10000E+01 volume 0.27188E-02 ppm1 4.544 ppm2 8.638 CV 1
ASSI { 2459}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 65 and name H ))
5.000 3.100 1.000 peak 2459 spectrum 1 weight 0.10000E+01 volume 0.31534E-03 ppm1 2.717 ppm2 7.702 CV 1
OR { 2459}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 65 and name H ))
ASSI { 2460}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 65 and name H ))
5.600 3.900 0.400 peak 2460 spectrum 1 weight 0.10000E+01 volume 0.20402E-03 ppm1 4.540 ppm2 7.713 CV 1
ASSI { 2461}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 55 and name HG1%)
4.300 2.300 1.700 peak 2461 spectrum 1 weight 0.10000E+01 volume 0.10930E-02 ppm1 4.526 ppm2 0.798 CV 1
ASSI { 2463}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 60 and name HB% )
2.300 0.600 0.600 peak 2463 spectrum 1 weight 0.10000E+01 volume 0.76302E-02 ppm1 4.530 ppm2 1.240 CV 1
ASSI { 2464}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 44 and name HG2 ))
3.500 1.500 1.500 peak 2464 spectrum 1 weight 0.10000E+01 volume 0.68451E-03 ppm1 4.530 ppm2 2.081 CV 1
ASSI { 2465}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 55 and name HB ))
4.100 2.100 1.900 peak 2465 spectrum 1 weight 0.10000E+01 volume 0.11002E-02 ppm1 4.529 ppm2 2.019 CV 1
ASSI { 2466}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 61 and name HB3 ))
4.200 2.200 1.800 peak 2466 spectrum 1 weight 0.10000E+01 volume 0.13656E-02 ppm1 4.532 ppm2 2.709 CV 1
OR { 2466}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 61 and name HB2 ))
ASSI { 2467}
( segid " " and resid 60 and name HB% )
( segid " " and resid 54 and name HD1%)
2.900 1.100 1.100 peak 2467 spectrum 1 weight 0.10000E+01 volume 0.39279E-02 ppm1 1.233 ppm2 0.426 CV 1
ASSI { 2469}
( segid " " and resid 42 and name HG2%)
( segid " " and resid 40 and name HD2%)
2.100 0.600 0.600 peak 2469 spectrum 1 weight 0.10000E+01 volume 0.11254E-01 ppm1 1.243 ppm2 0.975 CV 1
OR { 2469}
( segid " " and resid 42 and name HG2%)
( segid " " and resid 40 and name HD1%)
ASSI { 2470}
( segid " " and resid 42 and name HG2%)
( segid " " and resid 40 and name HD2%)
2.100 0.600 0.600 peak 2470 spectrum 1 weight 0.10000E+01 volume 0.11870E-01 ppm1 1.239 ppm2 0.920 CV 1
ASSI { 2472}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 13 and name HG3 ))
2.200 0.600 0.600 peak 2472 spectrum 1 weight 0.10000E+01 volume 0.59004E-02 ppm1 1.240 ppm2 2.419 CV 1
OR { 2472}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 13 and name HG2 ))
ASSI { 2473}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 45 and name HD2 ))
3.400 1.400 1.400 peak 2473 spectrum 1 weight 0.10000E+01 volume 0.27293E-02 ppm1 1.244 ppm2 2.300 CV 1
ASSI { 2475}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HE2 ))
2.700 0.900 0.900 peak 2475 spectrum 1 weight 0.10000E+01 volume 0.27505E-02 ppm1 1.233 ppm2 2.985 CV 1
OR { 2475}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HE3 ))
ASSI { 2476}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 61 and name HB3 ))
3.900 1.900 1.900 peak 2476 spectrum 1 weight 0.10000E+01 volume 0.23554E-02 ppm1 1.234 ppm2 2.708 CV 1
OR { 2476}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 61 and name HB2 ))
ASSI { 2477}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 45 and name HD3 ))
3.100 1.200 1.200 peak 2477 spectrum 1 weight 0.10000E+01 volume 0.21835E-02 ppm1 1.243 ppm2 2.834 CV 1
ASSI { 2478}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 47 and name HD3 ))
4.000 2.000 2.000 peak 2478 spectrum 1 weight 0.10000E+01 volume 0.92824E-03 ppm1 1.248 ppm2 3.199 CV 1
ASSI { 2479}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 55 and name HA ))
2.500 0.800 0.800 peak 2479 spectrum 1 weight 0.10000E+01 volume 0.45090E-02 ppm1 1.234 ppm2 3.967 CV 1
ASSI { 2480}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 54 and name HA ))
2.100 2.100 3.900 peak 2480 spectrum 1 weight 0.10000E+01 volume 0.18327E-02 ppm1 1.233 ppm2 3.705 CV 1
ASSI { 2483}
( segid " " and resid 60 and name HB% )
( segid " " and resid 66 and name HD% )
3.400 1.500 1.500 peak 2483 spectrum 1 weight 0.10000E+01 volume 0.26546E-02 ppm1 1.233 ppm2 7.291 CV 1
ASSI { 2485}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 66 and name HZ ))
2.100 0.600 0.600 peak 2485 spectrum 1 weight 0.10000E+01 volume 0.59491E-02 ppm1 1.233 ppm2 6.935 CV 1
ASSI { 2487}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name H ))
2.400 0.700 0.700 peak 2487 spectrum 1 weight 0.10000E+01 volume 0.23355E-02 ppm1 1.232 ppm2 8.041 CV 1
ASSI { 2488}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 62 and name H ))
3.100 1.200 1.200 peak 2488 spectrum 1 weight 0.10000E+01 volume 0.27391E-02 ppm1 1.234 ppm2 7.866 CV 1
ASSI { 2489}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 55 and name H ))
3.000 1.100 1.100 peak 2489 spectrum 1 weight 0.10000E+01 volume 0.20121E-02 ppm1 1.234 ppm2 7.492 CV 1
ASSI { 2491}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 43 and name H ))
2.400 0.700 0.700 peak 2491 spectrum 1 weight 0.10000E+01 volume 0.31534E-02 ppm1 1.240 ppm2 7.976 CV 1
ASSI { 2492}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 61 and name H ))
2.400 0.700 0.700 peak 2492 spectrum 1 weight 0.10000E+01 volume 0.44827E-02 ppm1 1.234 ppm2 8.638 CV 1
ASSI { 2493}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 9 and name H ))
3.300 1.400 1.400 peak 2493 spectrum 1 weight 0.10000E+01 volume 0.46400E-02 ppm1 1.249 ppm2 8.675 CV 1
ASSI { 2494}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 61 and name H ))
2.700 0.900 0.900 peak 2494 spectrum 1 weight 0.10000E+01 volume 0.28690E-02 ppm1 4.529 ppm2 8.639 CV 1
ASSI { 2495}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 62 and name H ))
5.000 3.100 1.000 peak 2495 spectrum 1 weight 0.10000E+01 volume 0.51225E-03 ppm1 4.528 ppm2 7.854 CV 1
ASSI { 2498}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 54 and name HD2%)
3.300 1.300 1.300 peak 2498 spectrum 1 weight 0.10000E+01 volume 0.65138E-03 ppm1 1.370 ppm2 0.395 CV 1
ASSI { 2499}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 54 and name HD2%)
3.500 1.500 1.500 peak 2499 spectrum 1 weight 0.10000E+01 volume 0.60037E-03 ppm1 1.267 ppm2 0.395 CV 1
ASSI { 2500}
( segid " " and resid 59 and name HD2%)
( segid " " and resid 54 and name HD2%)
1.800 1.800 4.200 peak 2500 spectrum 1 weight 0.10000E+01 volume 0.56770E-02 ppm1 0.932 ppm2 0.390 CV 1
ASSI { 2501}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 54 and name HD2%)
1.900 0.400 0.400 peak 2501 spectrum 1 weight 0.10000E+01 volume 0.10737E-01 ppm1 0.826 ppm2 0.393 CV 1
ASSI { 2502}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 59 and name HD2%)
2.100 0.600 0.600 peak 2502 spectrum 1 weight 0.10000E+01 volume 0.10485E-01 ppm1 4.200 ppm2 0.937 CV 1
ASSI { 2504}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 15 and name HB% )
2.000 0.500 0.500 peak 2504 spectrum 1 weight 0.10000E+01 volume 0.12144E-01 ppm1 4.203 ppm2 1.576 CV 1
ASSI { 2510}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 59 and name HD2%)
3.600 1.600 1.600 peak 2510 spectrum 1 weight 0.10000E+01 volume 0.19657E-02 ppm1 1.275 ppm2 0.939 CV 1
ASSI { 2512}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HB3 ))
2.100 0.600 0.600 peak 2512 spectrum 1 weight 0.10000E+01 volume 0.18739E-02 ppm1 1.269 ppm2 1.405 CV 1
ASSI { 2513}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 57 and name HB3 ))
3.600 1.600 1.600 peak 2513 spectrum 1 weight 0.10000E+01 volume 0.39187E-03 ppm1 1.262 ppm2 1.655 CV 1
ASSI { 2516}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 59 and name HB2 ))
2.300 0.700 0.700 peak 2516 spectrum 1 weight 0.10000E+01 volume 0.82269E-02 ppm1 0.824 ppm2 1.262 CV 1
ASSI { 2520}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 50 and name HB ))
2.100 0.600 0.600 peak 2520 spectrum 1 weight 0.10000E+01 volume 0.74031E-02 ppm1 0.823 ppm2 2.152 CV 1
ASSI { 2523}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HA ))
3.200 1.300 1.300 peak 2523 spectrum 1 weight 0.10000E+01 volume 0.77994E-03 ppm1 1.392 ppm2 4.209 CV 1
ASSI { 2524}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HA ))
3.600 1.700 1.700 peak 2524 spectrum 1 weight 0.10000E+01 volume 0.56139E-03 ppm1 1.267 ppm2 4.196 CV 1
ASSI { 2525}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 21 and name HE% )
4.300 2.300 1.700 peak 2525 spectrum 1 weight 0.10000E+01 volume 0.69318E-03 ppm1 4.205 ppm2 6.868 CV 1
OR { 2525}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 21 and name HD% )
ASSI { 2531}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 21 and name HD% )
3.500 1.600 1.600 peak 2531 spectrum 1 weight 0.10000E+01 volume 0.47799E-03 ppm1 1.370 ppm2 6.869 CV 1
OR { 2531}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 21 and name HE% )
ASSI { 2532}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 21 and name HE% )
4.600 2.600 1.400 peak 2532 spectrum 1 weight 0.10000E+01 volume 0.49267E-03 ppm1 1.261 ppm2 6.873 CV 1
OR { 2532}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 21 and name HD% )
ASSI { 2536}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 21 and name HD% )
2.700 0.900 0.900 peak 2536 spectrum 1 weight 0.10000E+01 volume 0.32958E-02 ppm1 0.826 ppm2 6.892 CV 1
OR { 2536}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 21 and name HE% )
ASSI { 2543}
(( segid " " and resid 58 and name HA2 ))
(( segid " " and resid 58 and name H ))
2.800 1.000 1.000 peak 2543 spectrum 1 weight 0.10000E+01 volume 0.20659E-02 ppm1 3.909 ppm2 7.912 CV 1
ASSI { 2544}
(( segid " " and resid 29 and name HA2 ))
( segid " " and resid 27 and name HG2%)
4.200 2.200 1.800 peak 2544 spectrum 1 weight 0.10000E+01 volume 0.83844E-03 ppm1 4.085 ppm2 0.911 CV 1
ASSI { 2546}
(( segid " " and resid 58 and name HA2 ))
( segid " " and resid 59 and name HD2%)
5.600 3.900 0.400 peak 2546 spectrum 1 weight 0.10000E+01 volume 0.22361E-03 ppm1 3.917 ppm2 0.926 CV 1
ASSI { 2548}
(( segid " " and resid 29 and name HA2 ))
(( segid " " and resid 28 and name HB2 ))
4.400 2.400 1.600 peak 2548 spectrum 1 weight 0.10000E+01 volume 0.85014E-03 ppm1 4.082 ppm2 1.996 CV 1
OR { 2548}
(( segid " " and resid 29 and name HA2 ))
(( segid " " and resid 28 and name HB3 ))
ASSI { 2549}
(( segid " " and resid 29 and name HA2 ))
(( segid " " and resid 30 and name HG3 ))
3.800 1.800 1.800 peak 2549 spectrum 1 weight 0.10000E+01 volume 0.90163E-03 ppm1 4.093 ppm2 2.254 CV 1
ASSI { 2550}
(( segid " " and resid 58 and name HA2 ))
(( segid " " and resid 58 and name HA3 ))
2.500 0.800 0.800 peak 2550 spectrum 1 weight 0.10000E+01 volume 0.23972E-02 ppm1 3.891 ppm2 4.050 CV 1
ASSI { 2552}
(( segid " " and resid 58 and name HA2 ))
(( segid " " and resid 60 and name H ))
4.100 2.100 1.900 peak 2552 spectrum 1 weight 0.10000E+01 volume 0.34240E-03 ppm1 3.894 ppm2 7.062 CV 1
ASSI { 2553}
(( segid " " and resid 29 and name HA2 ))
(( segid " " and resid 30 and name H ))
3.500 1.500 1.500 peak 2553 spectrum 1 weight 0.10000E+01 volume 0.89316E-03 ppm1 4.089 ppm2 7.488 CV 1
ASSI { 2555}
(( segid " " and resid 58 and name HA2 ))
(( segid " " and resid 59 and name H ))
3.900 1.900 1.900 peak 2555 spectrum 1 weight 0.10000E+01 volume 0.57122E-03 ppm1 3.915 ppm2 7.666 CV 1
ASSI { 2556}
(( segid " " and resid 29 and name HA2 ))
(( segid " " and resid 29 and name H ))
3.400 1.400 1.400 peak 2556 spectrum 1 weight 0.10000E+01 volume 0.65645E-03 ppm1 4.089 ppm2 8.847 CV 1
ASSI { 2560}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HA ))
3.000 1.100 1.100 peak 2560 spectrum 1 weight 0.10000E+01 volume 0.15189E-02 ppm1 2.161 ppm2 3.971 CV 1
ASSI { 2561}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 54 and name HA ))
4.200 2.200 1.800 peak 2561 spectrum 1 weight 0.10000E+01 volume 0.36918E-03 ppm1 2.175 ppm2 3.694 CV 1
ASSI { 2562}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 59 and name HD1%)
4.900 3.000 1.100 peak 2562 spectrum 1 weight 0.10000E+01 volume 0.91826E-03 ppm1 2.164 ppm2 0.827 CV 1
ASSI { 2563}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HB3 ))
2.200 0.600 0.600 peak 2563 spectrum 1 weight 0.10000E+01 volume 0.23612E-02 ppm1 2.158 ppm2 1.692 CV 1
ASSI { 2564}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HG2 ))
2.800 0.900 0.900 peak 2564 spectrum 1 weight 0.10000E+01 volume 0.41755E-02 ppm1 2.159 ppm2 1.986 CV 1
OR { 2564}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 57 and name HE% )
ASSI { 2565}
(( segid " " and resid 55 and name HB ))
( segid " " and resid 55 and name HG1%)
2.200 0.600 0.600 peak 2565 spectrum 1 weight 0.10000E+01 volume 0.98812E-02 ppm1 2.000 ppm2 0.804 CV 1
OR { 2565}
(( segid " " and resid 55 and name HB ))
( segid " " and resid 55 and name HG2%)
ASSI { 2567}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 54 and name HD2%)
5.300 3.500 0.700 peak 2567 spectrum 1 weight 0.10000E+01 volume 0.60760E-03 ppm1 3.967 ppm2 0.408 CV 1
ASSI { 2570}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 55 and name H ))
3.100 1.200 1.200 peak 2570 spectrum 1 weight 0.10000E+01 volume 0.27091E-02 ppm1 2.002 ppm2 7.490 CV 1
ASSI { 2574}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 12 and name H ))
4.200 2.200 1.800 peak 2574 spectrum 1 weight 0.10000E+01 volume 0.89937E-03 ppm1 1.999 ppm2 8.968 CV 1
ASSI { 2576}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name H ))
3.000 1.100 1.100 peak 2576 spectrum 1 weight 0.10000E+01 volume 0.14541E-02 ppm1 2.158 ppm2 7.864 CV 1
ASSI { 2578}
( segid " " and resid 57 and name HE% )
( segid " " and resid 54 and name HD2%)
2.600 0.900 0.900 peak 2578 spectrum 1 weight 0.10000E+01 volume 0.33247E-02 ppm1 1.986 ppm2 0.390 CV 1
ASSI { 2579}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 18 and name HB2 ))
3.000 1.100 1.100 peak 2579 spectrum 1 weight 0.10000E+01 volume 0.83030E-02 ppm1 1.986 ppm2 1.792 CV 1
ASSI { 2581}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 59 and name HG ))
2.300 0.600 0.600 peak 2581 spectrum 1 weight 0.10000E+01 volume 0.46943E-02 ppm1 1.987 ppm2 1.479 CV 1
ASSI { 2582}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 59 and name HB2 ))
3.000 1.100 1.100 peak 2582 spectrum 1 weight 0.10000E+01 volume 0.16952E-02 ppm1 1.986 ppm2 1.257 CV 1
ASSI { 2583}
( segid " " and resid 57 and name HE% )
( segid " " and resid 17 and name HD1%)
2.000 2.000 4.000 peak 2583 spectrum 1 weight 0.10000E+01 volume 0.24002E-02 ppm1 1.987 ppm2 1.056 CV 1
ASSI { 2584}
( segid " " and resid 57 and name HE% )
( segid " " and resid 59 and name HD2%)
3.200 1.300 1.300 peak 2584 spectrum 1 weight 0.10000E+01 volume 0.77943E-02 ppm1 1.987 ppm2 0.937 CV 1
ASSI { 2585}
( segid " " and resid 57 and name HE% )
( segid " " and resid 59 and name HD1%)
1.800 0.400 0.400 peak 2585 spectrum 1 weight 0.10000E+01 volume 0.16196E-01 ppm1 1.987 ppm2 0.828 CV 1
ASSI { 2587}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 53 and name HB3 ))
2.900 1.100 1.100 peak 2587 spectrum 1 weight 0.10000E+01 volume 0.17880E-02 ppm1 1.987 ppm2 2.857 CV 1
ASSI { 2588}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 18 and name HD3 ))
2.800 1.000 1.000 peak 2588 spectrum 1 weight 0.10000E+01 volume 0.36977E-02 ppm1 1.987 ppm2 3.305 CV 1
ASSI { 2589}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 59 and name HA ))
4.000 2.000 2.000 peak 2589 spectrum 1 weight 0.10000E+01 volume 0.14805E-02 ppm1 1.987 ppm2 4.202 CV 1
ASSI { 2590}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 57 and name HA ))
2.900 1.100 1.100 peak 2590 spectrum 1 weight 0.10000E+01 volume 0.54993E-02 ppm1 1.987 ppm2 3.974 CV 1
ASSI { 2591}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 18 and name HA ))
3.200 1.300 1.300 peak 2591 spectrum 1 weight 0.10000E+01 volume 0.27658E-02 ppm1 1.987 ppm2 3.796 CV 1
ASSI { 2592}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 54 and name HA ))
2.800 1.000 1.000 peak 2592 spectrum 1 weight 0.10000E+01 volume 0.18518E-02 ppm1 1.986 ppm2 3.696 CV 1
ASSI { 2593}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 53 and name HD2 ))
2.400 2.400 3.600 peak 2593 spectrum 1 weight 0.10000E+01 volume 0.98367E-03 ppm1 1.988 ppm2 5.763 CV 1
ASSI { 2595}
( segid " " and resid 57 and name HE% )
( segid " " and resid 21 and name HD% )
4.800 2.900 1.200 peak 2595 spectrum 1 weight 0.10000E+01 volume 0.76745E-03 ppm1 1.986 ppm2 6.878 CV 1
OR { 2595}
( segid " " and resid 57 and name HE% )
( segid " " and resid 21 and name HE% )
ASSI { 2596}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 17 and name H ))
2.200 2.200 3.800 peak 2596 spectrum 1 weight 0.10000E+01 volume 0.13250E-02 ppm1 1.987 ppm2 8.732 CV 1
ASSI { 2597}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 22 and name H ))
6.000 6.000 0.000 peak 2597 spectrum 1 weight 0.10000E+01 volume 0.13982E-03 ppm1 1.987 ppm2 8.549 CV 1
ASSI { 2600}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 57 and name H ))
3.500 1.600 1.600 peak 2600 spectrum 1 weight 0.10000E+01 volume 0.22724E-02 ppm1 1.986 ppm2 7.867 CV 1
ASSI { 2601}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 59 and name H ))
4.100 2.100 1.900 peak 2601 spectrum 1 weight 0.10000E+01 volume 0.79007E-03 ppm1 1.986 ppm2 7.663 CV 1
ASSI { 2602}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 55 and name HG2%)
2.900 1.100 1.100 peak 2602 spectrum 1 weight 0.10000E+01 volume 0.40825E-02 ppm1 3.820 ppm2 0.818 CV 1
OR { 2602}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 55 and name HG1%)
ASSI { 2603}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB3 ))
2.400 0.700 0.700 peak 2603 spectrum 1 weight 0.10000E+01 volume 0.61431E-02 ppm1 3.820 ppm2 1.850 CV 1
ASSI { 2604}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB2 ))
2.700 0.900 0.900 peak 2604 spectrum 1 weight 0.10000E+01 volume 0.59924E-02 ppm1 3.820 ppm2 1.714 CV 1
ASSI { 2605}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HG3 ))
2.900 1.000 1.000 peak 2605 spectrum 1 weight 0.10000E+01 volume 0.49179E-02 ppm1 3.820 ppm2 2.130 CV 1
ASSI { 2608}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 53 and name HA ))
2.200 0.600 0.600 peak 2608 spectrum 1 weight 0.10000E+01 volume 0.41714E-02 ppm1 1.716 ppm2 4.010 CV 1
ASSI { 2610}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 56 and name HG2 ))
2.300 0.700 0.700 peak 2610 spectrum 1 weight 0.10000E+01 volume 0.59966E-02 ppm1 1.847 ppm2 2.218 CV 1
ASSI { 2611}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 56 and name HG3 ))
2.700 0.900 0.900 peak 2611 spectrum 1 weight 0.10000E+01 volume 0.62037E-02 ppm1 1.846 ppm2 2.129 CV 1
ASSI { 2612}
(( segid " " and resid 111 and name HG2 ))
( segid " " and resid 102 and name HE% )
2.400 0.700 0.700 peak 2612 spectrum 1 weight 0.10000E+01 volume 0.68362E-02 ppm1 1.702 ppm2 2.130 CV 1
OR { 2612}
(( segid " " and resid 111 and name HG2 ))
(( segid " " and resid 102 and name HB2 ))
ASSI { 2614}
(( segid " " and resid 56 and name HB3 ))
( segid " " and resid 55 and name HG2%)
4.000 2.000 2.000 peak 2614 spectrum 1 weight 0.10000E+01 volume 0.22955E-02 ppm1 1.846 ppm2 0.810 CV 1
OR { 2614}
(( segid " " and resid 56 and name HB3 ))
( segid " " and resid 55 and name HG1%)
ASSI { 2615}
(( segid " " and resid 30 and name HG3 ))
( segid " " and resid 27 and name HG2%)
3.400 1.400 1.400 peak 2615 spectrum 1 weight 0.10000E+01 volume 0.40204E-02 ppm1 2.214 ppm2 0.885 CV 1
ASSI { 2616}
(( segid " " and resid 30 and name HG2 ))
( segid " " and resid 27 and name HG2%)
3.300 1.400 1.400 peak 2616 spectrum 1 weight 0.10000E+01 volume 0.34184E-02 ppm1 2.151 ppm2 0.894 CV 1
ASSI { 2618}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 56 and name HB2 ))
2.200 0.600 0.600 peak 2618 spectrum 1 weight 0.10000E+01 volume 0.61214E-02 ppm1 2.123 ppm2 1.714 CV 1
ASSI { 2619}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name HB2 ))
2.700 0.900 0.900 peak 2619 spectrum 1 weight 0.10000E+01 volume 0.68527E-02 ppm1 2.221 ppm2 1.714 CV 1
ASSI { 2626}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 52 and name HB2 ))
5.700 4.100 0.300 peak 2626 spectrum 1 weight 0.10000E+01 volume 0.30491E-03 ppm1 2.122 ppm2 3.227 CV 1
ASSI { 2627}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 35 and name HA ))
4.200 2.200 1.800 peak 2627 spectrum 1 weight 0.10000E+01 volume 0.89584E-03 ppm1 2.223 ppm2 4.150 CV 1
ASSI { 2635}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 30 and name HE21))
3.500 1.500 1.500 peak 2635 spectrum 1 weight 0.10000E+01 volume 0.20363E-02 ppm1 2.214 ppm2 7.036 CV 1
ASSI { 2642}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 30 and name HE22))
3.600 1.600 1.600 peak 2642 spectrum 1 weight 0.10000E+01 volume 0.35163E-02 ppm1 2.213 ppm2 7.754 CV 1
ASSI { 2643}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name H ))
3.400 1.400 1.400 peak 2643 spectrum 1 weight 0.10000E+01 volume 0.34947E-02 ppm1 2.222 ppm2 8.073 CV 1
ASSI { 2645}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 56 and name H ))
2.500 0.800 0.800 peak 2645 spectrum 1 weight 0.10000E+01 volume 0.29861E-02 ppm1 2.123 ppm2 8.073 CV 1
ASSI { 2647}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 55 and name H ))
5.000 3.200 1.000 peak 2647 spectrum 1 weight 0.10000E+01 volume 0.87935E-03 ppm1 1.841 ppm2 7.485 CV 1
ASSI { 2648}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 55 and name H ))
4.400 2.400 1.600 peak 2648 spectrum 1 weight 0.10000E+01 volume 0.58330E-03 ppm1 1.719 ppm2 7.492 CV 1
ASSI { 2649}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 57 and name H ))
2.900 1.000 1.000 peak 2649 spectrum 1 weight 0.10000E+01 volume 0.20565E-02 ppm1 1.715 ppm2 7.865 CV 1
ASSI { 2650}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 57 and name H ))
3.500 1.600 1.600 peak 2650 spectrum 1 weight 0.10000E+01 volume 0.20404E-02 ppm1 1.845 ppm2 7.865 CV 1
ASSI { 2652}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name H ))
2.300 0.700 0.700 peak 2652 spectrum 1 weight 0.10000E+01 volume 0.36726E-02 ppm1 1.716 ppm2 8.074 CV 1
ASSI { 2653}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 54 and name H ))
5.400 3.600 0.600 peak 2653 spectrum 1 weight 0.10000E+01 volume 0.45497E-03 ppm1 1.844 ppm2 8.289 CV 1
ASSI { 2655}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 55 and name H ))
2.300 0.700 0.700 peak 2655 spectrum 1 weight 0.10000E+01 volume 0.40937E-02 ppm1 0.819 ppm2 7.491 CV 1
ASSI { 2657}
( segid " " and resid 55 and name HG1%)
( segid " " and resid 60 and name HB% )
2.500 0.800 0.800 peak 2657 spectrum 1 weight 0.10000E+01 volume 0.43573E-02 ppm1 0.821 ppm2 1.240 CV 1
ASSI { 2661}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 61 and name HB2 ))
4.400 2.400 1.600 peak 2661 spectrum 1 weight 0.10000E+01 volume 0.73607E-03 ppm1 0.819 ppm2 2.707 CV 1
OR { 2661}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 61 and name HB3 ))
ASSI { 2662}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 51 and name HA ))
4.300 2.300 1.700 peak 2662 spectrum 1 weight 0.10000E+01 volume 0.41256E-03 ppm1 0.820 ppm2 2.994 CV 1
ASSI { 2666}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 56 and name HA ))
3.400 3.400 2.600 peak 2666 spectrum 1 weight 0.10000E+01 volume 0.34196E-02 ppm1 0.819 ppm2 3.822 CV 1
ASSI { 2668}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 62 and name HA ))
3.300 1.400 1.400 peak 2668 spectrum 1 weight 0.10000E+01 volume 0.11489E-02 ppm1 0.781 ppm2 4.570 CV 1
ASSI { 2669}
( segid " " and resid 123 and name HD1%)
(( segid " " and resid 118 and name HA ))
3.500 1.500 1.500 peak 2669 spectrum 1 weight 0.10000E+01 volume 0.25090E-02 ppm1 0.795 ppm2 3.674 CV 1
ASSI { 2671}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 54 and name H ))
4.200 2.200 1.800 peak 2671 spectrum 1 weight 0.10000E+01 volume 0.10066E-02 ppm1 0.821 ppm2 8.288 CV 1
ASSI { 2672}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 56 and name H ))
3.300 1.400 1.400 peak 2672 spectrum 1 weight 0.10000E+01 volume 0.31079E-02 ppm1 0.819 ppm2 8.072 CV 1
ASSI { 2675}
( segid " " and resid 55 and name HG1%)
( segid " " and resid 66 and name HD% )
4.200 2.200 1.800 peak 2675 spectrum 1 weight 0.10000E+01 volume 0.76042E-03 ppm1 0.821 ppm2 7.295 CV 1
ASSI { 2677}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 66 and name HZ ))
3.700 1.700 1.700 peak 2677 spectrum 1 weight 0.10000E+01 volume 0.51881E-03 ppm1 0.821 ppm2 6.945 CV 1
ASSI { 2678}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 55 and name H ))
3.200 1.300 1.300 peak 2678 spectrum 1 weight 0.10000E+01 volume 0.37015E-03 ppm1 0.740 ppm2 7.486 CV 1
ASSI { 2680}
(( segid " " and resid 118 and name HA ))
( segid " " and resid 118 and name HD1%)
2.400 0.700 0.700 peak 2680 spectrum 1 weight 0.10000E+01 volume 0.30984E-02 ppm1 3.657 ppm2 0.511 CV 1
ASSI { 2682}
(( segid " " and resid 54 and name HA ))
( segid " " and resid 54 and name HD2%)
2.200 0.600 0.600 peak 2682 spectrum 1 weight 0.10000E+01 volume 0.49224E-02 ppm1 3.677 ppm2 0.395 CV 1
ASSI { 2686}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HA ))
3.600 1.600 1.600 peak 2686 spectrum 1 weight 0.10000E+01 volume 0.53013E-03 ppm1 0.743 ppm2 3.681 CV 1
ASSI { 2687}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 54 and name HD1%)
2.800 1.000 1.000 peak 2687 spectrum 1 weight 0.10000E+01 volume 0.21923E-02 ppm1 0.740 ppm2 0.413 CV 1
OR { 2687}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 54 and name HD2%)
ASSI { 2689}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HG ))
3.200 1.300 1.300 peak 2689 spectrum 1 weight 0.10000E+01 volume 0.55114E-03 ppm1 0.750 ppm2 1.736 CV 1
ASSI { 2692}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HB3 ))
2.300 0.700 0.700 peak 2692 spectrum 1 weight 0.10000E+01 volume 0.10359E-02 ppm1 0.726 ppm2 1.935 CV 1
ASSI { 2693}
(( segid " " and resid 54 and name HG ))
( segid " " and resid 54 and name HD1%)
2.300 0.600 0.600 peak 2693 spectrum 1 weight 0.10000E+01 volume 0.44897E-02 ppm1 1.726 ppm2 0.425 CV 1
OR { 2693}
(( segid " " and resid 54 and name HG ))
( segid " " and resid 54 and name HD2%)
ASSI { 2694}
(( segid " " and resid 54 and name HG ))
(( segid " " and resid 54 and name HA ))
3.300 1.400 1.400 peak 2694 spectrum 1 weight 0.10000E+01 volume 0.10238E-02 ppm1 1.717 ppm2 3.671 CV 1
ASSI { 2695}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 33 and name HB ))
3.600 1.600 1.600 peak 2695 spectrum 1 weight 0.10000E+01 volume 0.50940E-03 ppm1 0.440 ppm2 2.304 CV 1
ASSI { 2697}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 54 and name HB3 ))
2.500 0.800 0.800 peak 2697 spectrum 1 weight 0.10000E+01 volume 0.33537E-02 ppm1 0.437 ppm2 1.938 CV 1
ASSI { 2698}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 54 and name HG ))
2.200 0.600 0.600 peak 2698 spectrum 1 weight 0.10000E+01 volume 0.53910E-02 ppm1 0.436 ppm2 1.726 CV 1
ASSI { 2703}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 51 and name HA ))
2.700 0.900 0.900 peak 2703 spectrum 1 weight 0.10000E+01 volume 0.24318E-02 ppm1 0.436 ppm2 2.982 CV 1
ASSI { 2705}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 54 and name HA ))
3.800 1.800 1.800 peak 2705 spectrum 1 weight 0.10000E+01 volume 0.17680E-02 ppm1 0.437 ppm2 3.679 CV 1
ASSI { 2711}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 17 and name HD1%)
2.400 0.700 0.700 peak 2711 spectrum 1 weight 0.10000E+01 volume 0.71502E-02 ppm1 0.383 ppm2 1.051 CV 1
ASSI { 2715}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 21 and name HB3 ))
2.900 1.000 1.000 peak 2715 spectrum 1 weight 0.10000E+01 volume 0.21490E-02 ppm1 0.382 ppm2 3.029 CV 1
OR { 2715}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 21 and name HB2 ))
ASSI { 2716}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 59 and name HA ))
5.200 3.300 0.800 peak 2716 spectrum 1 weight 0.10000E+01 volume 0.44028E-03 ppm1 0.382 ppm2 4.202 CV 1
ASSI { 2719}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 57 and name H ))
4.600 2.700 1.400 peak 2719 spectrum 1 weight 0.10000E+01 volume 0.56354E-03 ppm1 0.381 ppm2 7.864 CV 1
ASSI { 2720}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 21 and name H ))
4.300 2.300 1.700 peak 2720 spectrum 1 weight 0.10000E+01 volume 0.58393E-03 ppm1 0.381 ppm2 8.935 CV 1
ASSI { 2721}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 17 and name H ))
2.900 2.900 3.100 peak 2721 spectrum 1 weight 0.10000E+01 volume 0.27884E-03 ppm1 0.388 ppm2 8.776 CV 1
ASSI { 2722}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 22 and name H ))
5.300 3.400 0.700 peak 2722 spectrum 1 weight 0.10000E+01 volume 0.36965E-03 ppm1 0.383 ppm2 8.554 CV 1
ASSI { 2723}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 54 and name H ))
3.500 1.600 1.600 peak 2723 spectrum 1 weight 0.10000E+01 volume 0.21093E-02 ppm1 0.382 ppm2 8.296 CV 1
ASSI { 2725}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 59 and name H ))
5.000 3.200 1.000 peak 2725 spectrum 1 weight 0.10000E+01 volume 0.51797E-03 ppm1 0.383 ppm2 7.666 CV 1
ASSI { 2729}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 54 and name H ))
3.600 1.600 1.600 peak 2729 spectrum 1 weight 0.10000E+01 volume 0.23673E-02 ppm1 0.437 ppm2 8.294 CV 1
ASSI { 2738}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 66 and name HZ ))
3.300 1.400 1.400 peak 2738 spectrum 1 weight 0.10000E+01 volume 0.42792E-03 ppm1 0.731 ppm2 6.928 CV 1
ASSI { 2743}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 59 and name H ))
4.400 2.400 1.600 peak 2743 spectrum 1 weight 0.10000E+01 volume 0.28327E-03 ppm1 3.680 ppm2 7.670 CV 1
ASSI { 2748}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 55 and name HG2%)
2.500 0.800 0.800 peak 2748 spectrum 1 weight 0.10000E+01 volume 0.53359E-02 ppm1 4.020 ppm2 0.794 CV 1
OR { 2748}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 55 and name HG1%)
ASSI { 2749}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 51 and name HG2%)
2.900 1.100 1.100 peak 2749 spectrum 1 weight 0.10000E+01 volume 0.24812E-02 ppm1 4.019 ppm2 0.674 CV 1
ASSI { 2751}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB2 ))
2.600 0.900 0.900 peak 2751 spectrum 1 weight 0.10000E+01 volume 0.41494E-02 ppm1 4.021 ppm2 3.236 CV 1
ASSI { 2752}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB3 ))
2.400 0.700 0.700 peak 2752 spectrum 1 weight 0.10000E+01 volume 0.38498E-02 ppm1 4.021 ppm2 3.164 CV 1
ASSI { 2758}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 13 and name HB3 ))
3.300 1.400 1.400 peak 2758 spectrum 1 weight 0.10000E+01 volume 0.77736E-03 ppm1 2.885 ppm2 2.397 CV 1
OR { 2758}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 13 and name HB3 ))
OR { 2758}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 13 and name HB2 ))
OR { 2758}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 13 and name HG2 ))
OR { 2758}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 13 and name HG3 ))
OR { 2758}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 13 and name HB2 ))
ASSI { 2761}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 50 and name HA ))
5.400 3.600 0.600 peak 2761 spectrum 1 weight 0.10000E+01 volume 0.30022E-03 ppm1 2.885 ppm2 3.781 CV 1
ASSI { 2765}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 53 and name HD2 ))
4.000 2.000 2.000 peak 2765 spectrum 1 weight 0.10000E+01 volume 0.33133E-03 ppm1 2.208 ppm2 5.760 CV 1
ASSI { 2768}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 54 and name H ))
4.400 2.400 1.600 peak 2768 spectrum 1 weight 0.10000E+01 volume 0.43904E-03 ppm1 2.895 ppm2 8.290 CV 1
ASSI { 2771}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HD2 ))
3.100 1.200 1.200 peak 2771 spectrum 1 weight 0.10000E+01 volume 0.13165E-02 ppm1 4.018 ppm2 7.066 CV 1
ASSI { 2773}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 55 and name H ))
3.100 1.200 1.200 peak 2773 spectrum 1 weight 0.10000E+01 volume 0.14072E-02 ppm1 4.019 ppm2 7.490 CV 1
ASSI { 2777}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 13 and name H ))
5.200 3.400 0.800 peak 2777 spectrum 1 weight 0.10000E+01 volume 0.37751E-03 ppm1 7.070 ppm2 8.033 CV 1
ASSI { 2778}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HB2 ))
2.900 1.000 1.000 peak 2778 spectrum 1 weight 0.10000E+01 volume 0.15395E-02 ppm1 7.070 ppm2 3.236 CV 1
ASSI { 2779}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HB3 ))
3.400 1.400 1.400 peak 2779 spectrum 1 weight 0.10000E+01 volume 0.15049E-02 ppm1 7.070 ppm2 3.160 CV 1
ASSI { 2781}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 9 and name HB2 ))
3.000 1.100 1.100 peak 2781 spectrum 1 weight 0.10000E+01 volume 0.15660E-02 ppm1 7.072 ppm2 2.883 CV 1
OR { 2781}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 9 and name HB3 ))
ASSI { 2783}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 13 and name HG3 ))
2.500 0.800 0.800 peak 2783 spectrum 1 weight 0.10000E+01 volume 0.21190E-02 ppm1 7.071 ppm2 2.400 CV 1
OR { 2783}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 13 and name HB3 ))
OR { 2783}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 13 and name HG2 ))
OR { 2783}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 13 and name HB2 ))
ASSI { 2787}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 48 and name HB2 ))
3.300 1.400 1.400 peak 2787 spectrum 1 weight 0.10000E+01 volume 0.16563E-02 ppm1 7.071 ppm2 1.701 CV 1
OR { 2787}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 48 and name HD2 ))
ASSI { 2789}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 48 and name HG2 ))
3.300 1.400 1.400 peak 2789 spectrum 1 weight 0.10000E+01 volume 0.11895E-02 ppm1 7.070 ppm2 1.339 CV 1
ASSI { 2790}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 63 and name HG2%)
3.500 1.500 1.500 peak 2790 spectrum 1 weight 0.10000E+01 volume 0.37169E-02 ppm1 7.070 ppm2 0.949 CV 1
OR { 2790}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 63 and name HG1%)
ASSI { 2792}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 51 and name HG2%)
2.700 0.900 0.900 peak 2792 spectrum 1 weight 0.10000E+01 volume 0.20864E-02 ppm1 7.070 ppm2 0.673 CV 1
ASSI { 2793}
(( segid " " and resid 52 and name HE1 ))
( segid " " and resid 63 and name HG1%)
4.200 2.200 1.800 peak 2793 spectrum 1 weight 0.10000E+01 volume 0.81103E-03 ppm1 7.824 ppm2 0.949 CV 1
OR { 2793}
(( segid " " and resid 52 and name HE1 ))
( segid " " and resid 63 and name HG2%)
ASSI { 2796}
(( segid " " and resid 52 and name HE1 ))
(( segid " " and resid 48 and name HE3 ))
3.800 1.800 1.800 peak 2796 spectrum 1 weight 0.10000E+01 volume 0.41225E-03 ppm1 7.827 ppm2 2.973 CV 1
ASSI { 2797}
(( segid " " and resid 52 and name HE1 ))
( segid " " and resid 55 and name HG2%)
4.800 2.800 1.200 peak 2797 spectrum 1 weight 0.10000E+01 volume 0.27371E-03 ppm1 7.824 ppm2 0.804 CV 1
OR { 2797}
(( segid " " and resid 52 and name HE1 ))
( segid " " and resid 55 and name HG1%)
ASSI { 2798}
(( segid " " and resid 52 and name HE1 ))
(( segid " " and resid 48 and name HG3 ))
4.800 2.900 1.200 peak 2798 spectrum 1 weight 0.10000E+01 volume 0.24530E-03 ppm1 7.825 ppm2 1.512 CV 1
ASSI { 2800}
(( segid " " and resid 52 and name HE1 ))
(( segid " " and resid 56 and name HG3 ))
5.400 3.700 0.600 peak 2800 spectrum 1 weight 0.10000E+01 volume 0.28120E-03 ppm1 7.827 ppm2 2.127 CV 1
ASSI { 2805}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 56 and name HB3 ))
4.300 2.300 1.700 peak 2805 spectrum 1 weight 0.10000E+01 volume 0.90348E-03 ppm1 3.220 ppm2 1.856 CV 1
ASSI { 2812}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HG13))
2.700 0.900 0.900 peak 2812 spectrum 1 weight 0.10000E+01 volume 0.10593E-02 ppm1 2.979 ppm2 0.092 CV 1
ASSI { 2817}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB ))
3.200 1.300 1.300 peak 2817 spectrum 1 weight 0.10000E+01 volume 0.12070E-02 ppm1 2.980 ppm2 1.634 CV 1
ASSI { 2818}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HG12))
3.900 1.900 1.900 peak 2818 spectrum 1 weight 0.10000E+01 volume 0.12081E-02 ppm1 2.979 ppm2 1.507 CV 1
ASSI { 2819}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 54 and name HB3 ))
4.500 2.500 1.500 peak 2819 spectrum 1 weight 0.10000E+01 volume 0.59737E-03 ppm1 2.973 ppm2 1.963 CV 1
ASSI { 2821}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 51 and name HG13))
3.400 1.500 1.500 peak 2821 spectrum 1 weight 0.10000E+01 volume 0.72807E-03 ppm1 1.626 ppm2 0.090 CV 1
ASSI { 2822}
(( segid " " and resid 51 and name HB ))
( segid " " and resid 54 and name HD1%)
5.300 3.500 0.700 peak 2822 spectrum 1 weight 0.10000E+01 volume 0.30443E-03 ppm1 1.622 ppm2 0.435 CV 1
ASSI { 2827}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 48 and name HA ))
3.000 1.100 1.100 peak 2827 spectrum 1 weight 0.10000E+01 volume 0.78763E-03 ppm1 1.623 ppm2 3.887 CV 1
ASSI { 2828}
(( segid " " and resid 51 and name HG12))
(( segid " " and resid 51 and name HG13))
2.400 0.700 0.700 peak 2828 spectrum 1 weight 0.10000E+01 volume 0.82386E-03 ppm1 1.499 ppm2 0.095 CV 1
ASSI { 2832}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 92 and name HD2 ))
3.100 1.200 1.200 peak 2832 spectrum 1 weight 0.10000E+01 volume 0.11010E-02 ppm1 1.475 ppm2 2.906 CV 1
ASSI { 2833}
(( segid " " and resid 90 and name HB3 ))
(( segid " " and resid 90 and name HA ))
2.900 1.100 1.100 peak 2833 spectrum 1 weight 0.10000E+01 volume 0.20029E-02 ppm1 1.474 ppm2 3.745 CV 1
ASSI { 2834}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 51 and name HG13))
2.700 0.900 0.900 peak 2834 spectrum 1 weight 0.10000E+01 volume 0.34000E-02 ppm1 0.660 ppm2 0.094 CV 1
ASSI { 2835}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 51 and name HG13))
2.200 0.600 0.600 peak 2835 spectrum 1 weight 0.10000E+01 volume 0.51528E-02 ppm1 0.763 ppm2 0.094 CV 1
ASSI { 2836}
( segid " " and resid 51 and name HD1%)
( segid " " and resid 54 and name HD1%)
3.700 1.700 1.700 peak 2836 spectrum 1 weight 0.10000E+01 volume 0.20643E-02 ppm1 0.763 ppm2 0.441 CV 1
ASSI { 2838}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 67 and name HG2 ))
3.700 1.700 1.700 peak 2838 spectrum 1 weight 0.10000E+01 volume 0.83103E-03 ppm1 0.660 ppm2 2.390 CV 1
OR { 2838}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 67 and name HG3 ))
ASSI { 2839}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 63 and name HB ))
2.900 1.100 1.100 peak 2839 spectrum 1 weight 0.10000E+01 volume 0.36198E-02 ppm1 0.659 ppm2 2.210 CV 1
ASSI { 2840}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 55 and name HB ))
3.800 1.800 1.800 peak 2840 spectrum 1 weight 0.10000E+01 volume 0.15319E-02 ppm1 0.660 ppm2 1.981 CV 1
ASSI { 2842}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 51 and name HB ))
2.100 0.500 0.500 peak 2842 spectrum 1 weight 0.10000E+01 volume 0.74942E-02 ppm1 0.660 ppm2 1.626 CV 1
ASSI { 2843}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 51 and name HG12))
2.200 0.600 0.600 peak 2843 spectrum 1 weight 0.10000E+01 volume 0.56332E-02 ppm1 0.659 ppm2 1.516 CV 1
ASSI { 2845}
( segid " " and resid 51 and name HG2%)
( segid " " and resid 60 and name HB% )
3.900 1.900 1.900 peak 2845 spectrum 1 weight 0.10000E+01 volume 0.17929E-02 ppm1 0.660 ppm2 1.253 CV 1
ASSI { 2848}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 52 and name HB2 ))
3.900 1.900 1.900 peak 2848 spectrum 1 weight 0.10000E+01 volume 0.12032E-02 ppm1 0.660 ppm2 3.238 CV 1
ASSI { 2849}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 52 and name HB3 ))
4.200 2.200 1.800 peak 2849 spectrum 1 weight 0.10000E+01 volume 0.10868E-02 ppm1 0.659 ppm2 3.174 CV 1
ASSI { 2850}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 51 and name HA ))
2.500 0.800 0.800 peak 2850 spectrum 1 weight 0.10000E+01 volume 0.51346E-02 ppm1 0.660 ppm2 2.974 CV 1
ASSI { 2851}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 63 and name HA ))
2.200 0.600 0.600 peak 2851 spectrum 1 weight 0.10000E+01 volume 0.51575E-02 ppm1 0.660 ppm2 3.959 CV 1
ASSI { 2854}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 66 and name HA ))
5.500 3.700 0.500 peak 2854 spectrum 1 weight 0.10000E+01 volume 0.28978E-03 ppm1 0.767 ppm2 4.582 CV 1
ASSI { 2855}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 48 and name HA ))
2.600 0.900 0.900 peak 2855 spectrum 1 weight 0.10000E+01 volume 0.34596E-02 ppm1 0.764 ppm2 3.889 CV 1
ASSI { 2856}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 47 and name HA ))
3.800 1.800 1.800 peak 2856 spectrum 1 weight 0.10000E+01 volume 0.11463E-02 ppm1 0.765 ppm2 3.739 CV 1
ASSI { 2857}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 33 and name HA ))
4.800 2.800 1.200 peak 2857 spectrum 1 weight 0.10000E+01 volume 0.49426E-03 ppm1 0.765 ppm2 3.588 CV 1
ASSI { 2858}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 66 and name HB3 ))
3.500 1.500 1.500 peak 2858 spectrum 1 weight 0.10000E+01 volume 0.21202E-02 ppm1 0.764 ppm2 3.360 CV 1
ASSI { 2860}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 51 and name HA ))
2.800 1.000 1.000 peak 2860 spectrum 1 weight 0.10000E+01 volume 0.37497E-02 ppm1 0.764 ppm2 2.967 CV 1
ASSI { 2861}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 33 and name HB ))
3.900 1.900 1.900 peak 2861 spectrum 1 weight 0.10000E+01 volume 0.11398E-02 ppm1 0.762 ppm2 2.362 CV 1
ASSI { 2864}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 51 and name HB ))
2.200 0.600 0.600 peak 2864 spectrum 1 weight 0.10000E+01 volume 0.73428E-02 ppm1 0.764 ppm2 1.631 CV 1
ASSI { 2865}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 51 and name HG12))
2.100 0.500 0.500 peak 2865 spectrum 1 weight 0.10000E+01 volume 0.81998E-02 ppm1 0.764 ppm2 1.495 CV 1
ASSI { 2866}
( segid " " and resid 51 and name HD1%)
( segid " " and resid 32 and name HG1%)
3.300 3.300 2.700 peak 2866 spectrum 1 weight 0.10000E+01 volume 0.21675E-02 ppm1 0.764 ppm2 1.334 CV 1
ASSI { 2867}
( segid " " and resid 51 and name HD1%)
( segid " " and resid 33 and name HG2%)
2.000 0.500 0.500 peak 2867 spectrum 1 weight 0.10000E+01 volume 0.14798E-01 ppm1 0.767 ppm2 0.943 CV 1
OR { 2867}
( segid " " and resid 51 and name HD1%)
( segid " " and resid 33 and name HG1%)
ASSI { 2876}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 56 and name HE21))
4.700 2.700 1.300 peak 2876 spectrum 1 weight 0.10000E+01 volume 0.74447E-03 ppm1 0.660 ppm2 7.397 CV 1
ASSI { 2881}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 63 and name H ))
4.400 2.400 1.600 peak 2881 spectrum 1 weight 0.10000E+01 volume 0.56494E-03 ppm1 0.657 ppm2 8.663 CV 1
ASSI { 2882}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 51 and name H ))
2.300 0.700 0.700 peak 2882 spectrum 1 weight 0.10000E+01 volume 0.49028E-02 ppm1 0.764 ppm2 8.214 CV 1
ASSI { 2884}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 67 and name H ))
5.500 3.700 0.500 peak 2884 spectrum 1 weight 0.10000E+01 volume 0.35805E-03 ppm1 0.761 ppm2 7.781 CV 1
ASSI { 2886}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 66 and name H ))
5.100 3.200 0.900 peak 2886 spectrum 1 weight 0.10000E+01 volume 0.59231E-03 ppm1 0.763 ppm2 7.513 CV 1
ASSI { 2887}
( segid " " and resid 51 and name HD1%)
( segid " " and resid 66 and name HD% )
3.700 1.700 1.700 peak 2887 spectrum 1 weight 0.10000E+01 volume 0.20080E-02 ppm1 0.764 ppm2 7.292 CV 1
ASSI { 2889}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 67 and name HE22))
4.000 2.000 2.000 peak 2889 spectrum 1 weight 0.10000E+01 volume 0.50922E-03 ppm1 0.764 ppm2 6.933 CV 1
ASSI { 2890}
(( segid " " and resid 51 and name HG13))
( segid " " and resid 54 and name HD1%)
4.500 2.600 1.500 peak 2890 spectrum 1 weight 0.10000E+01 volume 0.34503E-03 ppm1 0.095 ppm2 0.437 CV 1
ASSI { 2893}
(( segid " " and resid 51 and name HG13))
( segid " " and resid 33 and name HG2%)
2.800 1.000 1.000 peak 2893 spectrum 1 weight 0.10000E+01 volume 0.12922E-02 ppm1 0.087 ppm2 0.942 CV 1
OR { 2893}
(( segid " " and resid 51 and name HG13))
( segid " " and resid 33 and name HG1%)
ASSI { 2898}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 54 and name HD1%)
4.300 2.300 1.700 peak 2898 spectrum 1 weight 0.10000E+01 volume 0.48593E-03 ppm1 3.781 ppm2 0.413 CV 1
OR { 2898}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 54 and name HD2%)
ASSI { 2899}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 9 and name HZ2 ))
3.500 1.500 1.500 peak 2899 spectrum 1 weight 0.10000E+01 volume 0.99216E-03 ppm1 3.785 ppm2 6.916 CV 1
ASSI { 2900}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 9 and name HH2 ))
4.400 2.500 1.600 peak 2900 spectrum 1 weight 0.10000E+01 volume 0.65552E-03 ppm1 3.787 ppm2 6.717 CV 1
ASSI { 2902}
(( segid " " and resid 50 and name HB ))
( segid " " and resid 54 and name HD1%)
4.700 2.800 1.300 peak 2902 spectrum 1 weight 0.10000E+01 volume 0.34158E-03 ppm1 2.180 ppm2 0.447 CV 1
ASSI { 2903}
(( segid " " and resid 50 and name HB ))
( segid " " and resid 50 and name HG2%)
2.100 0.600 0.600 peak 2903 spectrum 1 weight 0.10000E+01 volume 0.67429E-02 ppm1 2.184 ppm2 0.918 CV 1
OR { 2903}
(( segid " " and resid 50 and name HB ))
( segid " " and resid 50 and name HD1%)
ASSI { 2904}
(( segid " " and resid 127 and name HG3 ))
( segid " " and resid 124 and name HG1%)
5.600 4.000 0.400 peak 2904 spectrum 1 weight 0.10000E+01 volume 0.30219E-03 ppm1 1.548 ppm2 0.525 CV 1
ASSI { 2905}
(( segid " " and resid 127 and name HG3 ))
( segid " " and resid 119 and name HD1%)
3.000 1.100 1.100 peak 2905 spectrum 1 weight 0.10000E+01 volume 0.14926E-02 ppm1 1.555 ppm2 0.668 CV 1
ASSI { 2908}
(( segid " " and resid 103 and name HD3 ))
(( segid " " and resid 103 and name HB3 ))
2.200 0.600 0.600 peak 2908 spectrum 1 weight 0.10000E+01 volume 0.13895E-01 ppm1 1.558 ppm2 1.793 CV 1
OR { 2908}
(( segid " " and resid 103 and name HD3 ))
(( segid " " and resid 103 and name HB2 ))
OR { 2908}
(( segid " " and resid 103 and name HD2 ))
(( segid " " and resid 103 and name HB3 ))
OR { 2908}
(( segid " " and resid 103 and name HD2 ))
(( segid " " and resid 103 and name HB2 ))
ASSI { 2911}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 51 and name HG13))
4.100 2.100 1.900 peak 2911 spectrum 1 weight 0.10000E+01 volume 0.87206E-03 ppm1 0.918 ppm2 0.101 CV 1
ASSI { 2912}
( segid " " and resid 50 and name HG2%)
( segid " " and resid 54 and name HD1%)
2.100 0.600 0.600 peak 2912 spectrum 1 weight 0.10000E+01 volume 0.79476E-02 ppm1 0.914 ppm2 0.432 CV 1
ASSI { 2916}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 51 and name HA ))
2.900 1.100 1.100 peak 2916 spectrum 1 weight 0.10000E+01 volume 0.17318E-02 ppm1 0.916 ppm2 2.977 CV 1
ASSI { 2918}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 33 and name HA ))
3.000 1.200 1.200 peak 2918 spectrum 1 weight 0.10000E+01 volume 0.21001E-02 ppm1 0.916 ppm2 3.591 CV 1
ASSI { 2919}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 9 and name HE1 ))
2.700 2.700 3.300 peak 2919 spectrum 1 weight 0.10000E+01 volume 0.40962E-03 ppm1 0.890 ppm2 0.099 CV 1
ASSI { 2920}
( segid " " and resid 50 and name HD1%)
( segid " " and resid 54 and name HD1%)
2.100 2.100 3.900 peak 2920 spectrum 1 weight 0.10000E+01 volume 0.17841E-02 ppm1 0.892 ppm2 0.421 CV 1
OR { 2920}
( segid " " and resid 50 and name HD1%)
( segid " " and resid 54 and name HD2%)
ASSI { 2924}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 37 and name HB3 ))
2.500 0.800 0.800 peak 2924 spectrum 1 weight 0.10000E+01 volume 0.35460E-02 ppm1 0.890 ppm2 1.879 CV 1
ASSI { 2927}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 45 and name HG3 ))
2.400 0.700 0.700 peak 2927 spectrum 1 weight 0.10000E+01 volume 0.30833E-02 ppm1 0.890 ppm2 1.394 CV 1
ASSI { 2931}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 37 and name HA ))
3.000 1.200 1.200 peak 2931 spectrum 1 weight 0.10000E+01 volume 0.24939E-02 ppm1 0.890 ppm2 3.938 CV 1
ASSI { 2932}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 50 and name HA ))
2.600 0.800 0.800 peak 2932 spectrum 1 weight 0.10000E+01 volume 0.53569E-02 ppm1 0.890 ppm2 3.772 CV 1
ASSI { 2934}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 49 and name HA ))
3.100 1.200 1.200 peak 2934 spectrum 1 weight 0.10000E+01 volume 0.20339E-03 ppm1 0.887 ppm2 4.207 CV 1
ASSI { 2935}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 45 and name HE ))
3.500 1.500 1.500 peak 2935 spectrum 1 weight 0.10000E+01 volume 0.46748E-03 ppm1 0.892 ppm2 7.094 CV 1
ASSI { 2936}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 9 and name HZ2 ))
3.000 1.100 1.100 peak 2936 spectrum 1 weight 0.10000E+01 volume 0.21297E-02 ppm1 0.890 ppm2 6.914 CV 1
ASSI { 2937}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 9 and name HH2 ))
3.000 1.100 1.100 peak 2937 spectrum 1 weight 0.10000E+01 volume 0.28741E-02 ppm1 0.891 ppm2 6.717 CV 1
ASSI { 2940}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 40 and name H ))
2.900 2.900 3.100 peak 2940 spectrum 1 weight 0.10000E+01 volume 0.27558E-03 ppm1 0.888 ppm2 7.866 CV 1
ASSI { 2943}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 37 and name H ))
2.400 2.400 3.600 peak 2943 spectrum 1 weight 0.10000E+01 volume 0.92296E-03 ppm1 0.891 ppm2 8.584 CV 1
ASSI { 2946}
(( segid " " and resid 50 and name HB ))
(( segid " " and resid 49 and name H ))
4.100 2.100 1.900 peak 2946 spectrum 1 weight 0.10000E+01 volume 0.57310E-03 ppm1 2.180 ppm2 7.713 CV 1
ASSI { 2955}
( segid " " and resid 50 and name HG2%)
( segid " " and resid 66 and name HD% )
4.700 2.800 1.300 peak 2955 spectrum 1 weight 0.10000E+01 volume 0.63736E-03 ppm1 0.920 ppm2 7.285 CV 1
ASSI { 2960}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 21 and name H ))
5.400 3.600 0.600 peak 2960 spectrum 1 weight 0.10000E+01 volume 0.25956E-03 ppm1 0.913 ppm2 8.934 CV 1
ASSI { 2961}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 9 and name HH2 ))
5.400 3.600 0.600 peak 2961 spectrum 1 weight 0.10000E+01 volume 0.83661E-03 ppm1 0.914 ppm2 6.723 CV 1
ASSI { 2962}
(( segid " " and resid 82 and name HA ))
( segid " " and resid 82 and name HD2%)
2.300 0.700 0.700 peak 2962 spectrum 1 weight 0.10000E+01 volume 0.75078E-02 ppm1 4.219 ppm2 0.955 CV 1
ASSI { 2963}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 48 and name HG2 ))
3.300 1.400 1.400 peak 2963 spectrum 1 weight 0.10000E+01 volume 0.80088E-03 ppm1 4.213 ppm2 1.335 CV 1
ASSI { 2964}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HB3 ))
3.000 1.100 1.100 peak 2964 spectrum 1 weight 0.10000E+01 volume 0.32256E-02 ppm1 4.216 ppm2 1.703 CV 1
ASSI { 2965}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HG2 ))
2.900 1.100 1.100 peak 2965 spectrum 1 weight 0.10000E+01 volume 0.29409E-02 ppm1 4.216 ppm2 2.563 CV 1
ASSI { 2966}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 52 and name HB2 ))
2.900 1.000 1.000 peak 2966 spectrum 1 weight 0.10000E+01 volume 0.11426E-02 ppm1 4.214 ppm2 3.232 CV 1
ASSI { 2967}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 52 and name HB3 ))
4.000 2.000 2.000 peak 2967 spectrum 1 weight 0.10000E+01 volume 0.12320E-02 ppm1 4.213 ppm2 3.161 CV 1
ASSI { 2971}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HA ))
3.000 1.100 1.100 peak 2971 spectrum 1 weight 0.10000E+01 volume 0.19306E-02 ppm1 2.206 ppm2 4.186 CV 1
OR { 2971}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HA ))
ASSI { 2972}
(( segid " " and resid 49 and name HG2 ))
( segid " " and resid 46 and name HG2%)
4.100 2.100 1.900 peak 2972 spectrum 1 weight 0.10000E+01 volume 0.37690E-03 ppm1 2.557 ppm2 1.209 CV 1
ASSI { 2973}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 45 and name HG3 ))
4.400 2.400 1.600 peak 2973 spectrum 1 weight 0.10000E+01 volume 0.44520E-03 ppm1 2.567 ppm2 1.338 CV 1
ASSI { 2974}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 45 and name HB3 ))
3.600 1.600 1.600 peak 2974 spectrum 1 weight 0.10000E+01 volume 0.53411E-03 ppm1 2.550 ppm2 1.702 CV 1
OR { 2974}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 45 and name HB2 ))
ASSI { 2980}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 16 and name HD2 ))
3.100 1.200 1.200 peak 2980 spectrum 1 weight 0.10000E+01 volume 0.66393E-03 ppm1 2.225 ppm2 7.296 CV 1
ASSI { 2983}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 20 and name H ))
2.500 0.800 0.800 peak 2983 spectrum 1 weight 0.10000E+01 volume 0.18922E-02 ppm1 2.233 ppm2 8.666 CV 1
ASSI { 2984}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 21 and name H ))
4.500 2.500 1.500 peak 2984 spectrum 1 weight 0.10000E+01 volume 0.45255E-03 ppm1 2.231 ppm2 8.930 CV 1
ASSI { 2991}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HB2 ))
2.300 0.700 0.700 peak 2991 spectrum 1 weight 0.10000E+01 volume 0.56142E-02 ppm1 3.885 ppm2 1.710 CV 1
OR { 2991}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HD3 ))
ASSI { 2994}
(( segid " " and resid 69 and name HB2 ))
( segid " " and resid 63 and name HG1%)
2.800 1.000 1.000 peak 2994 spectrum 1 weight 0.10000E+01 volume 0.21324E-02 ppm1 1.876 ppm2 0.945 CV 1
OR { 2994}
(( segid " " and resid 69 and name HB2 ))
( segid " " and resid 63 and name HG2%)
OR { 2994}
(( segid " " and resid 69 and name HB3 ))
( segid " " and resid 63 and name HG1%)
ASSI { 2996}
(( segid " " and resid 69 and name HB3 ))
( segid " " and resid 71 and name HG2%)
3.700 1.700 1.700 peak 2996 spectrum 1 weight 0.10000E+01 volume 0.92532E-03 ppm1 1.874 ppm2 1.180 CV 1
OR { 2996}
(( segid " " and resid 69 and name HB2 ))
( segid " " and resid 71 and name HG2%)
ASSI { 2997}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HG2 ))
2.400 0.700 0.700 peak 2997 spectrum 1 weight 0.10000E+01 volume 0.38525E-02 ppm1 1.873 ppm2 1.338 CV 1
ASSI { 3000}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HA ))
2.900 1.000 1.000 peak 3000 spectrum 1 weight 0.10000E+01 volume 0.35815E-02 ppm1 1.873 ppm2 3.887 CV 1
ASSI { 3002}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 48 and name HA ))
3.100 1.200 1.200 peak 3002 spectrum 1 weight 0.10000E+01 volume 0.23651E-02 ppm1 1.336 ppm2 3.887 CV 1
ASSI { 3003}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 48 and name HE3 ))
2.300 0.700 0.700 peak 3003 spectrum 1 weight 0.10000E+01 volume 0.60511E-02 ppm1 1.338 ppm2 2.971 CV 1
OR { 3003}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 48 and name HE2 ))
ASSI { 3005}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 48 and name HD2 ))
2.100 0.500 0.500 peak 3005 spectrum 1 weight 0.10000E+01 volume 0.21933E-01 ppm1 1.338 ppm2 1.701 CV 1
OR { 3005}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 48 and name HD3 ))
OR { 3005}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 48 and name HB2 ))
ASSI { 3008}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 49 and name HG2 ))
4.200 2.200 1.800 peak 3008 spectrum 1 weight 0.10000E+01 volume 0.37098E-03 ppm1 1.331 ppm2 2.560 CV 1
ASSI { 3009}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HG2 ))
2.900 1.000 1.000 peak 3009 spectrum 1 weight 0.10000E+01 volume 0.41202E-02 ppm1 1.726 ppm2 1.340 CV 1
ASSI { 3010}
(( segid " " and resid 48 and name HG2 ))
( segid " " and resid 51 and name HG2%)
4.300 2.400 1.700 peak 3010 spectrum 1 weight 0.10000E+01 volume 0.74611E-03 ppm1 1.342 ppm2 0.675 CV 1
ASSI { 3012}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 52 and name HB2 ))
3.500 1.500 1.500 peak 3012 spectrum 1 weight 0.10000E+01 volume 0.46655E-03 ppm1 1.337 ppm2 3.235 CV 1
ASSI { 3015}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 52 and name HE1 ))
4.600 2.600 1.400 peak 3015 spectrum 1 weight 0.10000E+01 volume 0.42940E-03 ppm1 1.334 ppm2 7.826 CV 1
ASSI { 3017}
(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 48 and name H ))
3.900 1.900 1.900 peak 3017 spectrum 1 weight 0.10000E+01 volume 0.11303E-02 ppm1 1.338 ppm2 8.328 CV 1
ASSI { 3029}
(( segid " " and resid 127 and name HG2 ))
( segid " " and resid 119 and name HD1%)
2.600 0.900 0.900 peak 3029 spectrum 1 weight 0.10000E+01 volume 0.15228E-02 ppm1 1.749 ppm2 0.664 CV 1
ASSI { 3037}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 47 and name H ))
3.300 1.400 1.400 peak 3037 spectrum 1 weight 0.10000E+01 volume 0.15431E-02 ppm1 1.218 ppm2 9.006 CV 1
ASSI { 3039}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 46 and name HG2%)
3.100 1.200 1.200 peak 3039 spectrum 1 weight 0.10000E+01 volume 0.36217E-02 ppm1 4.598 ppm2 1.214 CV 1
ASSI { 3042}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 47 and name HA ))
5.600 3.900 0.400 peak 3042 spectrum 1 weight 0.10000E+01 volume 0.84903E-04 ppm1 4.596 ppm2 3.732 CV 1
ASSI { 3043}
(( segid " " and resid 46 and name HB ))
( segid " " and resid 46 and name HG2%)
2.600 0.900 0.900 peak 3043 spectrum 1 weight 0.10000E+01 volume 0.39382E-02 ppm1 4.712 ppm2 1.221 CV 1
ASSI { 3047}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 49 and name HB2 ))
3.300 1.400 1.400 peak 3047 spectrum 1 weight 0.10000E+01 volume 0.17873E-02 ppm1 1.222 ppm2 2.213 CV 1
OR { 3047}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 49 and name HB3 ))
ASSI { 3058}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 80 and name HE22))
5.100 3.300 0.900 peak 3058 spectrum 1 weight 0.10000E+01 volume 0.47542E-03 ppm1 1.225 ppm2 6.602 CV 1
ASSI { 3059}
(( segid " " and resid 45 and name HD2 ))
( segid " " and resid 43 and name HG2%)
3.100 1.200 1.200 peak 3059 spectrum 1 weight 0.10000E+01 volume 0.10157E-02 ppm1 2.311 ppm2 0.733 CV 1
OR { 3059}
(( segid " " and resid 45 and name HD2 ))
( segid " " and resid 43 and name HG1%)
ASSI { 3060}
(( segid " " and resid 45 and name HD2 ))
( segid " " and resid 50 and name HD1%)
3.500 1.600 1.600 peak 3060 spectrum 1 weight 0.10000E+01 volume 0.19910E-02 ppm1 2.313 ppm2 0.906 CV 1
ASSI { 3061}
(( segid " " and resid 45 and name HD2 ))
( segid " " and resid 46 and name HG2%)
3.800 1.800 1.800 peak 3061 spectrum 1 weight 0.10000E+01 volume 0.34163E-03 ppm1 2.312 ppm2 1.245 CV 1
ASSI { 3062}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 45 and name HG3 ))
3.100 1.200 1.200 peak 3062 spectrum 1 weight 0.10000E+01 volume 0.13534E-02 ppm1 2.312 ppm2 1.369 CV 1
ASSI { 3063}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 45 and name HG2 ))
2.900 1.000 1.000 peak 3063 spectrum 1 weight 0.10000E+01 volume 0.14694E-02 ppm1 2.312 ppm2 1.533 CV 1
ASSI { 3064}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 45 and name HB3 ))
3.000 1.100 1.100 peak 3064 spectrum 1 weight 0.10000E+01 volume 0.14807E-02 ppm1 2.311 ppm2 1.668 CV 1
OR { 3064}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 45 and name HB2 ))
ASSI { 3065}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 43 and name HB ))
3.900 1.900 1.900 peak 3065 spectrum 1 weight 0.10000E+01 volume 0.27142E-03 ppm1 2.312 ppm2 1.908 CV 1
ASSI { 3067}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 45 and name HD3 ))
2.100 0.500 0.500 peak 3067 spectrum 1 weight 0.10000E+01 volume 0.25243E-02 ppm1 2.311 ppm2 2.850 CV 1
ASSI { 3069}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 45 and name HB3 ))
3.300 1.400 1.400 peak 3069 spectrum 1 weight 0.10000E+01 volume 0.15839E-02 ppm1 2.853 ppm2 1.671 CV 1
OR { 3069}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 45 and name HB2 ))
ASSI { 3070}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 43 and name HB ))
4.000 2.000 2.000 peak 3070 spectrum 1 weight 0.10000E+01 volume 0.62303E-03 ppm1 2.837 ppm2 1.905 CV 1
ASSI { 3071}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 45 and name HG3 ))
2.900 1.000 1.000 peak 3071 spectrum 1 weight 0.10000E+01 volume 0.13480E-02 ppm1 2.847 ppm2 1.368 CV 1
ASSI { 3072}
(( segid " " and resid 45 and name HD3 ))
( segid " " and resid 50 and name HD1%)
2.800 1.000 1.000 peak 3072 spectrum 1 weight 0.10000E+01 volume 0.15714E-02 ppm1 2.848 ppm2 0.904 CV 1
ASSI { 3073}
(( segid " " and resid 45 and name HD3 ))
( segid " " and resid 43 and name HG2%)
3.400 1.400 1.400 peak 3073 spectrum 1 weight 0.10000E+01 volume 0.12734E-02 ppm1 2.850 ppm2 0.737 CV 1
OR { 3073}
(( segid " " and resid 45 and name HD3 ))
( segid " " and resid 43 and name HG1%)
ASSI { 3075}
(( segid " " and resid 45 and name HG2 ))
(( segid " " and resid 45 and name HD3 ))
3.300 1.300 1.300 peak 3075 spectrum 1 weight 0.10000E+01 volume 0.78941E-03 ppm1 1.526 ppm2 2.851 CV 1
ASSI { 3077}
(( segid " " and resid 123 and name HG ))
(( segid " " and resid 121 and name HB2 ))
2.000 0.500 0.500 peak 3077 spectrum 1 weight 0.10000E+01 volume 0.59479E-02 ppm1 1.392 ppm2 1.631 CV 1
ASSI { 3078}
(( segid " " and resid 45 and name HB2 ))
( segid " " and resid 50 and name HD1%)
2.800 1.000 1.000 peak 3078 spectrum 1 weight 0.10000E+01 volume 0.40041E-02 ppm1 1.686 ppm2 0.878 CV 1
OR { 3078}
(( segid " " and resid 45 and name HB3 ))
( segid " " and resid 50 and name HD1%)
ASSI { 3079}
(( segid " " and resid 45 and name HG2 ))
(( segid " " and resid 45 and name HE ))
4.000 2.000 2.000 peak 3079 spectrum 1 weight 0.10000E+01 volume 0.70767E-03 ppm1 1.516 ppm2 7.104 CV 1
ASSI { 3080}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 9 and name HZ2 ))
3.500 1.500 1.500 peak 3080 spectrum 1 weight 0.10000E+01 volume 0.61604E-03 ppm1 2.849 ppm2 6.916 CV 1
ASSI { 3081}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 53 and name HD2 ))
4.700 2.800 1.300 peak 3081 spectrum 1 weight 0.10000E+01 volume 0.44141E-03 ppm1 2.857 ppm2 5.774 CV 1
ASSI { 3082}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 53 and name HD2 ))
4.500 2.600 1.500 peak 3082 spectrum 1 weight 0.10000E+01 volume 0.43062E-03 ppm1 2.309 ppm2 5.795 CV 1
ASSI { 3083}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 9 and name HH2 ))
4.100 2.100 1.900 peak 3083 spectrum 1 weight 0.10000E+01 volume 0.40231E-03 ppm1 2.317 ppm2 6.723 CV 1
ASSI { 3084}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 9 and name HZ2 ))
3.600 1.600 1.600 peak 3084 spectrum 1 weight 0.10000E+01 volume 0.66110E-03 ppm1 2.310 ppm2 6.913 CV 1
ASSI { 3085}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 45 and name HE ))
3.300 1.400 1.400 peak 3085 spectrum 1 weight 0.10000E+01 volume 0.78671E-03 ppm1 2.311 ppm2 7.102 CV 1
ASSI { 3087}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 45 and name H ))
5.000 3.200 1.000 peak 3087 spectrum 1 weight 0.10000E+01 volume 0.29179E-03 ppm1 2.853 ppm2 8.104 CV 1
ASSI { 3089}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 45 and name HE ))
3.000 1.100 1.100 peak 3089 spectrum 1 weight 0.10000E+01 volume 0.10530E-02 ppm1 2.851 ppm2 7.103 CV 1
ASSI { 3090}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 9 and name HH2 ))
3.700 1.700 1.700 peak 3090 spectrum 1 weight 0.10000E+01 volume 0.30484E-03 ppm1 2.841 ppm2 6.733 CV 1
ASSI { 3093}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 44 and name HD3 ))
3.900 1.900 1.900 peak 3093 spectrum 1 weight 0.10000E+01 volume 0.19362E-02 ppm1 1.906 ppm2 3.733 CV 1
ASSI { 3094}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 43 and name HG2%)
3.900 1.900 1.900 peak 3094 spectrum 1 weight 0.10000E+01 volume 0.88488E-03 ppm1 4.376 ppm2 0.729 CV 1
OR { 3094}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 43 and name HG1%)
ASSI { 3095}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 50 and name HD1%)
4.400 2.400 1.600 peak 3095 spectrum 1 weight 0.10000E+01 volume 0.82393E-03 ppm1 4.378 ppm2 0.852 CV 1
ASSI { 3096}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HG3 ))
4.600 2.600 1.400 peak 3096 spectrum 1 weight 0.10000E+01 volume 0.64946E-03 ppm1 4.369 ppm2 1.324 CV 1
ASSI { 3097}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB2 ))
2.700 0.900 0.900 peak 3097 spectrum 1 weight 0.10000E+01 volume 0.54326E-02 ppm1 4.375 ppm2 1.888 CV 1
OR { 3097}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HG3 ))
ASSI { 3098}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HG2 ))
3.900 1.900 1.900 peak 3098 spectrum 1 weight 0.10000E+01 volume 0.14607E-02 ppm1 4.375 ppm2 2.058 CV 1
ASSI { 3099}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB3 ))
2.400 0.700 0.700 peak 3099 spectrum 1 weight 0.10000E+01 volume 0.40981E-02 ppm1 4.375 ppm2 2.190 CV 1
ASSI { 3100}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HD2 ))
4.000 2.000 2.000 peak 3100 spectrum 1 weight 0.10000E+01 volume 0.78376E-03 ppm1 4.380 ppm2 3.547 CV 1
ASSI { 3101}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HD3 ))
3.600 1.600 1.600 peak 3101 spectrum 1 weight 0.10000E+01 volume 0.79162E-03 ppm1 4.382 ppm2 3.727 CV 1
ASSI { 3102}
(( segid " " and resid 44 and name HB2 ))
( segid " " and resid 43 and name HG2%)
3.800 1.800 1.800 peak 3102 spectrum 1 weight 0.10000E+01 volume 0.18279E-02 ppm1 1.867 ppm2 0.763 CV 1
OR { 3102}
(( segid " " and resid 44 and name HB2 ))
( segid " " and resid 43 and name HG1%)
ASSI { 3104}
(( segid " " and resid 44 and name HG2 ))
( segid " " and resid 43 and name HG1%)
3.800 1.800 1.800 peak 3104 spectrum 1 weight 0.10000E+01 volume 0.17179E-02 ppm1 2.055 ppm2 0.742 CV 1
OR { 3104}
(( segid " " and resid 44 and name HG2 ))
( segid " " and resid 43 and name HG2%)
ASSI { 3105}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 44 and name HG3 ))
1.600 0.300 0.600 peak 3105 spectrum 1 weight 0.10000E+01 volume 0.19671E-01 ppm1 2.056 ppm2 1.901 CV 1
OR { 3105}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 44 and name HB2 ))
ASSI { 3107}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 44 and name HD3 ))
3.100 1.200 1.200 peak 3107 spectrum 1 weight 0.10000E+01 volume 0.34796E-02 ppm1 2.057 ppm2 3.732 CV 1
ASSI { 3110}
(( segid " " and resid 44 and name HG3 ))
(( segid " " and resid 44 and name HD3 ))
2.500 0.800 0.800 peak 3110 spectrum 1 weight 0.10000E+01 volume 0.30986E-02 ppm1 1.909 ppm2 3.735 CV 1
ASSI { 3111}
(( segid " " and resid 44 and name HG3 ))
(( segid " " and resid 44 and name HG2 ))
1.600 0.300 0.600 peak 3111 spectrum 1 weight 0.10000E+01 volume 0.16258E-01 ppm1 1.910 ppm2 2.053 CV 1
ASSI { 3112}
(( segid " " and resid 44 and name HD3 ))
( segid " " and resid 43 and name HG1%)
3.500 1.500 1.500 peak 3112 spectrum 1 weight 0.10000E+01 volume 0.27879E-02 ppm1 3.731 ppm2 0.740 CV 1
ASSI { 3113}
(( segid " " and resid 44 and name HD2 ))
( segid " " and resid 43 and name HG1%)
2.900 1.000 1.000 peak 3113 spectrum 1 weight 0.10000E+01 volume 0.41222E-02 ppm1 3.543 ppm2 0.739 CV 1
OR { 3113}
(( segid " " and resid 44 and name HD2 ))
( segid " " and resid 43 and name HG2%)
ASSI { 3114}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 44 and name HB3 ))
3.500 1.600 1.600 peak 3114 spectrum 1 weight 0.10000E+01 volume 0.89618E-03 ppm1 3.731 ppm2 2.185 CV 1
ASSI { 3116}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 44 and name HG3 ))
2.500 0.800 0.800 peak 3116 spectrum 1 weight 0.10000E+01 volume 0.43552E-02 ppm1 3.732 ppm2 1.903 CV 1
OR { 3116}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 44 and name HB2 ))
ASSI { 3118}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 44 and name HG2 ))
2.400 0.700 0.700 peak 3118 spectrum 1 weight 0.10000E+01 volume 0.34092E-02 ppm1 3.542 ppm2 2.049 CV 1
ASSI { 3120}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 44 and name HD2 ))
2.000 0.500 0.500 peak 3120 spectrum 1 weight 0.10000E+01 volume 0.47320E-02 ppm1 3.732 ppm2 3.543 CV 1
ASSI { 3121}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HD2 ))
1.700 0.400 0.500 peak 3121 spectrum 1 weight 0.10000E+01 volume 0.13187E-01 ppm1 3.552 ppm2 3.813 CV 1
ASSI { 3126}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 45 and name H ))
3.000 3.000 3.000 peak 3126 spectrum 1 weight 0.10000E+01 volume 0.21096E-03 ppm1 3.728 ppm2 8.095 CV 1
ASSI { 3128}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 45 and name H ))
2.600 2.600 3.400 peak 3128 spectrum 1 weight 0.10000E+01 volume 0.60419E-03 ppm1 2.054 ppm2 8.099 CV 1
ASSI { 3129}
(( segid " " and resid 113 and name HG2 ))
(( segid " " and resid 114 and name H ))
3.500 1.500 1.500 peak 3129 spectrum 1 weight 0.10000E+01 volume 0.13098E-02 ppm1 1.907 ppm2 8.101 CV 1
OR { 3129}
(( segid " " and resid 113 and name HG3 ))
(( segid " " and resid 114 and name H ))
ASSI { 3131}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 43 and name H ))
3.700 1.700 1.700 peak 3131 spectrum 1 weight 0.10000E+01 volume 0.49969E-03 ppm1 4.376 ppm2 7.992 CV 1
ASSI { 3132}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 43 and name H ))
3.000 1.100 1.100 peak 3132 spectrum 1 weight 0.10000E+01 volume 0.22542E-02 ppm1 1.905 ppm2 7.976 CV 1
ASSI { 3134}
( segid " " and resid 43 and name HG2%)
( segid " " and resid 42 and name HG2%)
2.400 0.700 0.700 peak 3134 spectrum 1 weight 0.10000E+01 volume 0.64745E-02 ppm1 0.713 ppm2 1.243 CV 1
ASSI { 3135}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 13 and name HG2 ))
3.400 1.400 1.400 peak 3135 spectrum 1 weight 0.10000E+01 volume 0.12808E-02 ppm1 0.714 ppm2 2.422 CV 1
OR { 3135}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 13 and name HG3 ))
ASSI { 3136}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 49 and name HB3 ))
3.400 1.500 1.500 peak 3136 spectrum 1 weight 0.10000E+01 volume 0.25209E-02 ppm1 0.713 ppm2 2.236 CV 1
OR { 3136}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 49 and name HG3 ))
OR { 3136}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 49 and name HB2 ))
ASSI { 3137}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 43 and name HB ))
2.000 0.500 0.500 peak 3137 spectrum 1 weight 0.10000E+01 volume 0.17965E-01 ppm1 0.713 ppm2 1.908 CV 1
ASSI { 3138}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 45 and name HB3 ))
3.300 1.300 1.300 peak 3138 spectrum 1 weight 0.10000E+01 volume 0.30743E-02 ppm1 0.713 ppm2 1.718 CV 1
OR { 3138}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 45 and name HB2 ))
ASSI { 3139}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 45 and name HG2 ))
3.400 1.400 1.400 peak 3139 spectrum 1 weight 0.10000E+01 volume 0.21529E-02 ppm1 0.713 ppm2 1.520 CV 1
ASSI { 3140}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 45 and name HG3 ))
3.500 1.500 1.500 peak 3140 spectrum 1 weight 0.10000E+01 volume 0.20402E-02 ppm1 0.713 ppm2 1.364 CV 1
ASSI { 3141}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 45 and name HD3 ))
3.400 1.400 1.400 peak 3141 spectrum 1 weight 0.10000E+01 volume 0.10122E-02 ppm1 0.714 ppm2 2.850 CV 1
ASSI { 3142}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 49 and name HB3 ))
2.800 2.800 3.200 peak 3142 spectrum 1 weight 0.10000E+01 volume 0.32997E-02 ppm1 0.744 ppm2 2.233 CV 1
OR { 3142}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 49 and name HG3 ))
OR { 3142}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 49 and name HB2 ))
ASSI { 3143}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 43 and name HB ))
2.000 0.500 0.500 peak 3143 spectrum 1 weight 0.10000E+01 volume 0.19007E-01 ppm1 0.744 ppm2 1.910 CV 1
ASSI { 3145}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 45 and name HG2 ))
3.500 1.500 1.500 peak 3145 spectrum 1 weight 0.10000E+01 volume 0.20859E-02 ppm1 0.744 ppm2 1.537 CV 1
ASSI { 3147}
( segid " " and resid 43 and name HG1%)
( segid " " and resid 42 and name HG2%)
2.700 0.900 0.900 peak 3147 spectrum 1 weight 0.10000E+01 volume 0.46273E-02 ppm1 0.744 ppm2 1.246 CV 1
ASSI { 3149}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 43 and name HG1%)
2.000 0.500 0.500 peak 3149 spectrum 1 weight 0.10000E+01 volume 0.19255E-01 ppm1 1.905 ppm2 0.730 CV 1
OR { 3149}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 43 and name HG2%)
ASSI { 3150}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 42 and name HG2%)
3.900 1.900 1.900 peak 3150 spectrum 1 weight 0.10000E+01 volume 0.90691E-03 ppm1 1.901 ppm2 1.244 CV 1
ASSI { 3151}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 43 and name HG1%)
2.400 0.700 0.700 peak 3151 spectrum 1 weight 0.10000E+01 volume 0.85321E-02 ppm1 4.383 ppm2 0.736 CV 1
OR { 3151}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 43 and name HG2%)
ASSI { 3153}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HG2 ))
4.300 2.300 1.700 peak 3153 spectrum 1 weight 0.10000E+01 volume 0.18167E-02 ppm1 4.382 ppm2 2.051 CV 1
ASSI { 3154}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HB3 ))
4.300 2.300 1.700 peak 3154 spectrum 1 weight 0.10000E+01 volume 0.12813E-02 ppm1 4.379 ppm2 2.191 CV 1
ASSI { 3155}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HD3 ))
2.600 0.800 0.800 peak 3155 spectrum 1 weight 0.10000E+01 volume 0.40676E-02 ppm1 4.384 ppm2 3.734 CV 1
ASSI { 3156}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HD2 ))
2.400 0.700 0.700 peak 3156 spectrum 1 weight 0.10000E+01 volume 0.36684E-02 ppm1 4.382 ppm2 3.543 CV 1
ASSI { 3157}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 44 and name HD2 ))
3.000 1.100 1.100 peak 3157 spectrum 1 weight 0.10000E+01 volume 0.23248E-02 ppm1 1.905 ppm2 3.543 CV 1
ASSI { 3159}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 44 and name HD2 ))
2.800 1.000 1.000 peak 3159 spectrum 1 weight 0.10000E+01 volume 0.48038E-02 ppm1 0.744 ppm2 3.544 CV 1
ASSI { 3160}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 44 and name HD3 ))
3.900 1.900 1.900 peak 3160 spectrum 1 weight 0.10000E+01 volume 0.19515E-02 ppm1 0.714 ppm2 3.736 CV 1
ASSI { 3161}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 44 and name HD2 ))
3.300 1.300 1.300 peak 3161 spectrum 1 weight 0.10000E+01 volume 0.25862E-02 ppm1 0.714 ppm2 3.545 CV 1
ASSI { 3162}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 43 and name HA ))
2.500 0.800 0.800 peak 3162 spectrum 1 weight 0.10000E+01 volume 0.56857E-02 ppm1 0.744 ppm2 4.384 CV 1
ASSI { 3164}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 43 and name HA ))
2.800 1.000 1.000 peak 3164 spectrum 1 weight 0.10000E+01 volume 0.44004E-02 ppm1 0.713 ppm2 4.384 CV 1
ASSI { 3166}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 53 and name HD2 ))
4.400 2.400 1.600 peak 3166 spectrum 1 weight 0.10000E+01 volume 0.57829E-03 ppm1 0.745 ppm2 5.776 CV 1
ASSI { 3167}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 53 and name HD2 ))
4.300 2.400 1.700 peak 3167 spectrum 1 weight 0.10000E+01 volume 0.59674E-03 ppm1 0.715 ppm2 5.798 CV 1
ASSI { 3168}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 9 and name HH2 ))
4.300 2.300 1.700 peak 3168 spectrum 1 weight 0.10000E+01 volume 0.23274E-03 ppm1 0.717 ppm2 6.721 CV 1
ASSI { 3170}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 43 and name H ))
2.400 0.700 0.700 peak 3170 spectrum 1 weight 0.10000E+01 volume 0.60869E-02 ppm1 0.713 ppm2 7.976 CV 1
ASSI { 3171}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 45 and name H ))
4.300 2.300 1.700 peak 3171 spectrum 1 weight 0.10000E+01 volume 0.74157E-03 ppm1 0.743 ppm2 8.099 CV 1
ASSI { 3173}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 45 and name H ))
4.200 2.200 1.800 peak 3173 spectrum 1 weight 0.10000E+01 volume 0.69830E-03 ppm1 0.714 ppm2 8.095 CV 1
ASSI { 3175}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 9 and name HZ2 ))
4.800 2.900 1.200 peak 3175 spectrum 1 weight 0.10000E+01 volume 0.22789E-03 ppm1 0.753 ppm2 6.918 CV 1
ASSI { 3176}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 9 and name HZ3 ))
5.000 3.200 1.000 peak 3176 spectrum 1 weight 0.10000E+01 volume 0.16604E-03 ppm1 0.750 ppm2 6.832 CV 1
ASSI { 3177}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 9 and name HH2 ))
4.700 2.800 1.300 peak 3177 spectrum 1 weight 0.10000E+01 volume 0.21594E-03 ppm1 0.745 ppm2 6.726 CV 1
ASSI { 3178}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 43 and name H ))
2.900 1.100 1.100 peak 3178 spectrum 1 weight 0.10000E+01 volume 0.29679E-02 ppm1 0.744 ppm2 7.976 CV 1
ASSI { 3180}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 43 and name HG1%)
3.700 1.700 1.700 peak 3180 spectrum 1 weight 0.10000E+01 volume 0.17585E-02 ppm1 4.202 ppm2 0.726 CV 1
OR { 3180}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 43 and name HG2%)
ASSI { 3181}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 40 and name HD2%)
5.500 3.800 0.500 peak 3181 spectrum 1 weight 0.10000E+01 volume 0.28539E-03 ppm1 4.204 ppm2 0.982 CV 1
OR { 3181}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 40 and name HD1%)
ASSI { 3182}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 42 and name HG2%)
2.700 0.900 0.900 peak 3182 spectrum 1 weight 0.10000E+01 volume 0.10549E-01 ppm1 4.203 ppm2 1.245 CV 1
ASSI { 3185}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 43 and name HG2%)
3.500 1.500 1.500 peak 3185 spectrum 1 weight 0.10000E+01 volume 0.39392E-02 ppm1 4.199 ppm2 0.722 CV 1
OR { 3185}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 43 and name HG1%)
ASSI { 3186}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 40 and name HD2%)
4.300 2.300 1.700 peak 3186 spectrum 1 weight 0.10000E+01 volume 0.74868E-03 ppm1 4.200 ppm2 0.967 CV 1
OR { 3186}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 40 and name HD1%)
ASSI { 3187}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 42 and name HG2%)
1.900 0.500 0.500 peak 3187 spectrum 1 weight 0.10000E+01 volume 0.17575E-01 ppm1 4.200 ppm2 1.245 CV 1
ASSI { 3189}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 13 and name HG3 ))
3.800 1.800 1.800 peak 3189 spectrum 1 weight 0.10000E+01 volume 0.10052E-02 ppm1 4.201 ppm2 2.412 CV 1
OR { 3189}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 13 and name HG2 ))
ASSI { 3190}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name H ))
3.400 1.500 1.500 peak 3190 spectrum 1 weight 0.10000E+01 volume 0.80973E-03 ppm1 4.202 ppm2 8.172 CV 1
ASSI { 3191}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name H ))
3.200 1.300 1.300 peak 3191 spectrum 1 weight 0.10000E+01 volume 0.21726E-02 ppm1 4.203 ppm2 7.977 CV 1
ASSI { 3192}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 42 and name H ))
3.600 1.600 1.600 peak 3192 spectrum 1 weight 0.10000E+01 volume 0.75180E-03 ppm1 4.199 ppm2 8.171 CV 1
ASSI { 3193}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 43 and name H ))
3.500 1.500 1.500 peak 3193 spectrum 1 weight 0.10000E+01 volume 0.33294E-02 ppm1 4.199 ppm2 7.976 CV 1
ASSI { 3194}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 65 and name H ))
3.400 1.400 1.400 peak 3194 spectrum 1 weight 0.10000E+01 volume 0.20180E-02 ppm1 1.235 ppm2 7.671 CV 1
ASSI { 3199}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 132 and name H ))
4.700 2.700 1.300 peak 3199 spectrum 1 weight 0.10000E+01 volume 0.72245E-03 ppm1 2.829 ppm2 7.868 CV 1
ASSI { 3200}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB3 ))
2.400 0.700 0.700 peak 3200 spectrum 1 weight 0.10000E+01 volume 0.97310E-02 ppm1 4.776 ppm2 2.804 CV 1
OR { 3200}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB2 ))
ASSI { 3201}
(( segid " " and resid 41 and name HB2 ))
( segid " " and resid 42 and name HG2%)
4.900 3.000 1.100 peak 3201 spectrum 1 weight 0.10000E+01 volume 0.50988E-03 ppm1 2.799 ppm2 1.257 CV 1
OR { 3201}
(( segid " " and resid 41 and name HB3 ))
( segid " " and resid 42 and name HG2%)
ASSI { 3204}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 128 and name HG3 ))
3.400 1.500 1.500 peak 3204 spectrum 1 weight 0.10000E+01 volume 0.11536E-02 ppm1 2.830 ppm2 1.628 CV 1
OR { 3204}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 128 and name HG2 ))
ASSI { 3206}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 42 and name HA ))
4.300 2.300 1.700 peak 3206 spectrum 1 weight 0.10000E+01 volume 0.49768E-03 ppm1 2.823 ppm2 4.192 CV 1
OR { 3206}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 42 and name HA ))
OR { 3206}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 42 and name HB ))
OR { 3206}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 42 and name HB ))
ASSI { 3209}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 40 and name H ))
3.400 1.500 1.500 peak 3209 spectrum 1 weight 0.10000E+01 volume 0.12573E-02 ppm1 1.889 ppm2 7.871 CV 1
ASSI { 3210}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 42 and name HG2%)
4.000 2.000 2.000 peak 3210 spectrum 1 weight 0.10000E+01 volume 0.89925E-03 ppm1 4.437 ppm2 1.215 CV 1
ASSI { 3211}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 20 and name HD2%)
2.800 2.800 3.200 peak 3211 spectrum 1 weight 0.10000E+01 volume 0.16573E-02 ppm1 1.924 ppm2 0.604 CV 1
ASSI { 3212}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 20 and name HD2%)
2.000 2.000 4.000 peak 3212 spectrum 1 weight 0.10000E+01 volume 0.26005E-02 ppm1 1.525 ppm2 0.608 CV 1
ASSI { 3214}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 40 and name HD1%)
2.200 0.600 0.600 peak 3214 spectrum 1 weight 0.10000E+01 volume 0.10766E-01 ppm1 1.524 ppm2 0.970 CV 1
OR { 3214}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 40 and name HD2%)
ASSI { 3215}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HB3 ))
1.800 0.400 0.400 peak 3215 spectrum 1 weight 0.10000E+01 volume 0.97636E-02 ppm1 1.923 ppm2 1.519 CV 1
ASSI { 3216}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HB2 ))
1.800 0.400 0.400 peak 3216 spectrum 1 weight 0.10000E+01 volume 0.10287E-01 ppm1 1.525 ppm2 1.915 CV 1
OR { 3216}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HG ))
ASSI { 3220}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HA ))
3.200 1.300 1.300 peak 3220 spectrum 1 weight 0.10000E+01 volume 0.14834E-02 ppm1 1.924 ppm2 3.721 CV 1
ASSI { 3224}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HA ))
3.000 1.100 1.100 peak 3224 spectrum 1 weight 0.10000E+01 volume 0.11672E-02 ppm1 1.923 ppm2 4.451 CV 1
ASSI { 3225}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HA ))
3.300 1.400 1.400 peak 3225 spectrum 1 weight 0.10000E+01 volume 0.10986E-02 ppm1 1.524 ppm2 4.450 CV 1
ASSI { 3227}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 40 and name HD1%)
2.100 0.500 0.500 peak 3227 spectrum 1 weight 0.10000E+01 volume 0.12216E-01 ppm1 1.891 ppm2 0.970 CV 1
OR { 3227}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 40 and name HD2%)
ASSI { 3232}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 13 and name HG3 ))
3.200 1.300 1.300 peak 3232 spectrum 1 weight 0.10000E+01 volume 0.37066E-02 ppm1 0.988 ppm2 2.406 CV 1
OR { 3232}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 13 and name HG2 ))
OR { 3232}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 13 and name HB3 ))
ASSI { 3237}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 40 and name HA ))
3.600 1.600 1.600 peak 3237 spectrum 1 weight 0.10000E+01 volume 0.19774E-02 ppm1 0.989 ppm2 4.450 CV 1
ASSI { 3238}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HG ))
2.000 0.500 0.500 peak 3238 spectrum 1 weight 0.10000E+01 volume 0.13568E-01 ppm1 0.947 ppm2 2.062 CV 1
ASSI { 3240}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 9 and name HZ3 ))
2.900 1.100 1.100 peak 3240 spectrum 1 weight 0.10000E+01 volume 0.18316E-02 ppm1 0.988 ppm2 6.797 CV 1
ASSI { 3241}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 9 and name HH2 ))
3.000 1.100 1.100 peak 3241 spectrum 1 weight 0.10000E+01 volume 0.15912E-02 ppm1 0.989 ppm2 6.732 CV 1
ASSI { 3242}
( segid " " and resid 22 and name HD1%)
( segid " " and resid 21 and name HD% )
4.700 2.800 1.300 peak 3242 spectrum 1 weight 0.10000E+01 volume 0.12568E-02 ppm1 0.987 ppm2 6.900 CV 1
ASSI { 3248}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 17 and name H ))
3.400 1.500 1.500 peak 3248 spectrum 1 weight 0.10000E+01 volume 0.14072E-02 ppm1 0.989 ppm2 8.764 CV 1
ASSI { 3249}
(( segid " " and resid 118 and name HG ))
(( segid " " and resid 118 and name H ))
4.400 2.400 1.600 peak 3249 spectrum 1 weight 0.10000E+01 volume 0.70918E-03 ppm1 1.883 ppm2 8.394 CV 1
ASSI { 3253}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 39 and name H ))
4.400 2.400 1.600 peak 3253 spectrum 1 weight 0.10000E+01 volume 0.87400E-03 ppm1 1.532 ppm2 7.537 CV 1
ASSI { 3257}
(( segid " " and resid 39 and name HB2 ))
( segid " " and resid 20 and name HD1%)
2.700 0.900 0.900 peak 3257 spectrum 1 weight 0.10000E+01 volume 0.25197E-02 ppm1 3.463 ppm2 0.657 CV 1
ASSI { 3260}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HB3 ))
2.200 0.600 0.600 peak 3260 spectrum 1 weight 0.10000E+01 volume 0.27453E-02 ppm1 3.461 ppm2 2.867 CV 1
ASSI { 3266}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HD2 ))
3.400 1.400 1.400 peak 3266 spectrum 1 weight 0.10000E+01 volume 0.64813E-03 ppm1 3.460 ppm2 7.413 CV 1
ASSI { 3269}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 39 and name HD2 ))
4.200 2.200 1.800 peak 3269 spectrum 1 weight 0.10000E+01 volume 0.59907E-03 ppm1 2.866 ppm2 7.411 CV 1
ASSI { 3272}
(( segid " " and resid 16 and name HE1 ))
(( segid " " and resid 16 and name HD2 ))
5.600 3.900 0.400 peak 3272 spectrum 1 weight 0.10000E+01 volume 0.13377E-03 ppm1 8.319 ppm2 7.305 CV 1
ASSI { 3273}
(( segid " " and resid 16 and name HE1 ))
(( segid " " and resid 40 and name HA ))
4.200 2.200 1.800 peak 3273 spectrum 1 weight 0.10000E+01 volume 0.20234E-03 ppm1 8.314 ppm2 4.461 CV 1
ASSI { 3275}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 38 and name HA ))
5.900 4.400 0.100 peak 3275 spectrum 1 weight 0.10000E+01 volume 0.19316E-03 ppm1 7.406 ppm2 4.079 CV 1
ASSI { 3276}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 36 and name HA ))
4.000 2.000 2.000 peak 3276 spectrum 1 weight 0.10000E+01 volume 0.37534E-03 ppm1 7.407 ppm2 3.665 CV 1
ASSI { 3278}
(( segid " " and resid 16 and name HE1 ))
(( segid " " and resid 39 and name HB2 ))
4.900 3.000 1.100 peak 3278 spectrum 1 weight 0.10000E+01 volume 0.25210E-03 ppm1 8.319 ppm2 3.443 CV 1
ASSI { 3281}
(( segid " " and resid 16 and name HE1 ))
(( segid " " and resid 40 and name HG ))
4.900 3.000 1.100 peak 3281 spectrum 1 weight 0.10000E+01 volume 0.16104E-03 ppm1 8.316 ppm2 1.902 CV 1
OR { 3281}
(( segid " " and resid 16 and name HE1 ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 3283}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 36 and name HB ))
4.700 2.800 1.300 peak 3283 spectrum 1 weight 0.10000E+01 volume 0.14892E-03 ppm1 7.410 ppm2 2.109 CV 1
ASSI { 3284}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 20 and name HG ))
5.100 3.200 0.900 peak 3284 spectrum 1 weight 0.10000E+01 volume 0.14225E-03 ppm1 7.412 ppm2 1.736 CV 1
ASSI { 3285}
(( segid " " and resid 39 and name HD2 ))
( segid " " and resid 35 and name HB% )
4.500 2.500 1.500 peak 3285 spectrum 1 weight 0.10000E+01 volume 0.72790E-03 ppm1 7.410 ppm2 1.415 CV 1
ASSI { 3287}
(( segid " " and resid 39 and name HD2 ))
( segid " " and resid 20 and name HD1%)
2.100 2.100 3.900 peak 3287 spectrum 1 weight 0.10000E+01 volume 0.18479E-02 ppm1 7.411 ppm2 0.666 CV 1
ASSI { 3289}
(( segid " " and resid 16 and name HE1 ))
( segid " " and resid 20 and name HD2%)
3.800 1.800 1.800 peak 3289 spectrum 1 weight 0.10000E+01 volume 0.88739E-03 ppm1 8.319 ppm2 0.630 CV 1
ASSI { 3290}
(( segid " " and resid 16 and name HE1 ))
( segid " " and resid 40 and name HD1%)
4.200 2.200 1.800 peak 3290 spectrum 1 weight 0.10000E+01 volume 0.58929E-03 ppm1 8.317 ppm2 0.966 CV 1
OR { 3290}
(( segid " " and resid 16 and name HE1 ))
( segid " " and resid 40 and name HD2%)
ASSI { 3292}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 37 and name HD1%)
3.700 1.700 1.700 peak 3292 spectrum 1 weight 0.10000E+01 volume 0.11032E-02 ppm1 4.076 ppm2 0.861 CV 1
ASSI { 3296}
( segid " " and resid 38 and name HB% )
( segid " " and resid 20 and name HD1%)
4.200 2.200 1.800 peak 3296 spectrum 1 weight 0.10000E+01 volume 0.93237E-03 ppm1 1.278 ppm2 0.644 CV 1
OR { 3296}
( segid " " and resid 38 and name HB% )
( segid " " and resid 20 and name HD2%)
ASSI { 3298}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 34 and name HG2 ))
2.600 2.600 3.400 peak 3298 spectrum 1 weight 0.10000E+01 volume 0.60604E-03 ppm1 1.285 ppm2 2.402 CV 1
ASSI { 3299}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 50 and name HB ))
4.300 2.400 1.700 peak 3299 spectrum 1 weight 0.10000E+01 volume 0.12244E-02 ppm1 1.279 ppm2 2.154 CV 1
ASSI { 3301}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 37 and name HG ))
3.800 1.800 1.800 peak 3301 spectrum 1 weight 0.10000E+01 volume 0.19523E-02 ppm1 1.280 ppm2 1.695 CV 1
ASSI { 3303}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 39 and name HB3 ))
4.600 2.700 1.400 peak 3303 spectrum 1 weight 0.10000E+01 volume 0.81977E-03 ppm1 1.278 ppm2 2.866 CV 1
ASSI { 3304}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 38 and name HA ))
2.100 0.500 0.500 peak 3304 spectrum 1 weight 0.10000E+01 volume 0.16246E-01 ppm1 1.278 ppm2 4.078 CV 1
ASSI { 3305}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 36 and name HA ))
4.300 2.300 1.700 peak 3305 spectrum 1 weight 0.10000E+01 volume 0.64045E-03 ppm1 1.278 ppm2 3.659 CV 1
ASSI { 3306}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 39 and name HB2 ))
4.700 2.800 1.300 peak 3306 spectrum 1 weight 0.10000E+01 volume 0.54440E-03 ppm1 1.275 ppm2 3.466 CV 1
ASSI { 3307}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 47 and name HD3 ))
2.800 2.800 3.200 peak 3307 spectrum 1 weight 0.10000E+01 volume 0.32520E-03 ppm1 1.280 ppm2 3.227 CV 1
OR { 3307}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 47 and name HD2 ))
ASSI { 3310}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 37 and name H ))
4.900 3.000 1.100 peak 3310 spectrum 1 weight 0.10000E+01 volume 0.36636E-03 ppm1 4.079 ppm2 8.570 CV 1
ASSI { 3312}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 39 and name HD2 ))
2.700 0.900 0.900 peak 3312 spectrum 1 weight 0.10000E+01 volume 0.27132E-02 ppm1 1.278 ppm2 7.413 CV 1
ASSI { 3314}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 36 and name H ))
4.000 2.000 2.000 peak 3314 spectrum 1 weight 0.10000E+01 volume 0.87439E-03 ppm1 1.280 ppm2 8.104 CV 1
ASSI { 3321}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB3 ))
2.200 0.600 0.600 peak 3321 spectrum 1 weight 0.10000E+01 volume 0.34336E-02 ppm1 3.930 ppm2 1.869 CV 1
ASSI { 3323}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 38 and name HB% )
4.100 2.100 1.900 peak 3323 spectrum 1 weight 0.10000E+01 volume 0.11401E-02 ppm1 1.554 ppm2 1.278 CV 1
ASSI { 3324}
(( segid " " and resid 37 and name HB3 ))
( segid " " and resid 38 and name HB% )
4.300 2.300 1.700 peak 3324 spectrum 1 weight 0.10000E+01 volume 0.13109E-02 ppm1 1.854 ppm2 1.269 CV 1
ASSI { 3327}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 36 and name HB ))
3.800 1.800 1.800 peak 3327 spectrum 1 weight 0.10000E+01 volume 0.10672E-02 ppm1 1.855 ppm2 2.123 CV 1
ASSI { 3328}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 36 and name HB ))
4.600 2.600 1.400 peak 3328 spectrum 1 weight 0.10000E+01 volume 0.93340E-03 ppm1 1.557 ppm2 2.121 CV 1
ASSI { 3334}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 119 and name H ))
3.400 1.400 1.400 peak 3334 spectrum 1 weight 0.10000E+01 volume 0.42473E-02 ppm1 0.804 ppm2 7.873 CV 1
ASSI { 3336}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 124 and name H ))
4.700 2.700 1.300 peak 3336 spectrum 1 weight 0.10000E+01 volume 0.32018E-03 ppm1 1.568 ppm2 6.771 CV 1
ASSI { 3343}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 36 and name H ))
4.800 2.900 1.200 peak 3343 spectrum 1 weight 0.10000E+01 volume 0.33142E-03 ppm1 3.899 ppm2 8.124 CV 1
ASSI { 3344}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name H ))
2.500 0.800 0.800 peak 3344 spectrum 1 weight 0.10000E+01 volume 0.23413E-02 ppm1 3.931 ppm2 8.591 CV 1
ASSI { 3345}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 37 and name H ))
2.500 0.800 0.800 peak 3345 spectrum 1 weight 0.10000E+01 volume 0.27970E-02 ppm1 1.855 ppm2 8.587 CV 1
ASSI { 3348}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 39 and name H ))
3.600 1.700 1.700 peak 3348 spectrum 1 weight 0.10000E+01 volume 0.48542E-03 ppm1 3.656 ppm2 7.527 CV 1
ASSI { 3350}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 35 and name HB% )
3.400 1.400 1.400 peak 3350 spectrum 1 weight 0.10000E+01 volume 0.12959E-02 ppm1 3.661 ppm2 1.430 CV 1
ASSI { 3351}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 20 and name HG ))
2.800 0.900 0.900 peak 3351 spectrum 1 weight 0.10000E+01 volume 0.69136E-03 ppm1 3.661 ppm2 1.682 CV 1
ASSI { 3352}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 20 and name HD2%)
3.900 1.900 1.900 peak 3352 spectrum 1 weight 0.10000E+01 volume 0.28330E-02 ppm1 3.660 ppm2 0.612 CV 1
ASSI { 3353}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HG13))
2.600 0.800 0.800 peak 3353 spectrum 1 weight 0.10000E+01 volume 0.27495E-02 ppm1 3.660 ppm2 2.105 CV 1
OR { 3353}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB ))
ASSI { 3355}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 33 and name HA ))
2.500 0.800 0.800 peak 3355 spectrum 1 weight 0.10000E+01 volume 0.95574E-03 ppm1 2.109 ppm2 3.594 CV 1
ASSI { 3361}
(( segid " " and resid 36 and name HG13))
(( segid " " and resid 36 and name HA ))
3.100 1.200 1.200 peak 3361 spectrum 1 weight 0.10000E+01 volume 0.95543E-03 ppm1 2.107 ppm2 3.682 CV 1
ASSI { 3362}
( segid " " and resid 36 and name HG2%)
( segid " " and resid 54 and name HD1%)
2.800 1.000 1.000 peak 3362 spectrum 1 weight 0.10000E+01 volume 0.29710E-02 ppm1 0.966 ppm2 0.425 CV 1
OR { 3362}
( segid " " and resid 36 and name HG2%)
( segid " " and resid 54 and name HD2%)
ASSI { 3367}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 36 and name H ))
3.300 1.300 1.300 peak 3367 spectrum 1 weight 0.10000E+01 volume 0.36419E-02 ppm1 0.972 ppm2 8.103 CV 1
ASSI { 3370}
(( segid " " and resid 36 and name HG13))
(( segid " " and resid 35 and name H ))
3.300 1.300 1.300 peak 3370 spectrum 1 weight 0.10000E+01 volume 0.20353E-02 ppm1 2.118 ppm2 7.870 CV 1
ASSI { 3371}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 36 and name H ))
2.600 0.800 0.800 peak 3371 spectrum 1 weight 0.10000E+01 volume 0.14148E-02 ppm1 2.105 ppm2 8.102 CV 1
ASSI { 3373}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 14 and name H ))
3.200 1.300 1.300 peak 3373 spectrum 1 weight 0.10000E+01 volume 0.86857E-03 ppm1 2.148 ppm2 8.714 CV 1
ASSI { 3374}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 35 and name H ))
5.000 3.200 1.000 peak 3374 spectrum 1 weight 0.10000E+01 volume 0.31040E-03 ppm1 2.110 ppm2 7.866 CV 1
ASSI { 3377}
( segid " " and resid 35 and name HB% )
( segid " " and resid 54 and name HD1%)
5.100 3.300 0.900 peak 3377 spectrum 1 weight 0.10000E+01 volume 0.36860E-03 ppm1 1.423 ppm2 0.441 CV 1
ASSI { 3378}
( segid " " and resid 35 and name HB% )
( segid " " and resid 20 and name HD1%)
3.100 1.200 1.200 peak 3378 spectrum 1 weight 0.10000E+01 volume 0.14658E-02 ppm1 1.416 ppm2 0.664 CV 1
ASSI { 3381}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 33 and name HB ))
2.800 2.800 3.200 peak 3381 spectrum 1 weight 0.10000E+01 volume 0.23880E-02 ppm1 1.414 ppm2 2.355 CV 1
ASSI { 3382}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 24 and name HB2 ))
2.800 1.000 1.000 peak 3382 spectrum 1 weight 0.10000E+01 volume 0.24413E-02 ppm1 1.416 ppm2 2.500 CV 1
ASSI { 3383}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 39 and name HB3 ))
4.000 2.000 2.000 peak 3383 spectrum 1 weight 0.10000E+01 volume 0.66697E-03 ppm1 1.418 ppm2 2.866 CV 1
ASSI { 3388}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HD3 ))
3.500 1.600 1.600 peak 3388 spectrum 1 weight 0.10000E+01 volume 0.11079E-02 ppm1 4.204 ppm2 3.309 CV 1
OR { 3388}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HD2 ))
ASSI { 3390}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 24 and name HD22))
3.300 1.300 1.300 peak 3390 spectrum 1 weight 0.10000E+01 volume 0.18430E-02 ppm1 1.415 ppm2 7.484 CV 1
ASSI { 3395}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 37 and name H ))
3.900 1.900 1.900 peak 3395 spectrum 1 weight 0.10000E+01 volume 0.12323E-02 ppm1 1.415 ppm2 8.586 CV 1
ASSI { 3396}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 32 and name H ))
2.900 2.900 3.100 peak 3396 spectrum 1 weight 0.10000E+01 volume 0.28883E-03 ppm1 1.415 ppm2 9.088 CV 1
ASSI { 3398}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 39 and name HD2 ))
3.700 1.700 1.700 peak 3398 spectrum 1 weight 0.10000E+01 volume 0.37330E-03 ppm1 4.190 ppm2 7.412 CV 1
ASSI { 3400}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 35 and name HA ))
2.100 0.600 0.600 peak 3400 spectrum 1 weight 0.10000E+01 volume 0.10997E-01 ppm1 1.415 ppm2 4.189 CV 1
ASSI { 3401}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 31 and name HB3 ))
4.300 2.300 1.700 peak 3401 spectrum 1 weight 0.10000E+01 volume 0.16243E-02 ppm1 2.421 ppm2 2.862 CV 1
ASSI { 3402}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 31 and name HB3 ))
2.900 1.100 1.100 peak 3402 spectrum 1 weight 0.10000E+01 volume 0.13260E-02 ppm1 2.249 ppm2 2.863 CV 1
ASSI { 3405}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 37 and name HD1%)
2.100 0.500 0.500 peak 3405 spectrum 1 weight 0.10000E+01 volume 0.61697E-02 ppm1 3.980 ppm2 0.830 CV 1
ASSI { 3406}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 17 and name HD1%)
2.100 0.600 0.600 peak 3406 spectrum 1 weight 0.10000E+01 volume 0.63308E-02 ppm1 3.964 ppm2 1.058 CV 1
ASSI { 3407}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 38 and name HB% )
3.700 1.700 1.700 peak 3407 spectrum 1 weight 0.10000E+01 volume 0.13121E-02 ppm1 3.973 ppm2 1.289 CV 1
ASSI { 3413}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 89 and name HB2 ))
2.500 0.800 0.800 peak 3413 spectrum 1 weight 0.10000E+01 volume 0.83004E-02 ppm1 2.398 ppm2 2.045 CV 1
ASSI { 3414}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 28 and name HB2 ))
2.100 0.600 0.600 peak 3414 spectrum 1 weight 0.10000E+01 volume 0.16696E-01 ppm1 2.255 ppm2 1.988 CV 1
OR { 3414}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 28 and name HB3 ))
OR { 3414}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 28 and name HB3 ))
OR { 3414}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 28 and name HB2 ))
ASSI { 3420}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 34 and name H ))
2.500 0.800 0.800 peak 3420 spectrum 1 weight 0.10000E+01 volume 0.33513E-02 ppm1 2.249 ppm2 7.999 CV 1
ASSI { 3421}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 35 and name H ))
4.000 2.000 2.000 peak 3421 spectrum 1 weight 0.10000E+01 volume 0.14085E-02 ppm1 2.249 ppm2 7.873 CV 1
ASSI { 3425}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 20 and name H ))
3.600 1.600 1.600 peak 3425 spectrum 1 weight 0.10000E+01 volume 0.17201E-02 ppm1 2.292 ppm2 8.668 CV 1
ASSI { 3426}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 15 and name H ))
3.300 1.300 1.300 peak 3426 spectrum 1 weight 0.10000E+01 volume 0.10925E-02 ppm1 2.393 ppm2 8.277 CV 1
ASSI { 3427}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name H ))
2.700 0.900 0.900 peak 3427 spectrum 1 weight 0.10000E+01 volume 0.14275E-02 ppm1 2.397 ppm2 8.714 CV 1
ASSI { 3430}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name H ))
2.900 1.100 1.100 peak 3430 spectrum 1 weight 0.10000E+01 volume 0.13638E-02 ppm1 3.967 ppm2 8.762 CV 1
ASSI { 3437}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 36 and name HB ))
2.300 0.600 0.600 peak 3437 spectrum 1 weight 0.10000E+01 volume 0.22303E-02 ppm1 3.580 ppm2 2.108 CV 1
OR { 3437}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 36 and name HG13))
ASSI { 3438}
(( segid " " and resid 33 and name HB ))
( segid " " and resid 33 and name HG2%)
2.000 0.500 0.500 peak 3438 spectrum 1 weight 0.10000E+01 volume 0.10023E-01 ppm1 2.339 ppm2 0.948 CV 1
OR { 3438}
(( segid " " and resid 33 and name HB ))
( segid " " and resid 33 and name HG1%)
ASSI { 3439}
(( segid " " and resid 33 and name HB ))
( segid " " and resid 32 and name HG1%)
3.300 1.400 1.400 peak 3439 spectrum 1 weight 0.10000E+01 volume 0.12549E-02 ppm1 2.341 ppm2 1.291 CV 1
ASSI { 3440}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 33 and name HA ))
2.700 0.900 0.900 peak 3440 spectrum 1 weight 0.10000E+01 volume 0.86758E-03 ppm1 2.337 ppm2 3.579 CV 1
ASSI { 3445}
(( segid " " and resid 32 and name HB ))
( segid " " and resid 32 and name HG2%)
2.300 0.600 0.600 peak 3445 spectrum 1 weight 0.10000E+01 volume 0.69370E-02 ppm1 2.361 ppm2 1.031 CV 1
ASSI { 3446}
(( segid " " and resid 32 and name HB ))
( segid " " and resid 35 and name HB% )
3.900 1.900 1.900 peak 3446 spectrum 1 weight 0.10000E+01 volume 0.16747E-02 ppm1 2.359 ppm2 1.406 CV 1
ASSI { 3449}
(( segid " " and resid 32 and name HB ))
(( segid " " and resid 25 and name HA ))
3.000 1.100 1.100 peak 3449 spectrum 1 weight 0.10000E+01 volume 0.18924E-02 ppm1 2.360 ppm2 3.858 CV 1
ASSI { 3450}
( segid " " and resid 32 and name HG1%)
( segid " " and resid 54 and name HD1%)
3.000 1.100 1.100 peak 3450 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 1.295 ppm2 0.430 CV 1
ASSI { 3451}
( segid " " and resid 32 and name HG2%)
( segid " " and resid 54 and name HD1%)
3.900 1.900 1.900 peak 3451 spectrum 1 weight 0.10000E+01 volume 0.21378E-02 ppm1 1.035 ppm2 0.419 CV 1
OR { 3451}
( segid " " and resid 32 and name HG2%)
( segid " " and resid 54 and name HD2%)
ASSI { 3456}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 32 and name HB ))
2.200 0.600 0.600 peak 3456 spectrum 1 weight 0.10000E+01 volume 0.98698E-02 ppm1 1.295 ppm2 2.360 CV 1
ASSI { 3457}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 36 and name HG13))
3.400 1.400 1.400 peak 3457 spectrum 1 weight 0.10000E+01 volume 0.23837E-02 ppm1 1.295 ppm2 2.113 CV 1
OR { 3457}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 36 and name HB ))
ASSI { 3458}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 21 and name HB3 ))
4.100 2.100 1.900 peak 3458 spectrum 1 weight 0.10000E+01 volume 0.12241E-02 ppm1 1.295 ppm2 3.009 CV 1
OR { 3458}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 21 and name HB2 ))
ASSI { 3460}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 25 and name HA ))
3.500 1.500 1.500 peak 3460 spectrum 1 weight 0.10000E+01 volume 0.26478E-02 ppm1 1.295 ppm2 3.858 CV 1
ASSI { 3461}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 33 and name HA ))
3.100 1.200 1.200 peak 3461 spectrum 1 weight 0.10000E+01 volume 0.16553E-02 ppm1 1.295 ppm2 3.582 CV 1
ASSI { 3462}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 66 and name HB3 ))
4.500 2.500 1.500 peak 3462 spectrum 1 weight 0.10000E+01 volume 0.46572E-03 ppm1 1.296 ppm2 3.368 CV 1
ASSI { 3463}
( segid " " and resid 32 and name HG2%)
( segid " " and resid 35 and name HB% )
2.600 0.900 0.900 peak 3463 spectrum 1 weight 0.10000E+01 volume 0.82729E-02 ppm1 1.035 ppm2 1.415 CV 1
ASSI { 3464}
( segid " " and resid 32 and name HG2%)
( segid " " and resid 32 and name HG1%)
2.000 0.500 0.500 peak 3464 spectrum 1 weight 0.10000E+01 volume 0.18250E-01 ppm1 1.035 ppm2 1.295 CV 1
ASSI { 3465}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 24 and name HB2 ))
2.400 0.700 0.700 peak 3465 spectrum 1 weight 0.10000E+01 volume 0.44141E-02 ppm1 1.036 ppm2 2.503 CV 1
ASSI { 3467}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 36 and name HG13))
2.700 0.900 0.900 peak 3467 spectrum 1 weight 0.10000E+01 volume 0.43374E-02 ppm1 1.034 ppm2 2.111 CV 1
OR { 3467}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 36 and name HB ))
ASSI { 3468}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 21 and name HB3 ))
3.500 1.500 1.500 peak 3468 spectrum 1 weight 0.10000E+01 volume 0.20903E-02 ppm1 1.035 ppm2 3.024 CV 1
OR { 3468}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 21 and name HB2 ))
ASSI { 3471}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 25 and name HA ))
2.400 0.700 0.700 peak 3471 spectrum 1 weight 0.10000E+01 volume 0.56526E-02 ppm1 1.036 ppm2 3.855 CV 1
ASSI { 3472}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 24 and name HD22))
4.600 2.600 1.400 peak 3472 spectrum 1 weight 0.10000E+01 volume 0.99532E-03 ppm1 1.034 ppm2 7.486 CV 1
ASSI { 3474}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 30 and name HE21))
3.500 1.500 1.500 peak 3474 spectrum 1 weight 0.10000E+01 volume 0.21770E-02 ppm1 1.035 ppm2 7.034 CV 1
ASSI { 3475}
( segid " " and resid 32 and name HG2%)
( segid " " and resid 21 and name HD% )
2.500 0.800 0.800 peak 3475 spectrum 1 weight 0.10000E+01 volume 0.63980E-02 ppm1 1.035 ppm2 6.888 CV 1
OR { 3475}
( segid " " and resid 32 and name HG2%)
( segid " " and resid 21 and name HE% )
ASSI { 3477}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 35 and name H ))
3.400 1.400 1.400 peak 3477 spectrum 1 weight 0.10000E+01 volume 0.15816E-02 ppm1 1.034 ppm2 7.863 CV 1
ASSI { 3478}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 30 and name HE22))
4.500 2.500 1.500 peak 3478 spectrum 1 weight 0.10000E+01 volume 0.10687E-02 ppm1 1.034 ppm2 7.760 CV 1
ASSI { 3483}
( segid " " and resid 32 and name HG1%)
( segid " " and resid 66 and name HE% )
2.700 0.900 0.900 peak 3483 spectrum 1 weight 0.10000E+01 volume 0.39837E-02 ppm1 1.295 ppm2 7.089 CV 1
ASSI { 3484}
( segid " " and resid 32 and name HG1%)
( segid " " and resid 21 and name HE% )
2.300 0.700 0.700 peak 3484 spectrum 1 weight 0.10000E+01 volume 0.74369E-02 ppm1 1.295 ppm2 6.860 CV 1
OR { 3484}
( segid " " and resid 32 and name HG1%)
( segid " " and resid 21 and name HD% )
ASSI { 3485}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 33 and name H ))
2.300 0.600 0.600 peak 3485 spectrum 1 weight 0.10000E+01 volume 0.55769E-02 ppm1 1.295 ppm2 7.982 CV 1
ASSI { 3488}
(( segid " " and resid 32 and name HB ))
(( segid " " and resid 33 and name H ))
3.700 1.800 1.800 peak 3488 spectrum 1 weight 0.10000E+01 volume 0.14884E-02 ppm1 2.360 ppm2 7.986 CV 1
ASSI { 3489}
(( segid " " and resid 32 and name HB ))
( segid " " and resid 21 and name HD% )
4.700 2.800 1.300 peak 3489 spectrum 1 weight 0.10000E+01 volume 0.50765E-03 ppm1 2.358 ppm2 6.899 CV 1
ASSI { 3492}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 32 and name H ))
2.700 0.900 0.900 peak 3492 spectrum 1 weight 0.10000E+01 volume 0.37115E-02 ppm1 1.294 ppm2 9.097 CV 1
ASSI { 3494}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 32 and name H ))
4.800 2.900 1.200 peak 3494 spectrum 1 weight 0.10000E+01 volume 0.23905E-03 ppm1 2.847 ppm2 9.095 CV 1
ASSI { 3496}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 32 and name H ))
5.000 3.100 1.000 peak 3496 spectrum 1 weight 0.10000E+01 volume 0.33905E-03 ppm1 2.681 ppm2 9.083 CV 1
ASSI { 3497}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 64 and name H ))
5.700 4.000 0.300 peak 3497 spectrum 1 weight 0.10000E+01 volume 0.16013E-03 ppm1 2.701 ppm2 8.285 CV 1
OR { 3497}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 64 and name H ))
ASSI { 3499}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 35 and name H ))
4.800 2.900 1.200 peak 3499 spectrum 1 weight 0.10000E+01 volume 0.37812E-03 ppm1 2.860 ppm2 7.867 CV 1
ASSI { 3503}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 31 and name H ))
5.400 3.600 0.600 peak 3503 spectrum 1 weight 0.10000E+01 volume 0.26694E-03 ppm1 2.052 ppm2 8.868 CV 1
ASSI { 3506}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 31 and name H ))
4.600 2.700 1.400 peak 3506 spectrum 1 weight 0.10000E+01 volume 0.33892E-03 ppm1 2.214 ppm2 8.863 CV 1
ASSI { 3508}
(( segid " " and resid 30 and name HA ))
( segid " " and resid 27 and name HG2%)
3.800 1.800 1.800 peak 3508 spectrum 1 weight 0.10000E+01 volume 0.22205E-02 ppm1 4.578 ppm2 0.902 CV 1
ASSI { 3509}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
2.600 0.800 0.800 peak 3509 spectrum 1 weight 0.10000E+01 volume 0.36509E-02 ppm1 4.573 ppm2 2.058 CV 1
ASSI { 3510}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB3 ))
2.700 0.900 0.900 peak 3510 spectrum 1 weight 0.10000E+01 volume 0.49055E-02 ppm1 4.573 ppm2 1.856 CV 1
ASSI { 3511}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HB3 ))
1.700 0.400 0.500 peak 3511 spectrum 1 weight 0.10000E+01 volume 0.11821E-01 ppm1 2.054 ppm2 1.853 CV 1
ASSI { 3514}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 30 and name HA ))
3.800 1.800 1.800 peak 3514 spectrum 1 weight 0.10000E+01 volume 0.61502E-03 ppm1 2.145 ppm2 4.579 CV 1
ASSI { 3518}
(( segid " " and resid 29 and name HA3 ))
( segid " " and resid 27 and name HG2%)
3.800 1.800 1.800 peak 3518 spectrum 1 weight 0.10000E+01 volume 0.77327E-03 ppm1 3.752 ppm2 0.911 CV 1
ASSI { 3520}
(( segid " " and resid 29 and name HA3 ))
(( segid " " and resid 30 and name HG3 ))
3.800 1.800 1.800 peak 3520 spectrum 1 weight 0.10000E+01 volume 0.69908E-03 ppm1 3.747 ppm2 2.254 CV 1
ASSI { 3522}
(( segid " " and resid 29 and name HA3 ))
(( segid " " and resid 30 and name HB3 ))
4.800 2.900 1.200 peak 3522 spectrum 1 weight 0.10000E+01 volume 0.37013E-03 ppm1 3.756 ppm2 1.854 CV 1
ASSI { 3525}
(( segid " " and resid 29 and name HA3 ))
(( segid " " and resid 28 and name H ))
3.000 3.000 3.000 peak 3525 spectrum 1 weight 0.10000E+01 volume 0.25283E-03 ppm1 3.753 ppm2 8.598 CV 1
ASSI { 3526}
(( segid " " and resid 29 and name HA2 ))
(( segid " " and resid 30 and name HB3 ))
4.900 3.000 1.100 peak 3526 spectrum 1 weight 0.10000E+01 volume 0.42646E-03 ppm1 4.087 ppm2 1.828 CV 1
ASSI { 3527}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 31 and name HB2 ))
2.800 1.000 1.000 peak 3527 spectrum 1 weight 0.10000E+01 volume 0.14138E-02 ppm1 2.249 ppm2 2.664 CV 1
ASSI { 3531}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 27 and name HA ))
3.700 1.700 1.700 peak 3531 spectrum 1 weight 0.10000E+01 volume 0.33486E-02 ppm1 1.991 ppm2 3.892 CV 1
OR { 3531}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 27 and name HA ))
ASSI { 3533}
(( segid " " and resid 86 and name HB3 ))
( segid " " and resid 91 and name HE% )
4.100 2.100 1.900 peak 3533 spectrum 1 weight 0.10000E+01 volume 0.37346E-03 ppm1 1.990 ppm2 7.300 CV 1
OR { 3533}
(( segid " " and resid 86 and name HB2 ))
( segid " " and resid 91 and name HE% )
ASSI { 3534}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 27 and name H ))
3.000 3.000 3.000 peak 3534 spectrum 1 weight 0.10000E+01 volume 0.23781E-03 ppm1 2.307 ppm2 7.296 CV 1
ASSI { 3535}
(( segid " " and resid 34 and name HG3 ))
( segid " " and resid 66 and name HD% )
4.700 2.800 1.300 peak 3535 spectrum 1 weight 0.10000E+01 volume 0.27746E-03 ppm1 2.249 ppm2 7.301 CV 1
ASSI { 3538}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG3 ))
3.900 1.900 1.900 peak 3538 spectrum 1 weight 0.10000E+01 volume 0.10004E-02 ppm1 3.881 ppm2 2.265 CV 1
OR { 3538}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 3542}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 30 and name HE21))
4.100 2.100 1.900 peak 3542 spectrum 1 weight 0.10000E+01 volume 0.87441E-03 ppm1 2.104 ppm2 7.030 CV 1
ASSI { 3543}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 30 and name HE22))
3.700 1.700 1.700 peak 3543 spectrum 1 weight 0.10000E+01 volume 0.12713E-02 ppm1 2.105 ppm2 7.753 CV 1
ASSI { 3548}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 25 and name HG3 ))
3.300 1.400 1.400 peak 3548 spectrum 1 weight 0.10000E+01 volume 0.72729E-03 ppm1 2.897 ppm2 1.153 CV 1
ASSI { 3553}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB3 ))
2.500 0.800 0.800 peak 3553 spectrum 1 weight 0.10000E+01 volume 0.44727E-02 ppm1 3.854 ppm2 1.141 CV 1
OR { 3553}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 3555}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
2.400 0.700 0.700 peak 3555 spectrum 1 weight 0.10000E+01 volume 0.49521E-02 ppm1 3.860 ppm2 1.493 CV 1
ASSI { 3556}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HB3 ))
1.900 0.400 0.400 peak 3556 spectrum 1 weight 0.10000E+01 volume 0.58566E-02 ppm1 1.484 ppm2 1.147 CV 1
OR { 3556}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HG3 ))
ASSI { 3557}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HE2 ))
4.300 2.300 1.700 peak 3557 spectrum 1 weight 0.10000E+01 volume 0.14735E-02 ppm1 1.478 ppm2 3.001 CV 1
OR { 3557}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HE3 ))
ASSI { 3559}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HA ))
2.900 1.000 1.000 peak 3559 spectrum 1 weight 0.10000E+01 volume 0.15435E-02 ppm1 1.141 ppm2 3.853 CV 1
ASSI { 3560}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 22 and name HA ))
3.100 1.200 1.200 peak 3560 spectrum 1 weight 0.10000E+01 volume 0.49333E-03 ppm1 1.140 ppm2 3.731 CV 1
ASSI { 3561}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HE2 ))
4.600 2.600 1.400 peak 3561 spectrum 1 weight 0.10000E+01 volume 0.82086E-03 ppm1 1.139 ppm2 2.985 CV 1
OR { 3561}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HE3 ))
ASSI { 3563}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HB2 ))
2.000 0.500 0.500 peak 3563 spectrum 1 weight 0.10000E+01 volume 0.32098E-02 ppm1 1.141 ppm2 1.481 CV 1
ASSI { 3564}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HD3 ))
2.600 0.900 0.900 peak 3564 spectrum 1 weight 0.10000E+01 volume 0.29470E-02 ppm1 1.141 ppm2 1.346 CV 1
OR { 3564}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HD2 ))
ASSI { 3565}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HB2 ))
2.500 0.800 0.800 peak 3565 spectrum 1 weight 0.10000E+01 volume 0.30058E-02 ppm1 1.148 ppm2 1.478 CV 1
ASSI { 3566}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HD2 ))
2.400 0.700 0.700 peak 3566 spectrum 1 weight 0.10000E+01 volume 0.52161E-02 ppm1 1.150 ppm2 1.346 CV 1
OR { 3566}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HD3 ))
ASSI { 3567}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HE2 ))
3.400 1.500 1.500 peak 3567 spectrum 1 weight 0.10000E+01 volume 0.15774E-02 ppm1 1.149 ppm2 2.988 CV 1
OR { 3567}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HE3 ))
ASSI { 3568}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 22 and name HA ))
4.600 2.600 1.400 peak 3568 spectrum 1 weight 0.10000E+01 volume 0.72486E-03 ppm1 1.140 ppm2 3.732 CV 1
ASSI { 3569}
(( segid " " and resid 25 and name HD3 ))
( segid " " and resid 22 and name HD2%)
2.400 0.700 0.700 peak 3569 spectrum 1 weight 0.10000E+01 volume 0.66151E-02 ppm1 1.344 ppm2 0.947 CV 1
OR { 3569}
(( segid " " and resid 25 and name HD2 ))
( segid " " and resid 22 and name HD2%)
ASSI { 3570}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HG3 ))
2.100 0.500 0.500 peak 3570 spectrum 1 weight 0.10000E+01 volume 0.11088E-01 ppm1 1.346 ppm2 1.173 CV 1
OR { 3570}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HG2 ))
OR { 3570}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HG2 ))
OR { 3570}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HG3 ))
OR { 3570}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HB3 ))
ASSI { 3572}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 22 and name HG ))
4.700 2.700 1.300 peak 3572 spectrum 1 weight 0.10000E+01 volume 0.72840E-03 ppm1 1.345 ppm2 2.049 CV 1
OR { 3572}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 22 and name HG ))
ASSI { 3573}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 22 and name HB2 ))
5.000 3.100 1.000 peak 3573 spectrum 1 weight 0.10000E+01 volume 0.65917E-03 ppm1 1.345 ppm2 1.912 CV 1
OR { 3573}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 22 and name HB2 ))
ASSI { 3574}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HE3 ))
2.200 0.600 0.600 peak 3574 spectrum 1 weight 0.10000E+01 volume 0.84019E-02 ppm1 1.346 ppm2 2.992 CV 1
OR { 3574}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HE2 ))
OR { 3574}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HE3 ))
OR { 3574}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HE2 ))
ASSI { 3575}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HA ))
4.400 2.400 1.600 peak 3575 spectrum 1 weight 0.10000E+01 volume 0.13457E-02 ppm1 1.347 ppm2 3.851 CV 1
OR { 3575}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HA ))
ASSI { 3579}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 26 and name H ))
3.400 1.400 1.400 peak 3579 spectrum 1 weight 0.10000E+01 volume 0.11829E-02 ppm1 3.854 ppm2 8.542 CV 1
ASSI { 3581}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 21 and name HE% )
3.600 1.600 1.600 peak 3581 spectrum 1 weight 0.10000E+01 volume 0.59993E-03 ppm1 1.481 ppm2 6.861 CV 1
OR { 3581}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 21 and name HD% )
ASSI { 3582}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 21 and name HE% )
3.900 1.900 1.900 peak 3582 spectrum 1 weight 0.10000E+01 volume 0.42088E-03 ppm1 1.140 ppm2 6.853 CV 1
ASSI { 3584}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name H ))
3.000 1.100 1.100 peak 3584 spectrum 1 weight 0.10000E+01 volume 0.10618E-02 ppm1 1.139 ppm2 8.037 CV 1
ASSI { 3588}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name H ))
3.800 1.800 1.800 peak 3588 spectrum 1 weight 0.10000E+01 volume 0.10573E-02 ppm1 1.143 ppm2 8.037 CV 1
ASSI { 3589}
(( segid " " and resid 25 and name HG3 ))
( segid " " and resid 21 and name HE% )
4.800 2.900 1.200 peak 3589 spectrum 1 weight 0.10000E+01 volume 0.63209E-03 ppm1 1.151 ppm2 6.873 CV 1
OR { 3589}
(( segid " " and resid 25 and name HG3 ))
( segid " " and resid 21 and name HD% )
ASSI { 3591}
(( segid " " and resid 24 and name HB3 ))
( segid " " and resid 32 and name HG2%)
3.500 1.500 1.500 peak 3591 spectrum 1 weight 0.10000E+01 volume 0.17366E-02 ppm1 2.574 ppm2 1.023 CV 1
ASSI { 3594}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 27 and name HB ))
3.300 1.400 1.400 peak 3594 spectrum 1 weight 0.10000E+01 volume 0.12824E-02 ppm1 4.929 ppm2 2.113 CV 1
ASSI { 3596}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HB2 ))
3.000 1.100 1.100 peak 3596 spectrum 1 weight 0.10000E+01 volume 0.30463E-02 ppm1 4.934 ppm2 2.839 CV 1
ASSI { 3601}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name H ))
3.300 1.400 1.400 peak 3601 spectrum 1 weight 0.10000E+01 volume 0.84323E-03 ppm1 4.942 ppm2 8.046 CV 1
ASSI { 3602}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 30 and name HE21))
3.600 1.600 1.600 peak 3602 spectrum 1 weight 0.10000E+01 volume 0.31292E-03 ppm1 2.577 ppm2 7.029 CV 1
ASSI { 3606}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HD22))
4.800 2.900 1.200 peak 3606 spectrum 1 weight 0.10000E+01 volume 0.57369E-03 ppm1 2.576 ppm2 7.482 CV 1
ASSI { 3607}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HD22))
4.600 2.700 1.400 peak 3607 spectrum 1 weight 0.10000E+01 volume 0.52541E-03 ppm1 2.490 ppm2 7.484 CV 1
ASSI { 3608}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HD21))
4.300 2.300 1.700 peak 3608 spectrum 1 weight 0.10000E+01 volume 0.59929E-03 ppm1 2.552 ppm2 8.102 CV 1
ASSI { 3611}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 22 and name HA ))
4.200 2.200 1.800 peak 3611 spectrum 1 weight 0.10000E+01 volume 0.37072E-03 ppm1 4.235 ppm2 3.730 CV 1
ASSI { 3612}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 22 and name HB2 ))
3.600 1.600 1.600 peak 3612 spectrum 1 weight 0.10000E+01 volume 0.75146E-03 ppm1 4.250 ppm2 1.901 CV 1
ASSI { 3615}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 25 and name H ))
3.800 1.800 1.800 peak 3615 spectrum 1 weight 0.10000E+01 volume 0.54616E-03 ppm1 4.238 ppm2 8.060 CV 1
ASSI { 3617}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 22 and name HD2%)
2.200 0.600 0.600 peak 3617 spectrum 1 weight 0.10000E+01 volume 0.99550E-02 ppm1 3.720 ppm2 0.946 CV 1
OR { 3617}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 22 and name HD1%)
ASSI { 3619}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HD3 ))
2.300 0.600 0.600 peak 3619 spectrum 1 weight 0.10000E+01 volume 0.28848E-02 ppm1 3.717 ppm2 1.372 CV 1
OR { 3619}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HD2 ))
ASSI { 3625}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HG ))
2.500 0.800 0.800 peak 3625 spectrum 1 weight 0.10000E+01 volume 0.28050E-02 ppm1 1.924 ppm2 2.048 CV 1
ASSI { 3626}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HB2 ))
2.000 0.500 0.500 peak 3626 spectrum 1 weight 0.10000E+01 volume 0.46502E-02 ppm1 1.457 ppm2 1.919 CV 1
ASSI { 3628}
(( segid " " and resid 22 and name HG ))
( segid " " and resid 22 and name HD1%)
2.000 0.500 0.500 peak 3628 spectrum 1 weight 0.10000E+01 volume 0.11551E-01 ppm1 2.063 ppm2 0.946 CV 1
OR { 3628}
(( segid " " and resid 22 and name HG ))
( segid " " and resid 22 and name HD2%)
ASSI { 3630}
(( segid " " and resid 22 and name HG ))
(( segid " " and resid 18 and name HG2 ))
3.700 1.700 1.700 peak 3630 spectrum 1 weight 0.10000E+01 volume 0.13793E-02 ppm1 2.066 ppm2 1.638 CV 1
ASSI { 3631}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HB3 ))
2.200 0.600 0.600 peak 3631 spectrum 1 weight 0.10000E+01 volume 0.13024E-01 ppm1 0.946 ppm2 1.450 CV 1
ASSI { 3634}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 21 and name H ))
5.100 3.300 0.900 peak 3634 spectrum 1 weight 0.10000E+01 volume 0.33389E-03 ppm1 0.946 ppm2 8.937 CV 1
ASSI { 3635}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 18 and name H ))
4.100 2.100 1.900 peak 3635 spectrum 1 weight 0.10000E+01 volume 0.12629E-02 ppm1 0.947 ppm2 8.307 CV 1
ASSI { 3636}
(( segid " " and resid 22 and name HG ))
( segid " " and resid 21 and name HD% )
4.500 2.500 1.500 peak 3636 spectrum 1 weight 0.10000E+01 volume 0.83018E-03 ppm1 2.066 ppm2 6.892 CV 1
ASSI { 3639}
(( segid " " and resid 22 and name HG ))
(( segid " " and resid 21 and name H ))
4.900 3.000 1.100 peak 3639 spectrum 1 weight 0.10000E+01 volume 0.27772E-03 ppm1 2.065 ppm2 8.931 CV 1
ASSI { 3640}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 57 and name H ))
2.900 1.000 1.000 peak 3640 spectrum 1 weight 0.10000E+01 volume 0.14621E-02 ppm1 3.715 ppm2 7.859 CV 1
ASSI { 3645}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 21 and name H ))
5.100 3.300 0.900 peak 3645 spectrum 1 weight 0.10000E+01 volume 0.21855E-03 ppm1 1.919 ppm2 8.927 CV 1
ASSI { 3646}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 21 and name HD% )
5.400 3.700 0.600 peak 3646 spectrum 1 weight 0.10000E+01 volume 0.27972E-03 ppm1 1.458 ppm2 6.894 CV 1
ASSI { 3648}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HD% )
3.000 1.100 1.100 peak 3648 spectrum 1 weight 0.10000E+01 volume 0.22108E-02 ppm1 4.011 ppm2 6.897 CV 1
ASSI { 3650}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 22 and name HA ))
3.100 1.200 1.200 peak 3650 spectrum 1 weight 0.10000E+01 volume 0.70355E-03 ppm1 6.904 ppm2 3.727 CV 1
ASSI { 3651}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 21 and name HB3 ))
2.500 0.800 0.800 peak 3651 spectrum 1 weight 0.10000E+01 volume 0.20886E-02 ppm1 6.904 ppm2 3.040 CV 1
OR { 3651}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 21 and name HB2 ))
ASSI { 3657}
( segid " " and resid 21 and name HD% )
( segid " " and resid 59 and name HD1%)
3.000 1.100 1.100 peak 3657 spectrum 1 weight 0.10000E+01 volume 0.17018E-02 ppm1 6.903 ppm2 0.830 CV 1
ASSI { 3658}
( segid " " and resid 21 and name HD% )
( segid " " and resid 54 and name HD1%)
2.600 0.900 0.900 peak 3658 spectrum 1 weight 0.10000E+01 volume 0.21663E-02 ppm1 6.904 ppm2 0.409 CV 1
OR { 3658}
( segid " " and resid 21 and name HD% )
( segid " " and resid 54 and name HD2%)
ASSI { 3659}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 54 and name HD2%)
3.500 1.600 1.600 peak 3659 spectrum 1 weight 0.10000E+01 volume 0.90845E-03 ppm1 3.042 ppm2 0.397 CV 1
OR { 3659}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 54 and name HD2%)
OR { 3659}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 54 and name HD1%)
ASSI { 3660}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 54 and name HD1%)
4.600 2.700 1.400 peak 3660 spectrum 1 weight 0.10000E+01 volume 0.99342E-03 ppm1 4.014 ppm2 0.400 CV 1
OR { 3660}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 54 and name HD2%)
ASSI { 3662}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 32 and name HG1%)
4.400 2.400 1.600 peak 3662 spectrum 1 weight 0.10000E+01 volume 0.85918E-03 ppm1 4.017 ppm2 1.299 CV 1
ASSI { 3665}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB3 ))
2.600 0.800 0.800 peak 3665 spectrum 1 weight 0.10000E+01 volume 0.21135E-02 ppm1 4.013 ppm2 3.045 CV 1
OR { 3665}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB2 ))
ASSI { 3673}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 24 and name H ))
3.600 1.700 1.700 peak 3673 spectrum 1 weight 0.10000E+01 volume 0.43237E-03 ppm1 4.008 ppm2 7.277 CV 1
ASSI { 3674}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name H ))
3.600 1.700 1.700 peak 3674 spectrum 1 weight 0.10000E+01 volume 0.72527E-03 ppm1 4.009 ppm2 8.551 CV 1
ASSI { 3675}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name H ))
2.900 1.100 1.100 peak 3675 spectrum 1 weight 0.10000E+01 volume 0.12514E-02 ppm1 4.011 ppm2 8.933 CV 1
ASSI { 3677}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 25 and name HA ))
4.600 2.700 1.400 peak 3677 spectrum 1 weight 0.10000E+01 volume 0.42468E-03 ppm1 6.839 ppm2 3.838 CV 1
ASSI { 3678}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 22 and name HA ))
4.600 2.600 1.400 peak 3678 spectrum 1 weight 0.10000E+01 volume 0.49168E-03 ppm1 6.837 ppm2 3.709 CV 1
ASSI { 3686}
( segid " " and resid 21 and name HE% )
( segid " " and resid 54 and name HD1%)
2.900 1.100 1.100 peak 3686 spectrum 1 weight 0.10000E+01 volume 0.24683E-02 ppm1 6.845 ppm2 0.417 CV 1
OR { 3686}
( segid " " and resid 21 and name HE% )
( segid " " and resid 54 and name HD2%)
ASSI { 3688}
( segid " " and resid 21 and name HE% )
( segid " " and resid 66 and name HE% )
2.900 1.100 1.100 peak 3688 spectrum 1 weight 0.10000E+01 volume 0.24616E-02 ppm1 6.841 ppm2 7.093 CV 1
ASSI { 3698}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 19 and name H ))
4.600 2.700 1.400 peak 3698 spectrum 1 weight 0.10000E+01 volume 0.73405E-03 ppm1 3.332 ppm2 7.987 CV 1
ASSI { 3699}
(( segid " " and resid 18 and name HD2 ))
(( segid " " and resid 19 and name H ))
4.600 2.600 1.400 peak 3699 spectrum 1 weight 0.10000E+01 volume 0.63501E-03 ppm1 3.276 ppm2 7.988 CV 1
ASSI { 3700}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name H ))
4.100 2.100 1.900 peak 3700 spectrum 1 weight 0.10000E+01 volume 0.97279E-03 ppm1 3.333 ppm2 8.312 CV 1
ASSI { 3702}
(( segid " " and resid 111 and name HD2 ))
(( segid " " and resid 111 and name HE ))
3.900 1.900 1.900 peak 3702 spectrum 1 weight 0.10000E+01 volume 0.35474E-03 ppm1 3.334 ppm2 7.415 CV 1
ASSI { 3710}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 21 and name HB2 ))
2.800 1.000 1.000 peak 3710 spectrum 1 weight 0.10000E+01 volume 0.10491E-02 ppm1 3.794 ppm2 3.043 CV 1
OR { 3710}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 21 and name HB3 ))
ASSI { 3711}
(( segid " " and resid 18 and name HG2 ))
(( segid " " and resid 18 and name HA ))
3.200 1.200 1.200 peak 3711 spectrum 1 weight 0.10000E+01 volume 0.23062E-02 ppm1 1.657 ppm2 3.797 CV 1
OR { 3711}
(( segid " " and resid 18 and name HG3 ))
(( segid " " and resid 18 and name HA ))
ASSI { 3722}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 15 and name HA ))
3.600 1.600 1.600 peak 3722 spectrum 1 weight 0.10000E+01 volume 0.87751E-03 ppm1 3.337 ppm2 4.200 CV 1
ASSI { 3723}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 18 and name H ))
2.900 1.100 1.100 peak 3723 spectrum 1 weight 0.10000E+01 volume 0.70255E-03 ppm1 2.222 ppm2 8.301 CV 1
ASSI { 3726}
(( segid " " and resid 17 and name HB3 ))
( segid " " and resid 17 and name HD2%)
2.700 0.900 0.900 peak 3726 spectrum 1 weight 0.10000E+01 volume 0.16578E-02 ppm1 2.221 ppm2 0.738 CV 1
ASSI { 3727}
(( segid " " and resid 17 and name HB3 ))
( segid " " and resid 17 and name HD1%)
3.800 1.800 1.800 peak 3727 spectrum 1 weight 0.10000E+01 volume 0.10599E-02 ppm1 2.232 ppm2 1.066 CV 1
ASSI { 3728}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HG ))
3.100 1.200 1.200 peak 3728 spectrum 1 weight 0.10000E+01 volume 0.67298E-03 ppm1 2.227 ppm2 1.486 CV 1
ASSI { 3729}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HB2 ))
2.300 0.600 0.600 peak 3729 spectrum 1 weight 0.10000E+01 volume 0.11656E-02 ppm1 2.221 ppm2 1.785 CV 1
ASSI { 3731}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 54 and name HD2%)
2.500 0.800 0.800 peak 3731 spectrum 1 weight 0.10000E+01 volume 0.79859E-02 ppm1 1.073 ppm2 0.400 CV 1
OR { 3731}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 54 and name HD1%)
ASSI { 3732}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 17 and name HD2%)
2.000 0.500 0.500 peak 3732 spectrum 1 weight 0.10000E+01 volume 0.15153E-01 ppm1 1.073 ppm2 0.741 CV 1
ASSI { 3733}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 17 and name HG ))
2.000 0.500 0.500 peak 3733 spectrum 1 weight 0.10000E+01 volume 0.93330E-02 ppm1 1.073 ppm2 1.486 CV 1
ASSI { 3737}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 40 and name HB2 ))
3.200 1.300 1.300 peak 3737 spectrum 1 weight 0.10000E+01 volume 0.35967E-02 ppm1 1.070 ppm2 1.904 CV 1
OR { 3737}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 40 and name HG ))
ASSI { 3739}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 21 and name HB3 ))
4.000 2.000 2.000 peak 3739 spectrum 1 weight 0.10000E+01 volume 0.10829E-02 ppm1 1.072 ppm2 3.034 CV 1
OR { 3739}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 21 and name HB2 ))
ASSI { 3740}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 53 and name HB3 ))
4.300 2.300 1.700 peak 3740 spectrum 1 weight 0.10000E+01 volume 0.91000E-03 ppm1 1.071 ppm2 2.900 CV 1
ASSI { 3742}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 50 and name HA ))
3.100 1.200 1.200 peak 3742 spectrum 1 weight 0.10000E+01 volume 0.17658E-02 ppm1 1.074 ppm2 3.779 CV 1
ASSI { 3746}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 54 and name HA ))
3.100 1.200 1.200 peak 3746 spectrum 1 weight 0.10000E+01 volume 0.20126E-02 ppm1 0.736 ppm2 3.676 CV 1
ASSI { 3747}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 53 and name HB3 ))
2.900 1.100 1.100 peak 3747 spectrum 1 weight 0.10000E+01 volume 0.18960E-02 ppm1 0.735 ppm2 2.885 CV 1
ASSI { 3748}
( segid " " and resid 17 and name HD2%)
( segid " " and resid 54 and name HD2%)
2.400 0.700 0.700 peak 3748 spectrum 1 weight 0.10000E+01 volume 0.83681E-02 ppm1 0.735 ppm2 0.397 CV 1
ASSI { 3752}
( segid " " and resid 17 and name HD2%)
( segid " " and resid 57 and name HE% )
2.300 0.600 0.600 peak 3752 spectrum 1 weight 0.10000E+01 volume 0.55923E-02 ppm1 0.736 ppm2 1.985 CV 1
ASSI { 3754}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 17 and name HG ))
2.100 0.600 0.600 peak 3754 spectrum 1 weight 0.10000E+01 volume 0.83118E-02 ppm1 0.735 ppm2 1.484 CV 1
ASSI { 3755}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 9 and name HZ3 ))
3.800 1.800 1.800 peak 3755 spectrum 1 weight 0.10000E+01 volume 0.17337E-02 ppm1 1.073 ppm2 6.807 CV 1
ASSI { 3756}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 9 and name HH2 ))
2.500 0.800 0.800 peak 3756 spectrum 1 weight 0.10000E+01 volume 0.14150E-02 ppm1 1.073 ppm2 6.729 CV 1
ASSI { 3759}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 21 and name H ))
4.100 2.100 1.900 peak 3759 spectrum 1 weight 0.10000E+01 volume 0.77497E-03 ppm1 1.074 ppm2 8.932 CV 1
ASSI { 3761}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 20 and name H ))
3.900 1.900 1.900 peak 3761 spectrum 1 weight 0.10000E+01 volume 0.10096E-02 ppm1 1.073 ppm2 8.678 CV 1
ASSI { 3764}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 53 and name H ))
3.900 1.900 1.900 peak 3764 spectrum 1 weight 0.10000E+01 volume 0.15386E-02 ppm1 0.736 ppm2 8.131 CV 1
ASSI { 3766}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 53 and name HD2 ))
2.900 1.000 1.000 peak 3766 spectrum 1 weight 0.10000E+01 volume 0.31774E-02 ppm1 0.734 ppm2 5.764 CV 1
ASSI { 3767}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 53 and name HD2 ))
5.000 3.100 1.000 peak 3767 spectrum 1 weight 0.10000E+01 volume 0.37575E-03 ppm1 1.070 ppm2 5.764 CV 1
ASSI { 3769}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 9 and name HZ2 ))
3.000 1.100 1.100 peak 3769 spectrum 1 weight 0.10000E+01 volume 0.17305E-02 ppm1 0.735 ppm2 6.906 CV 1
ASSI { 3770}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 9 and name HZ3 ))
3.500 1.600 1.600 peak 3770 spectrum 1 weight 0.10000E+01 volume 0.25171E-02 ppm1 0.735 ppm2 6.802 CV 1
ASSI { 3772}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HB3 ))
3.700 1.700 1.700 peak 3772 spectrum 1 weight 0.10000E+01 volume 0.79771E-03 ppm1 7.302 ppm2 3.380 CV 1
OR { 3772}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 3773}
(( segid " " and resid 39 and name HE1 ))
( segid " " and resid 20 and name HD1%)
3.100 3.100 2.900 peak 3773 spectrum 1 weight 0.10000E+01 volume 0.19302E-03 ppm1 8.231 ppm2 0.665 CV 1
ASSI { 3774}
(( segid " " and resid 39 and name HE1 ))
( segid " " and resid 38 and name HB% )
5.100 3.300 0.900 peak 3774 spectrum 1 weight 0.10000E+01 volume 0.39501E-03 ppm1 8.226 ppm2 1.282 CV 1
ASSI { 3775}
(( segid " " and resid 39 and name HE1 ))
( segid " " and resid 35 and name HB% )
4.900 3.000 1.100 peak 3775 spectrum 1 weight 0.10000E+01 volume 0.22111E-03 ppm1 8.229 ppm2 1.429 CV 1
ASSI { 3776}
(( segid " " and resid 39 and name HE1 ))
(( segid " " and resid 39 and name HD2 ))
5.400 3.700 0.600 peak 3776 spectrum 1 weight 0.10000E+01 volume 0.17451E-03 ppm1 8.230 ppm2 7.414 CV 1
ASSI { 3777}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 20 and name H ))
4.500 2.500 1.500 peak 3777 spectrum 1 weight 0.10000E+01 volume 0.41709E-03 ppm1 7.302 ppm2 8.668 CV 1
ASSI { 3787}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HA ))
3.900 1.900 1.900 peak 3787 spectrum 1 weight 0.10000E+01 volume 0.20793E-03 ppm1 3.402 ppm2 4.726 CV 1
OR { 3787}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HA ))
ASSI { 3795}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 19 and name HB3 ))
5.100 3.300 0.900 peak 3795 spectrum 1 weight 0.10000E+01 volume 0.42687E-03 ppm1 3.393 ppm2 2.241 CV 1
OR { 3795}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 19 and name HB2 ))
OR { 3795}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 19 and name HB3 ))
OR { 3795}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 19 and name HB2 ))
ASSI { 3802}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 15 and name HB% )
4.400 2.400 1.600 peak 3802 spectrum 1 weight 0.10000E+01 volume 0.69372E-03 ppm1 3.391 ppm2 1.566 CV 1
OR { 3802}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 15 and name HB% )
ASSI { 3804}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 40 and name HD1%)
3.400 1.400 1.400 peak 3804 spectrum 1 weight 0.10000E+01 volume 0.16460E-02 ppm1 3.391 ppm2 0.976 CV 1
OR { 3804}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 40 and name HD2%)
OR { 3804}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 40 and name HD1%)
OR { 3804}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 40 and name HD2%)
ASSI { 3807}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 20 and name HD2%)
4.700 2.700 1.300 peak 3807 spectrum 1 weight 0.10000E+01 volume 0.35387E-03 ppm1 3.344 ppm2 0.603 CV 1
OR { 3807}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 20 and name HD2%)
ASSI { 3810}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 19 and name HG2 ))
3.600 1.700 1.700 peak 3810 spectrum 1 weight 0.10000E+01 volume 0.50679E-03 ppm1 7.297 ppm2 2.458 CV 1
ASSI { 3811}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 19 and name HB3 ))
3.000 1.100 1.100 peak 3811 spectrum 1 weight 0.10000E+01 volume 0.13537E-02 ppm1 7.301 ppm2 2.261 CV 1
OR { 3811}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 19 and name HB2 ))
ASSI { 3814}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 15 and name HB% )
4.600 2.700 1.400 peak 3814 spectrum 1 weight 0.10000E+01 volume 0.56908E-03 ppm1 7.300 ppm2 1.570 CV 1
ASSI { 3816}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 42 and name HG2%)
4.600 2.700 1.400 peak 3816 spectrum 1 weight 0.10000E+01 volume 0.40640E-03 ppm1 7.302 ppm2 1.238 CV 1
ASSI { 3818}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 20 and name HD2%)
3.300 1.300 1.300 peak 3818 spectrum 1 weight 0.10000E+01 volume 0.17493E-02 ppm1 7.300 ppm2 0.633 CV 1
ASSI { 3819}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 19 and name HB3 ))
2.300 0.700 0.700 peak 3819 spectrum 1 weight 0.10000E+01 volume 0.21792E-02 ppm1 4.725 ppm2 2.261 CV 1
OR { 3819}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 19 and name HB2 ))
ASSI { 3821}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 19 and name HA ))
4.700 2.700 1.300 peak 3821 spectrum 1 weight 0.10000E+01 volume 0.73079E-03 ppm1 4.724 ppm2 4.011 CV 1
ASSI { 3822}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 18 and name HG3 ))
3.900 1.900 1.900 peak 3822 spectrum 1 weight 0.10000E+01 volume 0.13964E-02 ppm1 4.724 ppm2 1.690 CV 1
ASSI { 3823}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 15 and name HB% )
4.200 2.200 1.800 peak 3823 spectrum 1 weight 0.10000E+01 volume 0.34238E-03 ppm1 4.738 ppm2 1.580 CV 1
ASSI { 3824}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HD2 ))
2.900 1.100 1.100 peak 3824 spectrum 1 weight 0.10000E+01 volume 0.14782E-02 ppm1 4.731 ppm2 7.294 CV 1
ASSI { 3827}
( segid " " and resid 15 and name HB% )
( segid " " and resid 59 and name HD1%)
5.600 4.000 0.400 peak 3827 spectrum 1 weight 0.10000E+01 volume 0.53814E-03 ppm1 1.569 ppm2 0.837 CV 1
ASSI { 3829}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 19 and name HB2 ))
2.800 1.000 1.000 peak 3829 spectrum 1 weight 0.10000E+01 volume 0.25387E-02 ppm1 1.572 ppm2 2.296 CV 1
ASSI { 3831}
( segid " " and resid 15 and name HB% )
( segid " " and resid 57 and name HE% )
2.800 2.800 3.200 peak 3831 spectrum 1 weight 0.10000E+01 volume 0.27527E-02 ppm1 1.572 ppm2 1.987 CV 1
OR { 3831}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 57 and name HG2 ))
ASSI { 3836}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 16 and name H ))
2.600 0.900 0.900 peak 3836 spectrum 1 weight 0.10000E+01 volume 0.54897E-02 ppm1 1.572 ppm2 7.982 CV 1
ASSI { 3843}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 111 and name HB2 ))
2.800 1.000 1.000 peak 3843 spectrum 1 weight 0.10000E+01 volume 0.35231E-02 ppm1 3.988 ppm2 1.975 CV 1
ASSI { 3847}
(( segid " " and resid 13 and name HB3 ))
( segid " " and resid 43 and name HG1%)
4.400 2.500 1.600 peak 3847 spectrum 1 weight 0.10000E+01 volume 0.77422E-03 ppm1 2.390 ppm2 0.743 CV 1
OR { 3847}
(( segid " " and resid 13 and name HB3 ))
( segid " " and resid 43 and name HG2%)
OR { 3847}
(( segid " " and resid 13 and name HB2 ))
( segid " " and resid 43 and name HG1%)
OR { 3847}
(( segid " " and resid 13 and name HB2 ))
( segid " " and resid 43 and name HG2%)
ASSI { 3848}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 9 and name HB2 ))
3.200 1.300 1.300 peak 3848 spectrum 1 weight 0.10000E+01 volume 0.72337E-03 ppm1 2.400 ppm2 2.862 CV 1
OR { 3848}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 9 and name HB3 ))
OR { 3848}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 9 and name HB2 ))
OR { 3848}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 9 and name HB3 ))
ASSI { 3850}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 110 and name HA ))
4.700 2.800 1.300 peak 3850 spectrum 1 weight 0.10000E+01 volume 0.34253E-03 ppm1 3.993 ppm2 4.453 CV 1
ASSI { 3851}
(( segid " " and resid 18 and name HB3 ))
( segid " " and resid 59 and name HD1%)
2.600 0.800 0.800 peak 3851 spectrum 1 weight 0.10000E+01 volume 0.18837E-02 ppm1 2.083 ppm2 0.843 CV 1
ASSI { 3852}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 18 and name HB2 ))
1.700 0.400 0.500 peak 3852 spectrum 1 weight 0.10000E+01 volume 0.67768E-02 ppm1 2.081 ppm2 1.820 CV 1
ASSI { 3854}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 18 and name HD3 ))
2.800 1.000 1.000 peak 3854 spectrum 1 weight 0.10000E+01 volume 0.21405E-02 ppm1 2.084 ppm2 3.312 CV 1
OR { 3854}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 18 and name HD2 ))
ASSI { 3855}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 53 and name HD2 ))
4.800 2.900 1.200 peak 3855 spectrum 1 weight 0.10000E+01 volume 0.22970E-03 ppm1 3.994 ppm2 5.765 CV 1
ASSI { 3858}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name H ))
4.900 3.000 1.100 peak 3858 spectrum 1 weight 0.10000E+01 volume 0.20467E-03 ppm1 2.853 ppm2 8.421 CV 1
ASSI { 3859}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 15 and name H ))
5.000 3.200 1.000 peak 3859 spectrum 1 weight 0.10000E+01 volume 0.34783E-03 ppm1 2.135 ppm2 8.279 CV 1
ASSI { 3860}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 9 and name HE3 ))
3.800 1.800 1.800 peak 3860 spectrum 1 weight 0.10000E+01 volume 0.37446E-03 ppm1 2.156 ppm2 7.062 CV 1
ASSI { 3861}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 53 and name HD2 ))
4.300 2.300 1.700 peak 3861 spectrum 1 weight 0.10000E+01 volume 0.36236E-03 ppm1 2.150 ppm2 5.763 CV 1
ASSI { 3862}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 14 and name HA ))
3.500 1.500 1.500 peak 3862 spectrum 1 weight 0.10000E+01 volume 0.10099E-02 ppm1 2.146 ppm2 3.977 CV 1
ASSI { 3864}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 14 and name HB2 ))
3.700 1.700 1.700 peak 3864 spectrum 1 weight 0.10000E+01 volume 0.29939E-03 ppm1 2.146 ppm2 2.396 CV 1
ASSI { 3865}
(( segid " " and resid 14 and name HG3 ))
( segid " " and resid 17 and name HD2%)
4.600 2.700 1.400 peak 3865 spectrum 1 weight 0.10000E+01 volume 0.50818E-03 ppm1 2.143 ppm2 0.731 CV 1
ASSI { 3868}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 14 and name H ))
4.300 2.300 1.700 peak 3868 spectrum 1 weight 0.10000E+01 volume 0.74591E-03 ppm1 2.444 ppm2 8.720 CV 1
OR { 3868}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 14 and name H ))
ASSI { 3871}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 12 and name HB3 ))
2.300 0.600 0.600 peak 3871 spectrum 1 weight 0.10000E+01 volume 0.91872E-02 ppm1 2.451 ppm2 1.979 CV 1
ASSI { 3872}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 12 and name HB2 ))
2.300 0.700 0.700 peak 3872 spectrum 1 weight 0.10000E+01 volume 0.14643E-01 ppm1 2.444 ppm2 2.139 CV 1
ASSI { 3873}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 9 and name HB3 ))
4.200 2.200 1.800 peak 3873 spectrum 1 weight 0.10000E+01 volume 0.69338E-03 ppm1 2.416 ppm2 2.853 CV 1
OR { 3873}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 9 and name HB2 ))
OR { 3873}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 9 and name HB2 ))
OR { 3873}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 9 and name HB3 ))
ASSI { 3877}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB2 ))
2.500 0.800 0.800 peak 3877 spectrum 1 weight 0.10000E+01 volume 0.51954E-02 ppm1 4.252 ppm2 2.407 CV 1
OR { 3877}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HG3 ))
OR { 3877}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB3 ))
OR { 3877}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HG2 ))
ASSI { 3878}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 16 and name HB2 ))
3.200 1.300 1.300 peak 3878 spectrum 1 weight 0.10000E+01 volume 0.13943E-02 ppm1 4.252 ppm2 3.380 CV 1
OR { 3878}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 16 and name HB3 ))
ASSI { 3879}
(( segid " " and resid 124 and name HA ))
( segid " " and resid 130 and name HD1%)
4.300 2.300 1.700 peak 3879 spectrum 1 weight 0.10000E+01 volume 0.15047E-02 ppm1 4.254 ppm2 0.979 CV 1
ASSI { 3885}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 12 and name H ))
3.300 1.400 1.400 peak 3885 spectrum 1 weight 0.10000E+01 volume 0.75934E-03 ppm1 2.490 ppm2 8.968 CV 1
ASSI { 3886}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 12 and name H ))
3.900 1.900 1.900 peak 3886 spectrum 1 weight 0.10000E+01 volume 0.47856E-03 ppm1 3.996 ppm2 8.966 CV 1
OR { 3886}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 12 and name H ))
ASSI { 3887}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB2 ))
3.100 1.200 1.200 peak 3887 spectrum 1 weight 0.10000E+01 volume 0.25776E-02 ppm1 4.524 ppm2 2.484 CV 1
ASSI { 3888}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 14 and name HB2 ))
2.300 0.700 0.700 peak 3888 spectrum 1 weight 0.10000E+01 volume 0.17710E-02 ppm1 4.526 ppm2 2.415 CV 1
ASSI { 3889}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HG3 ))
2.900 1.100 1.100 peak 3889 spectrum 1 weight 0.10000E+01 volume 0.13828E-02 ppm1 4.521 ppm2 2.308 CV 1
ASSI { 3892}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB3 ))
2.800 1.000 1.000 peak 3892 spectrum 1 weight 0.10000E+01 volume 0.13672E-02 ppm1 4.530 ppm2 1.988 CV 1
ASSI { 3896}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 12 and name H ))
3.800 1.800 1.800 peak 3896 spectrum 1 weight 0.10000E+01 volume 0.41804E-03 ppm1 4.524 ppm2 8.982 CV 1
ASSI { 3898}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 12 and name HA ))
3.900 1.900 1.900 peak 3898 spectrum 1 weight 0.10000E+01 volume 0.42060E-03 ppm1 2.484 ppm2 4.118 CV 1
ASSI { 3899}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HD3 ))
3.700 1.700 1.700 peak 3899 spectrum 1 weight 0.10000E+01 volume 0.88931E-03 ppm1 2.491 ppm2 3.998 CV 1
OR { 3899}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HD2 ))
ASSI { 3900}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HG3 ))
3.300 1.400 1.400 peak 3900 spectrum 1 weight 0.10000E+01 volume 0.26326E-02 ppm1 2.490 ppm2 2.293 CV 1
ASSI { 3901}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HB3 ))
2.100 0.600 0.600 peak 3901 spectrum 1 weight 0.10000E+01 volume 0.40295E-02 ppm1 2.493 ppm2 2.007 CV 1
ASSI { 3902}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HG2 ))
2.700 0.900 0.900 peak 3902 spectrum 1 weight 0.10000E+01 volume 0.25507E-02 ppm1 2.493 ppm2 2.149 CV 1
ASSI { 3903}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 15 and name HB% )
4.500 2.600 1.500 peak 3903 spectrum 1 weight 0.10000E+01 volume 0.29880E-03 ppm1 2.488 ppm2 1.573 CV 1
ASSI { 3907}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 11 and name HB3 ))
4.700 2.800 1.300 peak 3907 spectrum 1 weight 0.10000E+01 volume 0.64442E-03 ppm1 3.995 ppm2 2.004 CV 1
OR { 3907}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 11 and name HB3 ))
ASSI { 3908}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 11 and name HG2 ))
3.200 1.300 1.300 peak 3908 spectrum 1 weight 0.10000E+01 volume 0.97395E-03 ppm1 3.997 ppm2 2.154 CV 1
OR { 3908}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 11 and name HG2 ))
ASSI { 3909}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 11 and name HG3 ))
3.300 1.300 1.300 peak 3909 spectrum 1 weight 0.10000E+01 volume 0.96835E-03 ppm1 3.996 ppm2 2.293 CV 1
OR { 3909}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 11 and name HG3 ))
ASSI { 3913}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB3 ))
2.900 1.100 1.100 peak 3913 spectrum 1 weight 0.10000E+01 volume 0.16503E-02 ppm1 4.481 ppm2 2.874 CV 1
OR { 3913}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 3914}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HE3 ))
4.800 2.900 1.200 peak 3914 spectrum 1 weight 0.10000E+01 volume 0.91692E-03 ppm1 4.482 ppm2 7.058 CV 1
ASSI { 3916}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 12 and name H ))
4.900 3.100 1.100 peak 3916 spectrum 1 weight 0.10000E+01 volume 0.23958E-03 ppm1 4.070 ppm2 8.959 CV 1
ASSI { 3917}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 12 and name H ))
4.100 2.100 1.900 peak 3917 spectrum 1 weight 0.10000E+01 volume 0.21879E-03 ppm1 4.484 ppm2 8.965 CV 1
ASSI { 3918}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name H ))
4.300 2.300 1.700 peak 3918 spectrum 1 weight 0.10000E+01 volume 0.25083E-03 ppm1 4.493 ppm2 8.778 CV 1
ASSI { 3919}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HB2 ))
3.000 3.000 3.000 peak 3919 spectrum 1 weight 0.10000E+01 volume 0.57585E-03 ppm1 4.061 ppm2 4.490 CV 1
ASSI { 3923}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 11 and name HG3 ))
5.500 3.700 0.500 peak 3923 spectrum 1 weight 0.10000E+01 volume 0.53790E-03 ppm1 4.083 ppm2 2.325 CV 1
ASSI { 3925}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 53 and name HB3 ))
3.200 1.300 1.300 peak 3925 spectrum 1 weight 0.10000E+01 volume 0.67403E-03 ppm1 5.765 ppm2 2.869 CV 1
ASSI { 3926}
(( segid " " and resid 9 and name HD1 ))
(( segid " " and resid 9 and name HB3 ))
3.500 1.500 1.500 peak 3926 spectrum 1 weight 0.10000E+01 volume 0.11338E-02 ppm1 6.974 ppm2 2.886 CV 1
OR { 3926}
(( segid " " and resid 9 and name HD1 ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 3927}
(( segid " " and resid 9 and name HD1 ))
(( segid " " and resid 9 and name HE1 ))
2.300 0.700 0.700 peak 3927 spectrum 1 weight 0.10000E+01 volume 0.36511E-02 ppm1 6.975 ppm2 9.895 CV 1
ASSI { 3931}
(( segid " " and resid 9 and name HD1 ))
( segid " " and resid 43 and name HG1%)
4.800 2.900 1.200 peak 3931 spectrum 1 weight 0.10000E+01 volume 0.15274E-03 ppm1 6.968 ppm2 0.727 CV 1
OR { 3931}
(( segid " " and resid 9 and name HD1 ))
( segid " " and resid 43 and name HG2%)
ASSI { 3934}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 43 and name HG1%)
5.100 3.300 0.900 peak 3934 spectrum 1 weight 0.10000E+01 volume 0.30939E-03 ppm1 4.501 ppm2 0.731 CV 1
OR { 3934}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 43 and name HG2%)
ASSI { 3937}
(( segid " " and resid 9 and name HZ3 ))
( segid " " and resid 40 and name HD1%)
3.200 1.200 1.200 peak 3937 spectrum 1 weight 0.10000E+01 volume 0.12590E-02 ppm1 6.808 ppm2 0.957 CV 1
OR { 3937}
(( segid " " and resid 9 and name HZ3 ))
( segid " " and resid 40 and name HD2%)
ASSI { 3940}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 17 and name HB3 ))
5.200 3.400 0.800 peak 3940 spectrum 1 weight 0.10000E+01 volume 0.27497E-03 ppm1 6.811 ppm2 2.238 CV 1
ASSI { 3941}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 13 and name HG3 ))
3.700 1.700 1.700 peak 3941 spectrum 1 weight 0.10000E+01 volume 0.72522E-03 ppm1 6.801 ppm2 2.402 CV 1
OR { 3941}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 13 and name HG2 ))
OR { 3941}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 13 and name HB3 ))
ASSI { 3944}
(( segid " " and resid 9 and name HH2 ))
( segid " " and resid 17 and name HD2%)
3.600 1.700 1.700 peak 3944 spectrum 1 weight 0.10000E+01 volume 0.62573E-03 ppm1 6.713 ppm2 0.741 CV 1
ASSI { 3947}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 50 and name HG13))
3.900 1.900 1.900 peak 3947 spectrum 1 weight 0.10000E+01 volume 0.55217E-03 ppm1 6.712 ppm2 1.581 CV 1
OR { 3947}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 50 and name HG12))
ASSI { 3952}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 9 and name HE1 ))
3.200 1.300 1.300 peak 3952 spectrum 1 weight 0.10000E+01 volume 0.15111E-02 ppm1 6.921 ppm2 9.896 CV 1
ASSI { 3959}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 45 and name HG3 ))
5.100 3.200 0.900 peak 3959 spectrum 1 weight 0.10000E+01 volume 0.19097E-03 ppm1 6.926 ppm2 1.373 CV 1
ASSI { 3960}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 49 and name HG2 ))
4.800 2.900 1.200 peak 3960 spectrum 1 weight 0.10000E+01 volume 0.28944E-03 ppm1 6.921 ppm2 2.531 CV 1
ASSI { 3961}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 13 and name HG3 ))
4.900 3.000 1.100 peak 3961 spectrum 1 weight 0.10000E+01 volume 0.35811E-03 ppm1 6.916 ppm2 2.472 CV 1
OR { 3961}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 13 and name HG2 ))
ASSI { 3966}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 9 and name HH2 ))
2.400 0.700 0.700 peak 3966 spectrum 1 weight 0.10000E+01 volume 0.27439E-02 ppm1 6.920 ppm2 6.717 CV 1
ASSI { 3971}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 56 and name HE22))
4.400 2.400 1.600 peak 3971 spectrum 1 weight 0.10000E+01 volume 0.15219E-02 ppm1 7.070 ppm2 6.872 CV 1
ASSI { 3972}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 9 and name HZ3 ))
2.600 0.800 0.800 peak 3972 spectrum 1 weight 0.10000E+01 volume 0.19065E-02 ppm1 7.072 ppm2 6.801 CV 1
ASSI { 3977}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 9 and name H ))
3.100 1.200 1.200 peak 3977 spectrum 1 weight 0.10000E+01 volume 0.31198E-02 ppm1 4.208 ppm2 8.680 CV 1
ASSI { 3978}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 8 and name H ))
3.900 1.900 1.900 peak 3978 spectrum 1 weight 0.10000E+01 volume 0.13504E-02 ppm1 4.207 ppm2 8.338 CV 1
ASSI { 3979}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 9 and name HD1 ))
4.600 2.700 1.400 peak 3979 spectrum 1 weight 0.10000E+01 volume 0.78736E-03 ppm1 4.206 ppm2 6.973 CV 1
ASSI { 3984}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 9 and name HB3 ))
4.700 2.800 1.300 peak 3984 spectrum 1 weight 0.10000E+01 volume 0.49691E-03 ppm1 4.211 ppm2 2.896 CV 1
OR { 3984}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 3985}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 64 and name HE3 ))
2.600 2.600 3.400 peak 3985 spectrum 1 weight 0.10000E+01 volume 0.60146E-03 ppm1 4.200 ppm2 3.004 CV 1
OR { 3985}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 64 and name HE2 ))
ASSI { 3986}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 16 and name HB3 ))
3.500 1.500 1.500 peak 3986 spectrum 1 weight 0.10000E+01 volume 0.58955E-03 ppm1 1.243 ppm2 3.355 CV 1
ASSI { 3987}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 44 and name HD2 ))
4.500 2.600 1.500 peak 3987 spectrum 1 weight 0.10000E+01 volume 0.63507E-03 ppm1 1.245 ppm2 3.572 CV 1
ASSI { 3993}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HB2 ))
3.600 1.700 1.700 peak 3993 spectrum 1 weight 0.10000E+01 volume 0.20701E-02 ppm1 3.551 ppm2 1.720 CV 1
ASSI { 3994}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HB2 ))
3.500 1.500 1.500 peak 3994 spectrum 1 weight 0.10000E+01 volume 0.12340E-02 ppm1 3.815 ppm2 1.718 CV 1
ASSI { 3995}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HG3 ))
2.300 0.700 0.700 peak 3995 spectrum 1 weight 0.10000E+01 volume 0.70272E-02 ppm1 3.815 ppm2 1.954 CV 1
OR { 3995}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HG2 ))
ASSI { 4000}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HG2 ))
2.100 0.600 0.600 peak 4000 spectrum 1 weight 0.10000E+01 volume 0.15252E-01 ppm1 1.719 ppm2 1.946 CV 1
OR { 4000}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 4002}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 43 and name HG1%)
3.900 1.900 1.900 peak 4002 spectrum 1 weight 0.10000E+01 volume 0.79437E-03 ppm1 4.458 ppm2 0.734 CV 1
OR { 4002}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 43 and name HG2%)
ASSI { 4003}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 8 and name HG2%)
3.900 1.900 1.900 peak 4003 spectrum 1 weight 0.10000E+01 volume 0.14745E-02 ppm1 4.458 ppm2 1.252 CV 1
ASSI { 4004}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB3 ))
2.100 0.600 0.600 peak 4004 spectrum 1 weight 0.10000E+01 volume 0.92946E-02 ppm1 4.458 ppm2 2.239 CV 1
ASSI { 4005}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG2 ))
3.100 1.200 1.200 peak 4005 spectrum 1 weight 0.10000E+01 volume 0.39153E-02 ppm1 4.458 ppm2 1.958 CV 1
OR { 4005}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 4006}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB2 ))
2.800 1.000 1.000 peak 4006 spectrum 1 weight 0.10000E+01 volume 0.55494E-02 ppm1 4.457 ppm2 1.720 CV 1
ASSI { 4007}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HD3 ))
3.600 1.600 1.600 peak 4007 spectrum 1 weight 0.10000E+01 volume 0.80027E-03 ppm1 4.455 ppm2 3.551 CV 1
ASSI { 4008}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HD2 ))
3.900 1.900 1.900 peak 4008 spectrum 1 weight 0.10000E+01 volume 0.88686E-03 ppm1 4.460 ppm2 3.812 CV 1
ASSI { 4009}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HA ))
3.900 1.900 1.900 peak 4009 spectrum 1 weight 0.10000E+01 volume 0.15858E-02 ppm1 4.460 ppm2 4.223 CV 1
OR { 4009}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HB ))
ASSI { 4013}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HG2 ))
3.800 1.800 1.800 peak 4013 spectrum 1 weight 0.10000E+01 volume 0.31434E-02 ppm1 4.561 ppm2 1.955 CV 1
OR { 4013}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 4014}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HB3 ))
4.600 2.700 1.400 peak 4014 spectrum 1 weight 0.10000E+01 volume 0.10115E-02 ppm1 4.559 ppm2 2.237 CV 1
ASSI { 4015}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HD3 ))
2.200 0.600 0.600 peak 4015 spectrum 1 weight 0.10000E+01 volume 0.81602E-02 ppm1 4.561 ppm2 3.552 CV 1
ASSI { 4016}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HD2 ))
2.400 0.700 0.700 peak 4016 spectrum 1 weight 0.10000E+01 volume 0.10237E-01 ppm1 4.562 ppm2 3.814 CV 1
ASSI { 4017}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HA ))
4.000 2.000 2.000 peak 4017 spectrum 1 weight 0.10000E+01 volume 0.92203E-03 ppm1 4.563 ppm2 4.307 CV 1
ASSI { 4018}
( segid " " and resid 6 and name HB% )
( segid " " and resid 43 and name HG1%)
3.500 1.600 1.600 peak 4018 spectrum 1 weight 0.10000E+01 volume 0.12606E-02 ppm1 1.338 ppm2 0.744 CV 1
OR { 4018}
( segid " " and resid 6 and name HB% )
( segid " " and resid 43 and name HG2%)
ASSI { 4019}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 7 and name HB2 ))
3.300 1.400 1.400 peak 4019 spectrum 1 weight 0.10000E+01 volume 0.35701E-02 ppm1 1.339 ppm2 1.733 CV 1
ASSI { 4021}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 7 and name HB3 ))
4.300 2.300 1.700 peak 4021 spectrum 1 weight 0.10000E+01 volume 0.15443E-02 ppm1 1.340 ppm2 2.231 CV 1
ASSI { 4022}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 49 and name HG2 ))
3.600 3.600 2.400 peak 4022 spectrum 1 weight 0.10000E+01 volume 0.13526E-02 ppm1 1.337 ppm2 2.574 CV 1
ASSI { 4025}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 7 and name HD2 ))
2.400 0.700 0.700 peak 4025 spectrum 1 weight 0.10000E+01 volume 0.44732E-02 ppm1 1.339 ppm2 3.815 CV 1
ASSI { 4026}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 7 and name HD3 ))
3.100 1.200 1.200 peak 4026 spectrum 1 weight 0.10000E+01 volume 0.56651E-02 ppm1 1.338 ppm2 3.551 CV 1
ASSI { 4027}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 5 and name HA ))
3.800 1.800 1.800 peak 4027 spectrum 1 weight 0.10000E+01 volume 0.26404E-02 ppm1 1.339 ppm2 4.307 CV 1
ASSI { 4029}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 49 and name HE21))
3.400 1.400 1.400 peak 4029 spectrum 1 weight 0.10000E+01 volume 0.12076E-02 ppm1 1.338 ppm2 7.059 CV 1
ASSI { 4030}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 49 and name HE22))
3.500 1.600 1.600 peak 4030 spectrum 1 weight 0.10000E+01 volume 0.11445E-02 ppm1 1.337 ppm2 7.466 CV 1
ASSI { 4033}
(( segid " " and resid 130 and name HA ))
( segid " " and resid 130 and name HD2%)
2.700 0.900 0.900 peak 4033 spectrum 1 weight 0.10000E+01 volume 0.94593E-02 ppm1 4.299 ppm2 0.938 CV 1
OR { 4033}
(( segid " " and resid 130 and name HA ))
( segid " " and resid 130 and name HD1%)
ASSI { 4034}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HG3 ))
1.800 0.400 0.400 peak 4034 spectrum 1 weight 0.10000E+01 volume 0.46797E-01 ppm1 1.742 ppm2 1.632 CV 1
OR { 4034}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HG2 ))
ASSI { 4035}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HB3 ))
1.200 0.200 1.000 peak 4035 spectrum 1 weight 0.10000E+01 volume 0.10992E+00 ppm1 1.742 ppm2 1.834 CV 1
ASSI { 4036}
(( segid " " and resid 86 and name HG2 ))
(( segid " " and resid 86 and name HD3 ))
2.300 0.700 0.700 peak 4036 spectrum 1 weight 0.10000E+01 volume 0.76129E-02 ppm1 1.804 ppm2 3.234 CV 1
OR { 4036}
(( segid " " and resid 86 and name HG2 ))
(( segid " " and resid 86 and name HD2 ))
ASSI { 4038}
( segid " " and resid 118 and name HD1%)
( segid " " and resid 88 and name HD% )
3.500 1.600 1.600 peak 4038 spectrum 1 weight 0.10000E+01 volume 0.16604E-02 ppm1 0.504 ppm2 7.043 CV 1
ASSI { 4041}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 118 and name H ))
3.300 1.400 1.400 peak 4041 spectrum 1 weight 0.10000E+01 volume 0.14240E-02 ppm1 0.504 ppm2 8.396 CV 1
ASSI { 4044}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 123 and name H ))
4.200 2.200 1.800 peak 4044 spectrum 1 weight 0.10000E+01 volume 0.93013E-03 ppm1 0.503 ppm2 7.557 CV 1
ASSI { 4045}
( segid " " and resid 118 and name HD2%)
( segid " " and resid 88 and name HE% )
3.200 1.300 1.300 peak 4045 spectrum 1 weight 0.10000E+01 volume 0.11894E-02 ppm1 0.757 ppm2 7.194 CV 1
ASSI { 4046}
( segid " " and resid 118 and name HD2%)
( segid " " and resid 88 and name HD% )
2.800 1.000 1.000 peak 4046 spectrum 1 weight 0.10000E+01 volume 0.17464E-02 ppm1 0.755 ppm2 7.054 CV 1
ASSI { 4048}
( segid " " and resid 118 and name HD2%)
(( segid " " and resid 119 and name H ))
4.200 2.200 1.800 peak 4048 spectrum 1 weight 0.10000E+01 volume 0.93038E-03 ppm1 0.755 ppm2 7.874 CV 1
ASSI { 4050}
( segid " " and resid 118 and name HD2%)
(( segid " " and resid 118 and name H ))
3.600 1.700 1.700 peak 4050 spectrum 1 weight 0.10000E+01 volume 0.16653E-02 ppm1 0.756 ppm2 8.396 CV 1
ASSI { 4052}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 123 and name HA ))
4.000 2.000 2.000 peak 4052 spectrum 1 weight 0.10000E+01 volume 0.15463E-02 ppm1 0.505 ppm2 3.954 CV 1
ASSI { 4054}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 115 and name HA ))
4.200 2.200 1.800 peak 4054 spectrum 1 weight 0.10000E+01 volume 0.73532E-03 ppm1 0.505 ppm2 3.346 CV 1
ASSI { 4055}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 88 and name HB3 ))
3.400 1.400 1.400 peak 4055 spectrum 1 weight 0.10000E+01 volume 0.67166E-03 ppm1 0.505 ppm2 3.193 CV 1
ASSI { 4056}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 88 and name HB2 ))
3.300 1.400 1.400 peak 4056 spectrum 1 weight 0.10000E+01 volume 0.74399E-03 ppm1 0.504 ppm2 2.959 CV 1
ASSI { 4057}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 85 and name HB2 ))
3.800 1.800 1.800 peak 4057 spectrum 1 weight 0.10000E+01 volume 0.12611E-02 ppm1 0.504 ppm2 2.238 CV 1
OR { 4057}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 85 and name HB3 ))
ASSI { 4058}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 118 and name HB2 ))
2.700 0.900 0.900 peak 4058 spectrum 1 weight 0.10000E+01 volume 0.25932E-02 ppm1 0.504 ppm2 2.009 CV 1
ASSI { 4059}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 118 and name HG ))
2.300 0.700 0.700 peak 4059 spectrum 1 weight 0.10000E+01 volume 0.35489E-02 ppm1 0.504 ppm2 1.892 CV 1
ASSI { 4066}
( segid " " and resid 118 and name HD2%)
(( segid " " and resid 115 and name HA ))
2.700 0.900 0.900 peak 4066 spectrum 1 weight 0.10000E+01 volume 0.19871E-02 ppm1 0.755 ppm2 3.349 CV 1
ASSI { 4069}
(( segid " " and resid 113 and name HG3 ))
(( segid " " and resid 127 and name HD3 ))
4.000 2.000 2.000 peak 4069 spectrum 1 weight 0.10000E+01 volume 0.18669E-02 ppm1 1.875 ppm2 3.227 CV 1
OR { 4069}
(( segid " " and resid 113 and name HG3 ))
(( segid " " and resid 127 and name HD2 ))
OR { 4069}
(( segid " " and resid 113 and name HG2 ))
(( segid " " and resid 127 and name HD3 ))
OR { 4069}
(( segid " " and resid 113 and name HG2 ))
(( segid " " and resid 127 and name HD2 ))
ASSI { 4070}
(( segid " " and resid 119 and name HB3 ))
(( segid " " and resid 119 and name HA ))
2.900 1.100 1.100 peak 4070 spectrum 1 weight 0.10000E+01 volume 0.17738E-02 ppm1 1.536 ppm2 4.141 CV 1
ASSI { 4071}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name H ))
3.400 1.500 1.500 peak 4071 spectrum 1 weight 0.10000E+01 volume 0.13788E-02 ppm1 1.032 ppm2 8.673 CV 1
ASSI { 4077}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 104 and name HB2 ))
3.000 1.100 1.100 peak 4077 spectrum 1 weight 0.10000E+01 volume 0.21315E-02 ppm1 1.104 ppm2 2.623 CV 1
ASSI { 4081}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 101 and name HA ))
4.000 2.000 2.000 peak 4081 spectrum 1 weight 0.10000E+01 volume 0.98566E-03 ppm1 1.033 ppm2 3.624 CV 1
ASSI { 4082}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 104 and name HB2 ))
4.200 2.200 1.800 peak 4082 spectrum 1 weight 0.10000E+01 volume 0.74508E-03 ppm1 1.034 ppm2 2.612 CV 1
ASSI { 4083}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 104 and name HB3 ))
4.000 2.000 2.000 peak 4083 spectrum 1 weight 0.10000E+01 volume 0.71319E-03 ppm1 1.033 ppm2 2.896 CV 1
ASSI { 4085}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HG ))
2.400 0.700 0.700 peak 4085 spectrum 1 weight 0.10000E+01 volume 0.49246E-02 ppm1 1.033 ppm2 2.166 CV 1
OR { 4085}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HB2 ))
ASSI { 4086}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 91 and name HD% )
4.300 2.300 1.700 peak 4086 spectrum 1 weight 0.10000E+01 volume 0.95621E-03 ppm1 1.031 ppm2 7.076 CV 1
OR { 4086}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 91 and name HZ ))
ASSI { 4087}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 104 and name H ))
4.600 2.700 1.400 peak 4087 spectrum 1 weight 0.10000E+01 volume 0.46176E-03 ppm1 1.032 ppm2 7.358 CV 1
ASSI { 4089}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 106 and name H ))
4.500 2.600 1.500 peak 4089 spectrum 1 weight 0.10000E+01 volume 0.35017E-03 ppm1 1.032 ppm2 9.154 CV 1
ASSI { 4090}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 88 and name H ))
4.700 2.800 1.300 peak 4090 spectrum 1 weight 0.10000E+01 volume 0.54274E-03 ppm1 1.031 ppm2 8.897 CV 1
ASSI { 4091}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 36 and name HA ))
5.000 3.100 1.000 peak 4091 spectrum 1 weight 0.10000E+01 volume 0.20871E-03 ppm1 1.144 ppm2 3.646 CV 1
ASSI { 4092}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 40 and name HA ))
5.000 3.100 1.000 peak 4092 spectrum 1 weight 0.10000E+01 volume 0.34885E-03 ppm1 0.664 ppm2 4.457 CV 1
ASSI { 4093}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 60 and name H ))
5.100 3.200 0.900 peak 4093 spectrum 1 weight 0.10000E+01 volume 0.37604E-03 ppm1 3.955 ppm2 7.066 CV 1
ASSI { 4095}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 24 and name HD22))
4.100 2.100 1.900 peak 4095 spectrum 1 weight 0.10000E+01 volume 0.13596E-02 ppm1 3.962 ppm2 7.482 CV 1
ASSI { 4096}
(( segid " " and resid 108 and name HE3 ))
(( segid " " and resid 108 and name H ))
4.700 2.700 1.300 peak 4096 spectrum 1 weight 0.10000E+01 volume 0.21881E-03 ppm1 3.004 ppm2 8.178 CV 1
OR { 4096}
(( segid " " and resid 108 and name HE2 ))
(( segid " " and resid 108 and name H ))
ASSI { 4099}
(( segid " " and resid 108 and name HE3 ))
(( segid " " and resid 109 and name H ))
4.800 2.900 1.200 peak 4099 spectrum 1 weight 0.10000E+01 volume 0.37256E-03 ppm1 2.960 ppm2 7.631 CV 1
OR { 4099}
(( segid " " and resid 108 and name HE2 ))
(( segid " " and resid 109 and name H ))
ASSI { 4105}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 56 and name HB2 ))
4.200 2.200 1.800 peak 4105 spectrum 1 weight 0.10000E+01 volume 0.28096E-03 ppm1 5.763 ppm2 1.717 CV 1
ASSI { 4107}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 53 and name HA ))
3.900 1.900 1.900 peak 4107 spectrum 1 weight 0.10000E+01 volume 0.47038E-03 ppm1 5.766 ppm2 3.987 CV 1
ASSI { 4111}
(( segid " " and resid 117 and name HD3 ))
(( segid " " and resid 117 and name HA ))
3.100 1.200 1.200 peak 4111 spectrum 1 weight 0.10000E+01 volume 0.96862E-03 ppm1 0.558 ppm2 4.009 CV 1
ASSI { 4113}
(( segid " " and resid 117 and name HD3 ))
(( segid " " and resid 117 and name HD2 ))
2.200 0.600 0.600 peak 4113 spectrum 1 weight 0.10000E+01 volume 0.17174E-02 ppm1 0.559 ppm2 1.170 CV 1
ASSI { 4115}
(( segid " " and resid 117 and name HD2 ))
(( segid " " and resid 117 and name HA ))
3.800 1.800 1.800 peak 4115 spectrum 1 weight 0.10000E+01 volume 0.10777E-02 ppm1 1.169 ppm2 4.009 CV 1
ASSI { 4116}
(( segid " " and resid 117 and name HB3 ))
(( segid " " and resid 117 and name HD3 ))
3.700 1.700 1.700 peak 4116 spectrum 1 weight 0.10000E+01 volume 0.48269E-03 ppm1 1.558 ppm2 0.598 CV 1
ASSI { 4117}
(( segid " " and resid 117 and name HB2 ))
(( segid " " and resid 117 and name HD3 ))
4.500 2.600 1.500 peak 4117 spectrum 1 weight 0.10000E+01 volume 0.41806E-03 ppm1 1.322 ppm2 0.592 CV 1
ASSI { 4118}
(( segid " " and resid 117 and name HB3 ))
(( segid " " and resid 117 and name H ))
5.200 3.400 0.800 peak 4118 spectrum 1 weight 0.10000E+01 volume 0.17088E-03 ppm1 1.560 ppm2 7.531 CV 1
ASSI { 4119}
(( segid " " and resid 117 and name HB2 ))
(( segid " " and resid 117 and name H ))
3.900 1.900 1.900 peak 4119 spectrum 1 weight 0.10000E+01 volume 0.18534E-03 ppm1 1.333 ppm2 7.534 CV 1
ASSI { 4120}
(( segid " " and resid 76 and name HH2 ))
( segid " " and resid 84 and name HD2%)
3.400 1.500 1.500 peak 4120 spectrum 1 weight 0.10000E+01 volume 0.78427E-03 ppm1 6.886 ppm2 0.612 CV 1
ASSI { 4121}
(( segid " " and resid 76 and name HH2 ))
( segid " " and resid 114 and name HD1%)
3.500 1.500 1.500 peak 4121 spectrum 1 weight 0.10000E+01 volume 0.86896E-03 ppm1 6.885 ppm2 0.958 CV 1
OR { 4121}
(( segid " " and resid 76 and name HH2 ))
( segid " " and resid 114 and name HG2%)
ASSI { 4124}
(( segid " " and resid 76 and name HH2 ))
(( segid " " and resid 114 and name HG13))
4.700 2.700 1.300 peak 4124 spectrum 1 weight 0.10000E+01 volume 0.33517E-03 ppm1 6.898 ppm2 1.856 CV 1
ASSI { 4125}
(( segid " " and resid 76 and name HH2 ))
(( segid " " and resid 114 and name HA ))
5.900 4.400 0.100 peak 4125 spectrum 1 weight 0.10000E+01 volume 0.13565E-03 ppm1 6.893 ppm2 3.869 CV 1
ASSI { 4126}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 53 and name HD2 ))
5.100 3.200 0.900 peak 4126 spectrum 1 weight 0.10000E+01 volume 0.11194E-03 ppm1 7.077 ppm2 5.789 CV 1
ASSI { 4130}
(( segid " " and resid 53 and name HE1 ))
(( segid " " and resid 53 and name HB3 ))
5.200 3.400 0.800 peak 4130 spectrum 1 weight 0.10000E+01 volume 0.25460E-03 ppm1 7.952 ppm2 2.899 CV 1
ASSI { 4131}
(( segid " " and resid 53 and name HE1 ))
(( segid " " and resid 9 and name HZ2 ))
5.700 4.000 0.300 peak 4131 spectrum 1 weight 0.10000E+01 volume 0.22615E-03 ppm1 7.952 ppm2 6.970 CV 1
OR { 4131}
(( segid " " and resid 53 and name HE1 ))
(( segid " " and resid 9 and name HD1 ))
ASSI { 4133}
(( segid " " and resid 66 and name HZ ))
(( segid " " and resid 54 and name HA ))
3.100 3.100 2.900 peak 4133 spectrum 1 weight 0.10000E+01 volume 0.18819E-03 ppm1 6.941 ppm2 3.659 CV 1
ASSI { 4136}
(( segid " " and resid 88 and name HZ ))
( segid " " and resid 88 and name HE% )
2.400 0.700 0.700 peak 4136 spectrum 1 weight 0.10000E+01 volume 0.50048E-02 ppm1 7.049 ppm2 7.177 CV 1
ASSI { 4140}
( segid " " and resid 88 and name HD% )
(( segid " " and resid 89 and name HA ))
3.800 1.800 1.800 peak 4140 spectrum 1 weight 0.10000E+01 volume 0.36524E-03 ppm1 7.040 ppm2 3.739 CV 1
ASSI { 4141}
( segid " " and resid 88 and name HD% )
(( segid " " and resid 92 and name HA ))
5.700 4.000 0.300 peak 4141 spectrum 1 weight 0.10000E+01 volume 0.17217E-03 ppm1 7.045 ppm2 3.580 CV 1
OR { 4141}
(( segid " " and resid 88 and name HZ ))
(( segid " " and resid 92 and name HA ))
ASSI { 4143}
(( segid " " and resid 76 and name HZ3 ))
(( segid " " and resid 76 and name HE3 ))
3.700 1.700 1.700 peak 4143 spectrum 1 weight 0.10000E+01 volume 0.44111E-03 ppm1 7.050 ppm2 7.370 CV 1
ASSI { 4144}
(( segid " " and resid 76 and name HZ3 ))
(( segid " " and resid 76 and name HH2 ))
3.500 1.500 1.500 peak 4144 spectrum 1 weight 0.10000E+01 volume 0.42833E-03 ppm1 7.047 ppm2 6.903 CV 1
ASSI { 4145}
(( segid " " and resid 76 and name HZ3 ))
( segid " " and resid 84 and name HD2%)
4.000 2.000 2.000 peak 4145 spectrum 1 weight 0.10000E+01 volume 0.56908E-03 ppm1 7.047 ppm2 0.602 CV 1
ASSI { 4148}
(( segid " " and resid 76 and name HZ3 ))
(( segid " " and resid 114 and name HG12))
4.900 3.000 1.100 peak 4148 spectrum 1 weight 0.10000E+01 volume 0.27447E-03 ppm1 7.047 ppm2 1.210 CV 1
ASSI { 4150}
(( segid " " and resid 76 and name HZ3 ))
(( segid " " and resid 84 and name HB2 ))
4.200 2.200 1.800 peak 4150 spectrum 1 weight 0.10000E+01 volume 0.18393E-03 ppm1 7.048 ppm2 1.795 CV 1
ASSI { 4151}
(( segid " " and resid 76 and name HZ3 ))
(( segid " " and resid 84 and name HB3 ))
4.500 2.500 1.500 peak 4151 spectrum 1 weight 0.10000E+01 volume 0.16106E-03 ppm1 7.047 ppm2 2.023 CV 1
ASSI { 4154}
(( segid " " and resid 76 and name HE3 ))
( segid " " and resid 84 and name HD2%)
4.700 2.800 1.300 peak 4154 spectrum 1 weight 0.10000E+01 volume 0.51567E-03 ppm1 7.365 ppm2 0.607 CV 1
ASSI { 4161}
(( segid " " and resid 108 and name HG2 ))
(( segid " " and resid 108 and name H ))
2.800 1.000 1.000 peak 4161 spectrum 1 weight 0.10000E+01 volume 0.21779E-02 ppm1 1.457 ppm2 8.180 CV 1
ASSI { 4162}
(( segid " " and resid 108 and name HG3 ))
(( segid " " and resid 108 and name H ))
3.300 1.400 1.400 peak 4162 spectrum 1 weight 0.10000E+01 volume 0.19100E-02 ppm1 1.401 ppm2 8.181 CV 1
ASSI { 4163}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 109 and name HE ))
4.100 2.100 1.900 peak 4163 spectrum 1 weight 0.10000E+01 volume 0.24218E-03 ppm1 2.780 ppm2 6.508 CV 1
ASSI { 4164}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 114 and name H ))
5.100 3.200 0.900 peak 4164 spectrum 1 weight 0.10000E+01 volume 0.22205E-03 ppm1 2.780 ppm2 8.095 CV 1
ASSI { 4166}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 127 and name HA ))
3.900 1.900 1.900 peak 4166 spectrum 1 weight 0.10000E+01 volume 0.62734E-03 ppm1 6.741 ppm2 3.732 CV 1
ASSI { 4168}
(( segid " " and resid 129 and name HG3 ))
(( segid " " and resid 131 and name H ))
5.000 3.100 1.000 peak 4168 spectrum 1 weight 0.10000E+01 volume 0.28551E-03 ppm1 2.397 ppm2 7.409 CV 1
OR { 4168}
(( segid " " and resid 129 and name HG2 ))
(( segid " " and resid 131 and name H ))
ASSI { 4169}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 85 and name HE21))
5.600 4.000 0.400 peak 4169 spectrum 1 weight 0.10000E+01 volume 0.14360E-03 ppm1 2.515 ppm2 6.839 CV 1
ASSI { 4170}
(( segid " " and resid 73 and name HB ))
( segid " " and resid 73 and name HG2%)
2.000 0.500 0.500 peak 4170 spectrum 1 weight 0.10000E+01 volume 0.18887E-01 ppm1 1.775 ppm2 0.827 CV 1
OR { 4170}
(( segid " " and resid 73 and name HB ))
( segid " " and resid 73 and name HD1%)
ASSI { 4171}
(( segid " " and resid 88 and name HZ ))
(( segid " " and resid 89 and name HG3 ))
6.000 4.800 0.000 peak 4171 spectrum 1 weight 0.10000E+01 volume 0.20983E-03 ppm1 7.092 ppm2 2.538 CV 1
ASSI { 4172}
(( segid " " and resid 128 and name HB2 ))
( segid " " and resid 131 and name HE% )
4.800 2.900 1.200 peak 4172 spectrum 1 weight 0.10000E+01 volume 0.42512E-03 ppm1 1.858 ppm2 6.741 CV 1
OR { 4172}
(( segid " " and resid 128 and name HB3 ))
( segid " " and resid 131 and name HE% )
# Restraints file 3: ambig.tbl
ASSI { 2}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 67 and name HA ))
2.400 0.700 0.700 peak 2 spectrum 1 weight 0.10000E+01 volume 0.63571E-02 ppm1 7.802 ppm2 4.411 CV 1
OR { 2}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 65 and name HA ))
ASSI { 3}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 4 and name HA ))
2.300 0.600 0.600 peak 3 spectrum 1 weight 0.10000E+01 volume 0.94094E-02 ppm1 8.152 ppm2 4.316 CV 1
OR { 3}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 5 and name HA ))
ASSI { 4}
(( segid " " and resid 90 and name H ))
(( segid " " and resid 90 and name HA ))
2.800 1.000 1.000 peak 4 spectrum 1 weight 0.10000E+01 volume 0.27191E-02 ppm1 7.919 ppm2 3.746 CV 1
OR { 4}
(( segid " " and resid 90 and name H ))
(( segid " " and resid 89 and name HA ))
ASSI { 14}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 4 and name HD3 ))
4.400 2.500 1.600 peak 14 spectrum 1 weight 0.10000E+01 volume 0.63327E-03 ppm1 8.156 ppm2 3.202 CV 1
OR { 14}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 4 and name HD2 ))
OR { 14}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 5 and name HD3 ))
ASSI { 15}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 5 and name HB3 ))
2.900 1.100 1.100 peak 15 spectrum 1 weight 0.10000E+01 volume 0.43327E-02 ppm1 8.152 ppm2 1.819 CV 1
OR { 15}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 4 and name HB2 ))
ASSI { 17}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 5 and name HG3 ))
3.500 1.500 1.500 peak 17 spectrum 1 weight 0.10000E+01 volume 0.36307E-02 ppm1 8.153 ppm2 1.645 CV 1
OR { 17}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 4 and name HG2 ))
OR { 17}
(( segid " " and resid 5 and name H ))
(( segid " " and resid 4 and name HG3 ))
ASSI { 19}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 7 and name HA ))
3.200 3.200 2.800 peak 19 spectrum 1 weight 0.10000E+01 volume 0.28306E-02 ppm1 8.346 ppm2 4.411 CV 1
OR { 19}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 43 and name HA ))
ASSI { 28}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 44 and name HG3 ))
4.400 2.400 1.600 peak 28 spectrum 1 weight 0.10000E+01 volume 0.79959E-03 ppm1 8.343 ppm2 1.930 CV 1
OR { 28}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 7 and name HG2 ))
OR { 28}
(( segid " " and resid 6 and name H ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 34}
(( segid " " and resid 8 and name H ))
(( segid " " and resid 7 and name HD3 ))
3.300 3.300 2.700 peak 34 spectrum 1 weight 0.10000E+01 volume 0.40993E-03 ppm1 8.349 ppm2 3.551 CV 1
OR { 34}
(( segid " " and resid 8 and name H ))
(( segid " " and resid 44 and name HD2 ))
ASSI { 46}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 45 and name HD3 ))
3.200 1.300 1.300 peak 46 spectrum 1 weight 0.10000E+01 volume 0.27388E-02 ppm1 9.902 ppm2 2.890 CV 1
OR { 46}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 14 and name HG2 ))
OR { 46}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 47}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 53 and name HB2 ))
3.700 1.700 1.700 peak 47 spectrum 1 weight 0.10000E+01 volume 0.19245E-02 ppm1 9.903 ppm2 2.215 CV 1
OR { 47}
(( segid " " and resid 9 and name HE1 ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 48}
(( segid " " and resid 9 and name HE1 ))
( segid " " and resid 50 and name HD1%)
4.300 2.400 1.700 peak 48 spectrum 1 weight 0.10000E+01 volume 0.50411E-03 ppm1 9.900 ppm2 0.912 CV 1
OR { 48}
(( segid " " and resid 9 and name HE1 ))
( segid " " and resid 40 and name HD2%)
OR { 48}
(( segid " " and resid 9 and name HE1 ))
( segid " " and resid 50 and name HG2%)
ASSI { 49}
(( segid " " and resid 9 and name HE1 ))
( segid " " and resid 43 and name HG2%)
3.700 1.700 1.700 peak 49 spectrum 1 weight 0.10000E+01 volume 0.82912E-03 ppm1 9.906 ppm2 0.748 CV 1
OR { 49}
(( segid " " and resid 9 and name HE1 ))
( segid " " and resid 17 and name HD2%)
ASSI { 60}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 14 and name HG3 ))
4.100 2.100 1.900 peak 60 spectrum 1 weight 0.10000E+01 volume 0.55244E-03 ppm1 8.821 ppm2 2.145 CV 1
OR { 60}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 12 and name HB2 ))
OR { 60}
(( segid " " and resid 10 and name H ))
(( segid " " and resid 11 and name HG2 ))
ASSI { 64}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 11 and name HA ))
3.000 1.100 1.100 peak 64 spectrum 1 weight 0.10000E+01 volume 0.16562E-02 ppm1 8.971 ppm2 4.509 CV 1
OR { 64}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 66}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HG2 ))
3.300 1.400 1.400 peak 66 spectrum 1 weight 0.10000E+01 volume 0.34632E-02 ppm1 8.971 ppm2 2.432 CV 1
OR { 66}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 13 and name HB2 ))
OR { 66}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 67}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 12 and name HG3 ))
3.300 1.300 1.300 peak 67 spectrum 1 weight 0.10000E+01 volume 0.34572E-02 ppm1 8.972 ppm2 2.296 CV 1
OR { 67}
(( segid " " and resid 12 and name H ))
(( segid " " and resid 11 and name HG3 ))
ASSI { 81}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 13 and name HA ))
3.400 1.500 1.500 peak 81 spectrum 1 weight 0.10000E+01 volume 0.13040E-02 ppm1 8.720 ppm2 4.240 CV 1
OR { 81}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 15 and name HA ))
ASSI { 83}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 14 and name HG2 ))
3.300 1.400 1.400 peak 83 spectrum 1 weight 0.10000E+01 volume 0.23848E-02 ppm1 8.720 ppm2 2.859 CV 1
OR { 83}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 84}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 13 and name HB3 ))
2.300 0.700 0.700 peak 84 spectrum 1 weight 0.10000E+01 volume 0.53019E-02 ppm1 8.722 ppm2 2.403 CV 1
OR { 84}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 14 and name HB2 ))
OR { 84}
(( segid " " and resid 14 and name H ))
(( segid " " and resid 13 and name HB2 ))
ASSI { 89}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 15 and name HA ))
2.300 0.700 0.700 peak 89 spectrum 1 weight 0.10000E+01 volume 0.61842E-02 ppm1 8.277 ppm2 4.201 CV 1
OR { 89}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 13 and name HA ))
ASSI { 92}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 14 and name HG2 ))
4.500 2.500 1.500 peak 92 spectrum 1 weight 0.10000E+01 volume 0.91864E-03 ppm1 8.279 ppm2 2.862 CV 1
OR { 92}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 93}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 14 and name HB2 ))
2.800 1.000 1.000 peak 93 spectrum 1 weight 0.10000E+01 volume 0.33576E-02 ppm1 8.276 ppm2 2.400 CV 1
OR { 93}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 13 and name HB3 ))
OR { 93}
(( segid " " and resid 15 and name H ))
(( segid " " and resid 13 and name HB2 ))
ASSI { 100}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 13 and name HA ))
3.000 1.100 1.100 peak 100 spectrum 1 weight 0.10000E+01 volume 0.18956E-02 ppm1 7.987 ppm2 4.225 CV 1
OR { 100}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 15 and name HA ))
ASSI { 103}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 13 and name HG3 ))
3.900 1.900 1.900 peak 103 spectrum 1 weight 0.10000E+01 volume 0.11878E-02 ppm1 7.987 ppm2 2.393 CV 1
OR { 103}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 14 and name HB2 ))
OR { 103}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 13 and name HB3 ))
OR { 103}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 13 and name HB2 ))
OR { 103}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 19 and name HG3 ))
ASSI { 110}
(( segid " " and resid 16 and name H ))
( segid " " and resid 40 and name HD1%)
4.300 2.300 1.700 peak 110 spectrum 1 weight 0.10000E+01 volume 0.90446E-03 ppm1 7.991 ppm2 0.985 CV 1
OR { 110}
(( segid " " and resid 16 and name H ))
( segid " " and resid 40 and name HD2%)
OR { 110}
(( segid " " and resid 16 and name H ))
( segid " " and resid 36 and name HG2%)
ASSI { 111}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 19 and name HB3 ))
4.100 2.100 1.900 peak 111 spectrum 1 weight 0.10000E+01 volume 0.11965E-02 ppm1 7.981 ppm2 2.202 CV 1
OR { 111}
(( segid " " and resid 16 and name H ))
(( segid " " and resid 17 and name HB3 ))
ASSI { 115}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 15 and name HA ))
4.000 2.000 2.000 peak 115 spectrum 1 weight 0.10000E+01 volume 0.71767E-03 ppm1 8.778 ppm2 4.235 CV 1
OR { 115}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 13 and name HA ))
ASSI { 116}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 14 and name HA ))
2.500 0.800 0.800 peak 116 spectrum 1 weight 0.10000E+01 volume 0.32581E-02 ppm1 8.775 ppm2 3.972 CV 1
OR { 116}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 17 and name HA ))
ASSI { 122}
(( segid " " and resid 17 and name H ))
( segid " " and resid 40 and name HD1%)
3.400 1.400 1.400 peak 122 spectrum 1 weight 0.10000E+01 volume 0.23328E-02 ppm1 8.776 ppm2 0.972 CV 1
OR { 122}
(( segid " " and resid 17 and name H ))
( segid " " and resid 40 and name HD2%)
OR { 122}
(( segid " " and resid 17 and name H ))
( segid " " and resid 36 and name HG2%)
ASSI { 125}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 18 and name H ))
2.700 0.900 0.900 peak 125 spectrum 1 weight 0.10000E+01 volume 0.20345E-02 ppm1 8.776 ppm2 8.309 CV 1
OR { 125}
(( segid " " and resid 17 and name H ))
(( segid " " and resid 15 and name H ))
ASSI { 128}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 17 and name HA ))
3.300 1.300 1.300 peak 128 spectrum 1 weight 0.10000E+01 volume 0.19055E-02 ppm1 8.314 ppm2 3.982 CV 1
OR { 128}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 14 and name HA ))
OR { 128}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 19 and name HA ))
ASSI { 131}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 18 and name HB3 ))
2.300 0.700 0.700 peak 131 spectrum 1 weight 0.10000E+01 volume 0.46343E-02 ppm1 8.313 ppm2 2.089 CV 1
OR { 131}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 14 and name HB3 ))
ASSI { 132}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 17 and name HB2 ))
3.000 1.100 1.100 peak 132 spectrum 1 weight 0.10000E+01 volume 0.44749E-02 ppm1 8.314 ppm2 1.792 CV 1
OR { 132}
(( segid " " and resid 18 and name H ))
(( segid " " and resid 18 and name HB2 ))
ASSI { 133}
(( segid " " and resid 18 and name H ))
( segid " " and resid 36 and name HG2%)
3.900 1.900 1.900 peak 133 spectrum 1 weight 0.10000E+01 volume 0.16502E-02 ppm1 8.314 ppm2 0.957 CV 1
OR { 133}
(( segid " " and resid 18 and name H ))
( segid " " and resid 40 and name HD1%)
OR { 133}
(( segid " " and resid 18 and name H ))
( segid " " and resid 22 and name HD2%)
OR { 133}
(( segid " " and resid 18 and name H ))
( segid " " and resid 22 and name HD1%)
OR { 133}
(( segid " " and resid 18 and name H ))
( segid " " and resid 59 and name HD2%)
ASSI { 142}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 18 and name HB2 ))
3.500 1.600 1.600 peak 142 spectrum 1 weight 0.10000E+01 volume 0.16055E-02 ppm1 7.991 ppm2 1.785 CV 1
OR { 142}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 17 and name HB2 ))
ASSI { 144}
(( segid " " and resid 19 and name H ))
(( segid " " and resid 18 and name HG2 ))
3.100 1.200 1.200 peak 144 spectrum 1 weight 0.10000E+01 volume 0.14854E-02 ppm1 7.989 ppm2 1.614 CV 1
OR { 144}
(( segid " " and resid 19 and name H ))
( segid " " and resid 15 and name HB% )
ASSI { 145}
(( segid " " and resid 19 and name H ))
( segid " " and resid 22 and name HD1%)
4.100 2.100 1.900 peak 145 spectrum 1 weight 0.10000E+01 volume 0.93116E-03 ppm1 7.983 ppm2 0.955 CV 1
OR { 145}
(( segid " " and resid 19 and name H ))
( segid " " and resid 22 and name HD2%)
OR { 145}
(( segid " " and resid 19 and name H ))
( segid " " and resid 36 and name HG2%)
OR { 145}
(( segid " " and resid 19 and name H ))
( segid " " and resid 36 and name HD1%)
OR { 145}
(( segid " " and resid 19 and name H ))
( segid " " and resid 59 and name HD2%)
ASSI { 146}
(( segid " " and resid 19 and name H ))
( segid " " and resid 59 and name HD2%)
4.900 3.000 1.100 peak 146 spectrum 1 weight 0.10000E+01 volume 0.58473E-03 ppm1 7.992 ppm2 0.884 CV 1
OR { 146}
(( segid " " and resid 19 and name H ))
( segid " " and resid 50 and name HG2%)
ASSI { 150}
(( segid " " and resid 63 and name H ))
(( segid " " and resid 62 and name HB2 ))
2.500 0.800 0.800 peak 150 spectrum 1 weight 0.10000E+01 volume 0.61969E-02 ppm1 8.670 ppm2 3.983 CV 1
OR { 150}
(( segid " " and resid 63 and name H ))
(( segid " " and resid 63 and name HA ))
ASSI { 153}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 20 and name HB3 ))
3.400 1.400 1.400 peak 153 spectrum 1 weight 0.10000E+01 volume 0.18674E-02 ppm1 8.677 ppm2 2.059 CV 1
OR { 153}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 36 and name HG13))
ASSI { 154}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 20 and name HG ))
3.800 1.800 1.800 peak 154 spectrum 1 weight 0.10000E+01 volume 0.22794E-02 ppm1 8.676 ppm2 1.677 CV 1
OR { 154}
(( segid " " and resid 20 and name H ))
(( segid " " and resid 18 and name HG3 ))
ASSI { 157}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 21 and name HA ))
2.700 0.900 0.900 peak 157 spectrum 1 weight 0.10000E+01 volume 0.26514E-02 ppm1 8.941 ppm2 4.004 CV 1
OR { 157}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 20 and name HA ))
ASSI { 160}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 20 and name HB3 ))
3.100 1.200 1.200 peak 160 spectrum 1 weight 0.10000E+01 volume 0.14313E-02 ppm1 8.941 ppm2 2.075 CV 1
OR { 160}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 36 and name HG13))
OR { 160}
(( segid " " and resid 21 and name H ))
(( segid " " and resid 22 and name HG ))
ASSI { 161}
(( segid " " and resid 21 and name H ))
( segid " " and resid 36 and name HD1%)
3.300 1.400 1.400 peak 161 spectrum 1 weight 0.10000E+01 volume 0.25653E-02 ppm1 8.942 ppm2 0.954 CV 1
OR { 161}
(( segid " " and resid 21 and name H ))
( segid " " and resid 36 and name HG2%)
OR { 161}
(( segid " " and resid 21 and name H ))
( segid " " and resid 22 and name HD2%)
OR { 161}
(( segid " " and resid 21 and name H ))
( segid " " and resid 22 and name HD1%)
ASSI { 167}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 21 and name HA ))
3.400 1.400 1.400 peak 167 spectrum 1 weight 0.10000E+01 volume 0.10763E-02 ppm1 8.556 ppm2 4.019 CV 1
OR { 167}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 19 and name HA ))
ASSI { 172}
(( segid " " and resid 22 and name H ))
(( segid " " and resid 22 and name HB3 ))
3.500 1.600 1.600 peak 172 spectrum 1 weight 0.10000E+01 volume 0.19491E-02 ppm1 8.556 ppm2 1.444 CV 1
OR { 172}
(( segid " " and resid 22 and name H ))
( segid " " and resid 23 and name HB% )
ASSI { 177}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 20 and name HA ))
2.900 1.100 1.100 peak 177 spectrum 1 weight 0.10000E+01 volume 0.23529E-02 ppm1 7.851 ppm2 3.994 CV 1
OR { 177}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 21 and name HA ))
OR { 177}
(( segid " " and resid 23 and name H ))
(( segid " " and resid 19 and name HA ))
ASSI { 185}
(( segid " " and resid 23 and name H ))
( segid " " and resid 22 and name HD2%)
3.300 1.400 1.400 peak 185 spectrum 1 weight 0.10000E+01 volume 0.32120E-02 ppm1 7.846 ppm2 0.951 CV 1
OR { 185}
(( segid " " and resid 23 and name H ))
( segid " " and resid 36 and name HD1%)
ASSI { 191}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 21 and name HA ))
3.300 1.400 1.400 peak 191 spectrum 1 weight 0.10000E+01 volume 0.10882E-02 ppm1 7.280 ppm2 4.001 CV 1
OR { 191}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 20 and name HA ))
OR { 191}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 32 and name HA ))
ASSI { 201}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 22 and name H ))
4.000 2.000 2.000 peak 201 spectrum 1 weight 0.10000E+01 volume 0.87079E-03 ppm1 7.281 ppm2 8.554 CV 1
OR { 201}
(( segid " " and resid 24 and name H ))
(( segid " " and resid 26 and name H ))
ASSI { 205}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 21 and name HA ))
3.800 1.800 1.800 peak 205 spectrum 1 weight 0.10000E+01 volume 0.76505E-03 ppm1 8.052 ppm2 3.979 CV 1
OR { 205}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 32 and name HA ))
ASSI { 206}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 24 and name HB2 ))
4.000 2.000 2.000 peak 206 spectrum 1 weight 0.10000E+01 volume 0.80463E-03 ppm1 8.050 ppm2 2.475 CV 1
OR { 206}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 26 and name HB3 ))
ASSI { 214}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 24 and name H ))
2.800 0.900 0.900 peak 214 spectrum 1 weight 0.10000E+01 volume 0.24667E-02 ppm1 8.045 ppm2 7.283 CV 1
OR { 214}
(( segid " " and resid 25 and name H ))
(( segid " " and resid 27 and name H ))
ASSI { 216}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 113 and name HB2 ))
4.500 2.500 1.500 peak 216 spectrum 1 weight 0.10000E+01 volume 0.62064E-03 ppm1 8.536 ppm2 2.240 CV 1
OR { 216}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 113 and name HB3 ))
OR { 216}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 114 and name HB ))
ASSI { 217}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 113 and name HB2 ))
4.500 2.600 1.500 peak 217 spectrum 1 weight 0.10000E+01 volume 0.62290E-03 ppm1 8.534 ppm2 2.173 CV 1
OR { 217}
(( segid " " and resid 112 and name H ))
( segid " " and resid 102 and name HE% )
OR { 217}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 113 and name HB3 ))
ASSI { 218}
(( segid " " and resid 26 and name H ))
( segid " " and resid 27 and name HG1%)
3.700 1.700 1.700 peak 218 spectrum 1 weight 0.10000E+01 volume 0.19355E-02 ppm1 8.538 ppm2 0.936 CV 1
OR { 218}
(( segid " " and resid 112 and name H ))
( segid " " and resid 115 and name HG2%)
ASSI { 219}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 25 and name HA ))
3.100 1.200 1.200 peak 219 spectrum 1 weight 0.10000E+01 volume 0.20328E-02 ppm1 8.546 ppm2 3.861 CV 1
OR { 219}
(( segid " " and resid 26 and name H ))
(( segid " " and resid 27 and name HA ))
ASSI { 233}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 26 and name HB3 ))
4.200 2.200 1.800 peak 233 spectrum 1 weight 0.10000E+01 volume 0.89966E-03 ppm1 7.303 ppm2 2.492 CV 1
OR { 233}
(( segid " " and resid 27 and name H ))
(( segid " " and resid 24 and name HB2 ))
ASSI { 246}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 27 and name HA ))
2.700 2.700 3.300 peak 246 spectrum 1 weight 0.10000E+01 volume 0.84275E-03 ppm1 8.853 ppm2 3.886 CV 1
OR { 246}
(( segid " " and resid 29 and name H ))
(( segid " " and resid 25 and name HA ))
ASSI { 253}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 29 and name HA2 ))
3.200 1.300 1.300 peak 253 spectrum 1 weight 0.10000E+01 volume 0.20691E-02 ppm1 7.495 ppm2 4.099 CV 1
OR { 253}
(( segid " " and resid 30 and name H ))
(( segid " " and resid 28 and name HA ))
ASSI { 284}
(( segid " " and resid 32 and name H ))
( segid " " and resid 33 and name HG1%)
4.300 2.300 1.700 peak 284 spectrum 1 weight 0.10000E+01 volume 0.68997E-03 ppm1 9.099 ppm2 0.944 CV 1
OR { 284}
(( segid " " and resid 32 and name H ))
( segid " " and resid 27 and name HG1%)
OR { 284}
(( segid " " and resid 32 and name H ))
( segid " " and resid 36 and name HD1%)
OR { 284}
(( segid " " and resid 32 and name H ))
( segid " " and resid 33 and name HG2%)
ASSI { 286}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 32 and name HA ))
3.500 1.600 1.600 peak 286 spectrum 1 weight 0.10000E+01 volume 0.11405E-02 ppm1 7.982 ppm2 3.966 CV 1
OR { 286}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 34 and name HA ))
OR { 286}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 21 and name HA ))
ASSI { 288}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 33 and name HB ))
2.600 0.800 0.800 peak 288 spectrum 1 weight 0.10000E+01 volume 0.31399E-02 ppm1 7.981 ppm2 2.337 CV 1
OR { 288}
(( segid " " and resid 33 and name H ))
(( segid " " and resid 32 and name HB ))
ASSI { 292}
(( segid " " and resid 33 and name H ))
( segid " " and resid 33 and name HG1%)
2.400 0.700 0.700 peak 292 spectrum 1 weight 0.10000E+01 volume 0.54785E-02 ppm1 7.982 ppm2 0.946 CV 1
OR { 292}
(( segid " " and resid 33 and name H ))
( segid " " and resid 33 and name HG2%)
OR { 292}
(( segid " " and resid 33 and name H ))
( segid " " and resid 36 and name HD1%)
ASSI { 304}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 34 and name HA ))
2.700 0.900 0.900 peak 304 spectrum 1 weight 0.10000E+01 volume 0.31582E-02 ppm1 7.876 ppm2 3.978 CV 1
OR { 304}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 32 and name HA ))
ASSI { 307}
(( segid " " and resid 132 and name H ))
(( segid " " and resid 131 and name HB2 ))
3.700 1.700 1.700 peak 307 spectrum 1 weight 0.10000E+01 volume 0.24447E-02 ppm1 7.871 ppm2 2.834 CV 1
OR { 307}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 31 and name HB3 ))
ASSI { 312}
(( segid " " and resid 35 and name H ))
( segid " " and resid 33 and name HG1%)
3.400 1.400 1.400 peak 312 spectrum 1 weight 0.10000E+01 volume 0.33617E-02 ppm1 7.876 ppm2 0.956 CV 1
OR { 312}
(( segid " " and resid 35 and name H ))
( segid " " and resid 36 and name HD1%)
OR { 312}
(( segid " " and resid 35 and name H ))
( segid " " and resid 36 and name HG2%)
ASSI { 314}
(( segid " " and resid 132 and name H ))
(( segid " " and resid 131 and name H ))
3.100 1.200 1.200 peak 314 spectrum 1 weight 0.10000E+01 volume 0.49476E-02 ppm1 7.873 ppm2 7.420 CV 1
OR { 314}
(( segid " " and resid 35 and name H ))
(( segid " " and resid 39 and name HD2 ))
ASSI { 315}
(( segid " " and resid 132 and name H ))
( segid " " and resid 131 and name HD% )
2.700 2.700 3.300 peak 315 spectrum 1 weight 0.10000E+01 volume 0.14132E-02 ppm1 7.873 ppm2 7.131 CV 1
OR { 315}
(( segid " " and resid 35 and name H ))
( segid " " and resid 66 and name HE% )
ASSI { 321}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 34 and name HA ))
3.800 1.800 1.800 peak 321 spectrum 1 weight 0.10000E+01 volume 0.84389E-03 ppm1 8.112 ppm2 3.967 CV 1
OR { 321}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 32 and name HA ))
OR { 321}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 37 and name HA ))
OR { 321}
(( segid " " and resid 36 and name H ))
(( segid " " and resid 21 and name HA ))
ASSI { 327}
(( segid " " and resid 36 and name H ))
( segid " " and resid 36 and name HD1%)
3.000 1.200 1.200 peak 327 spectrum 1 weight 0.10000E+01 volume 0.50852E-02 ppm1 8.112 ppm2 0.979 CV 1
OR { 327}
(( segid " " and resid 36 and name H ))
( segid " " and resid 36 and name HG2%)
OR { 327}
(( segid " " and resid 36 and name H ))
( segid " " and resid 33 and name HG2%)
ASSI { 328}
(( segid " " and resid 36 and name H ))
( segid " " and resid 51 and name HD1%)
4.900 3.000 1.100 peak 328 spectrum 1 weight 0.10000E+01 volume 0.70905E-03 ppm1 8.116 ppm2 0.750 CV 1
OR { 328}
(( segid " " and resid 36 and name H ))
( segid " " and resid 17 and name HD2%)
ASSI { 332}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 37 and name HA ))
2.700 0.900 0.900 peak 332 spectrum 1 weight 0.10000E+01 volume 0.23478E-02 ppm1 8.591 ppm2 3.944 CV 1
OR { 332}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 34 and name HA ))
ASSI { 335}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 50 and name HG12))
3.100 1.200 1.200 peak 335 spectrum 1 weight 0.10000E+01 volume 0.26483E-02 ppm1 8.593 ppm2 1.566 CV 1
OR { 335}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 37 and name HB2 ))
OR { 335}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 50 and name HG13))
ASSI { 337}
(( segid " " and resid 37 and name H ))
( segid " " and resid 50 and name HG2%)
2.400 0.700 0.700 peak 337 spectrum 1 weight 0.10000E+01 volume 0.40832E-02 ppm1 8.592 ppm2 0.931 CV 1
OR { 337}
(( segid " " and resid 37 and name H ))
( segid " " and resid 33 and name HG2%)
ASSI { 339}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 37 and name HB3 ))
2.600 0.800 0.800 peak 339 spectrum 1 weight 0.10000E+01 volume 0.28376E-02 ppm1 8.591 ppm2 1.854 CV 1
OR { 339}
(( segid " " and resid 37 and name H ))
(( segid " " and resid 47 and name HB3 ))
ASSI { 348}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 37 and name HB3 ))
3.400 1.400 1.400 peak 348 spectrum 1 weight 0.10000E+01 volume 0.20341E-02 ppm1 7.592 ppm2 1.860 CV 1
OR { 348}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 349}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 37 and name HB2 ))
3.200 1.300 1.300 peak 349 spectrum 1 weight 0.10000E+01 volume 0.23685E-02 ppm1 7.593 ppm2 1.555 CV 1
OR { 349}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 50 and name HG12))
OR { 349}
(( segid " " and resid 38 and name H ))
(( segid " " and resid 50 and name HG13))
ASSI { 351}
(( segid " " and resid 38 and name H ))
( segid " " and resid 36 and name HG2%)
3.500 1.500 1.500 peak 351 spectrum 1 weight 0.10000E+01 volume 0.20401E-02 ppm1 7.592 ppm2 0.937 CV 1
OR { 351}
(( segid " " and resid 38 and name H ))
( segid " " and resid 50 and name HG2%)
OR { 351}
(( segid " " and resid 38 and name H ))
( segid " " and resid 50 and name HD1%)
ASSI { 363}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 40 and name HB3 ))
4.200 2.200 1.800 peak 363 spectrum 1 weight 0.10000E+01 volume 0.10964E-02 ppm1 7.537 ppm2 1.545 CV 1
OR { 363}
(( segid " " and resid 39 and name H ))
(( segid " " and resid 37 and name HB2 ))
ASSI { 365}
(( segid " " and resid 39 and name H ))
( segid " " and resid 36 and name HG2%)
4.200 2.200 1.800 peak 365 spectrum 1 weight 0.10000E+01 volume 0.96964E-03 ppm1 7.541 ppm2 0.958 CV 1
OR { 365}
(( segid " " and resid 39 and name H ))
( segid " " and resid 40 and name HD2%)
OR { 365}
(( segid " " and resid 39 and name H ))
( segid " " and resid 40 and name HD1%)
ASSI { 398}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 40 and name HA ))
4.000 2.000 2.000 peak 398 spectrum 1 weight 0.10000E+01 volume 0.78627E-03 ppm1 8.182 ppm2 4.427 CV 1
OR { 398}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 43 and name HA ))
ASSI { 400}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 40 and name HG ))
4.000 2.000 2.000 peak 400 spectrum 1 weight 0.10000E+01 volume 0.52098E-03 ppm1 8.178 ppm2 1.902 CV 1
OR { 400}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 40 and name HB2 ))
OR { 400}
(( segid " " and resid 42 and name H ))
(( segid " " and resid 43 and name HB ))
ASSI { 407}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 43 and name HB ))
3.100 1.200 1.200 peak 407 spectrum 1 weight 0.10000E+01 volume 0.30039E-02 ppm1 7.980 ppm2 1.905 CV 1
OR { 407}
(( segid " " and resid 43 and name H ))
(( segid " " and resid 40 and name HG ))
ASSI { 430}
(( segid " " and resid 47 and name H ))
( segid " " and resid 50 and name HD1%)
4.200 2.200 1.800 peak 430 spectrum 1 weight 0.10000E+01 volume 0.97402E-03 ppm1 9.008 ppm2 0.926 CV 1
OR { 430}
(( segid " " and resid 47 and name H ))
( segid " " and resid 50 and name HG2%)
OR { 430}
(( segid " " and resid 47 and name H ))
( segid " " and resid 33 and name HG2%)
ASSI { 433}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 48 and name HB2 ))
2.600 0.900 0.900 peak 433 spectrum 1 weight 0.10000E+01 volume 0.73754E-02 ppm1 8.341 ppm2 1.727 CV 1
OR { 433}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 48 and name HD3 ))
OR { 433}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name HG3 ))
ASSI { 438}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 48 and name HB3 ))
2.100 0.600 0.600 peak 438 spectrum 1 weight 0.10000E+01 volume 0.81660E-02 ppm1 8.337 ppm2 1.861 CV 1
OR { 438}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name HB3 ))
OR { 438}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name HB2 ))
ASSI { 439}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 48 and name HG3 ))
3.600 1.700 1.700 peak 439 spectrum 1 weight 0.10000E+01 volume 0.25779E-02 ppm1 8.338 ppm2 1.518 CV 1
OR { 439}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 47 and name HG2 ))
ASSI { 440}
(( segid " " and resid 48 and name H ))
( segid " " and resid 33 and name HG2%)
4.300 2.300 1.700 peak 440 spectrum 1 weight 0.10000E+01 volume 0.98880E-03 ppm1 8.337 ppm2 0.945 CV 1
OR { 440}
(( segid " " and resid 48 and name H ))
( segid " " and resid 63 and name HG2%)
OR { 440}
(( segid " " and resid 48 and name H ))
( segid " " and resid 50 and name HG2%)
OR { 440}
(( segid " " and resid 48 and name H ))
( segid " " and resid 33 and name HG1%)
ASSI { 442}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 50 and name H ))
3.600 1.700 1.700 peak 442 spectrum 1 weight 0.10000E+01 volume 0.12307E-02 ppm1 8.337 ppm2 8.232 CV 1
OR { 442}
(( segid " " and resid 48 and name H ))
(( segid " " and resid 51 and name H ))
ASSI { 449}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 48 and name HB3 ))
2.900 1.100 1.100 peak 449 spectrum 1 weight 0.10000E+01 volume 0.21641E-02 ppm1 7.713 ppm2 1.859 CV 1
OR { 449}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 47 and name HB2 ))
ASSI { 450}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 48 and name HB2 ))
3.200 1.300 1.300 peak 450 spectrum 1 weight 0.10000E+01 volume 0.35003E-02 ppm1 7.716 ppm2 1.706 CV 1
OR { 450}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 45 and name HB2 ))
OR { 450}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 45 and name HB3 ))
ASSI { 452}
(( segid " " and resid 49 and name H ))
( segid " " and resid 33 and name HG2%)
4.200 2.200 1.800 peak 452 spectrum 1 weight 0.10000E+01 volume 0.10126E-02 ppm1 7.714 ppm2 0.966 CV 1
OR { 452}
(( segid " " and resid 49 and name H ))
( segid " " and resid 63 and name HG2%)
OR { 452}
(( segid " " and resid 49 and name H ))
( segid " " and resid 33 and name HG1%)
OR { 452}
(( segid " " and resid 49 and name H ))
( segid " " and resid 36 and name HG2%)
OR { 452}
(( segid " " and resid 49 and name H ))
( segid " " and resid 40 and name HD2%)
ASSI { 456}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 50 and name H ))
2.700 0.900 0.900 peak 456 spectrum 1 weight 0.10000E+01 volume 0.28203E-02 ppm1 7.712 ppm2 8.211 CV 1
OR { 456}
(( segid " " and resid 49 and name H ))
(( segid " " and resid 51 and name H ))
ASSI { 459}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 50 and name HB ))
2.300 0.700 0.700 peak 459 spectrum 1 weight 0.10000E+01 volume 0.33162E-02 ppm1 8.202 ppm2 2.195 CV 1
OR { 459}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 49 and name HB3 ))
OR { 459}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 49 and name HB2 ))
ASSI { 460}
(( segid " " and resid 108 and name H ))
(( segid " " and resid 108 and name HG2 ))
2.500 0.800 0.800 peak 460 spectrum 1 weight 0.10000E+01 volume 0.58259E-02 ppm1 8.195 ppm2 1.493 CV 1
OR { 460}
(( segid " " and resid 50 and name H ))
(( segid " " and resid 45 and name HG2 ))
ASSI { 465}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 50 and name HA ))
3.700 1.700 1.700 peak 465 spectrum 1 weight 0.10000E+01 volume 0.52088E-03 ppm1 8.228 ppm2 3.782 CV 1
OR { 465}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 47 and name HA ))
ASSI { 468}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 50 and name HB ))
3.000 1.100 1.100 peak 468 spectrum 1 weight 0.10000E+01 volume 0.13183E-02 ppm1 8.220 ppm2 2.185 CV 1
OR { 468}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 49 and name HB3 ))
OR { 468}
(( segid " " and resid 51 and name H ))
(( segid " " and resid 49 and name HB2 ))
ASSI { 471}
(( segid " " and resid 51 and name H ))
( segid " " and resid 50 and name HG2%)
3.000 1.100 1.100 peak 471 spectrum 1 weight 0.10000E+01 volume 0.28739E-02 ppm1 8.222 ppm2 0.930 CV 1
OR { 471}
(( segid " " and resid 51 and name H ))
( segid " " and resid 33 and name HG2%)
OR { 471}
(( segid " " and resid 51 and name H ))
( segid " " and resid 33 and name HG1%)
ASSI { 479}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 48 and name HA ))
3.800 1.800 1.800 peak 479 spectrum 1 weight 0.10000E+01 volume 0.12652E-02 ppm1 8.229 ppm2 3.910 CV 1
OR { 479}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 63 and name HA ))
ASSI { 482}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 53 and name HB2 ))
3.900 1.900 1.900 peak 482 spectrum 1 weight 0.10000E+01 volume 0.78968E-03 ppm1 8.229 ppm2 2.195 CV 1
OR { 482}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 49 and name HB3 ))
OR { 482}
(( segid " " and resid 52 and name H ))
(( segid " " and resid 56 and name HG2 ))
ASSI { 484}
(( segid " " and resid 52 and name H ))
( segid " " and resid 50 and name HG2%)
3.600 1.600 1.600 peak 484 spectrum 1 weight 0.10000E+01 volume 0.15235E-02 ppm1 8.228 ppm2 0.928 CV 1
OR { 484}
(( segid " " and resid 52 and name H ))
( segid " " and resid 33 and name HG2%)
OR { 484}
(( segid " " and resid 52 and name H ))
( segid " " and resid 63 and name HG2%)
OR { 484}
(( segid " " and resid 52 and name H ))
( segid " " and resid 33 and name HG1%)
ASSI { 485}
(( segid " " and resid 52 and name H ))
( segid " " and resid 50 and name HG2%)
3.200 1.300 1.300 peak 485 spectrum 1 weight 0.10000E+01 volume 0.17344E-02 ppm1 8.228 ppm2 0.864 CV 1
OR { 485}
(( segid " " and resid 52 and name H ))
( segid " " and resid 55 and name HG1%)
ASSI { 486}
(( segid " " and resid 52 and name H ))
( segid " " and resid 51 and name HD1%)
3.400 1.500 1.500 peak 486 spectrum 1 weight 0.10000E+01 volume 0.28483E-02 ppm1 8.227 ppm2 0.748 CV 1
OR { 486}
(( segid " " and resid 52 and name H ))
( segid " " and resid 55 and name HG2%)
ASSI { 490}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 53 and name HA ))
2.600 0.900 0.900 peak 490 spectrum 1 weight 0.10000E+01 volume 0.31604E-02 ppm1 8.140 ppm2 4.021 CV 1
OR { 490}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 52 and name HA ))
ASSI { 491}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 50 and name HA ))
3.400 1.400 1.400 peak 491 spectrum 1 weight 0.10000E+01 volume 0.77495E-03 ppm1 8.138 ppm2 3.792 CV 1
OR { 491}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 56 and name HA ))
ASSI { 496}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 54 and name HB3 ))
4.500 2.500 1.500 peak 496 spectrum 1 weight 0.10000E+01 volume 0.80555E-03 ppm1 8.150 ppm2 1.937 CV 1
OR { 496}
(( segid " " and resid 53 and name H ))
( segid " " and resid 57 and name HE% )
ASSI { 498}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 56 and name HB2 ))
3.700 1.700 1.700 peak 498 spectrum 1 weight 0.10000E+01 volume 0.14711E-02 ppm1 8.143 ppm2 1.720 CV 1
OR { 498}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 54 and name HG ))
ASSI { 500}
(( segid " " and resid 53 and name H ))
( segid " " and resid 17 and name HD2%)
3.700 1.700 1.700 peak 500 spectrum 1 weight 0.10000E+01 volume 0.15514E-02 ppm1 8.143 ppm2 0.764 CV 1
OR { 500}
(( segid " " and resid 53 and name H ))
(( segid " " and resid 54 and name HB2 ))
ASSI { 503}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 53 and name HA ))
3.100 1.200 1.200 peak 503 spectrum 1 weight 0.10000E+01 volume 0.14954E-02 ppm1 8.303 ppm2 4.017 CV 1
OR { 503}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 52 and name HA ))
ASSI { 504}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 50 and name HA ))
3.600 1.600 1.600 peak 504 spectrum 1 weight 0.10000E+01 volume 0.90005E-03 ppm1 8.306 ppm2 3.768 CV 1
OR { 504}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 56 and name HA ))
ASSI { 507}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 53 and name HB2 ))
3.100 1.200 1.200 peak 507 spectrum 1 weight 0.10000E+01 volume 0.12455E-02 ppm1 8.303 ppm2 2.197 CV 1
OR { 507}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 56 and name HG2 ))
ASSI { 510}
(( segid " " and resid 54 and name H ))
( segid " " and resid 17 and name HD1%)
4.000 2.000 2.000 peak 510 spectrum 1 weight 0.10000E+01 volume 0.10857E-02 ppm1 8.304 ppm2 1.042 CV 1
OR { 510}
(( segid " " and resid 54 and name H ))
( segid " " and resid 36 and name HD1%)
ASSI { 511}
(( segid " " and resid 54 and name H ))
(( segid " " and resid 54 and name HB2 ))
2.300 0.700 0.700 peak 511 spectrum 1 weight 0.10000E+01 volume 0.46765E-02 ppm1 8.306 ppm2 0.751 CV 1
OR { 511}
(( segid " " and resid 54 and name H ))
( segid " " and resid 17 and name HD2%)
ASSI { 516}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 55 and name HA ))
2.800 1.000 1.000 peak 516 spectrum 1 weight 0.10000E+01 volume 0.25007E-02 ppm1 7.495 ppm2 3.985 CV 1
OR { 516}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 52 and name HA ))
ASSI { 518}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 54 and name HG ))
4.100 2.100 1.900 peak 518 spectrum 1 weight 0.10000E+01 volume 0.93162E-03 ppm1 7.503 ppm2 1.758 CV 1
OR { 518}
(( segid " " and resid 55 and name H ))
(( segid " " and resid 56 and name HB2 ))
ASSI { 522}
(( segid " " and resid 56 and name H ))
(( segid " " and resid 55 and name HA ))
3.000 1.100 1.100 peak 522 spectrum 1 weight 0.10000E+01 volume 0.28279E-02 ppm1 8.079 ppm2 4.008 CV 1
OR { 522}
(( segid " " and resid 56 and name H ))
(( segid " " and resid 53 and name HA ))
OR { 522}
(( segid " " and resid 56 and name H ))
(( segid " " and resid 57 and name HA ))
ASSI { 524}
(( segid " " and resid 56 and name H ))
(( segid " " and resid 56 and name HG3 ))
2.500 0.800 0.800 peak 524 spectrum 1 weight 0.10000E+01 volume 0.32656E-02 ppm1 8.084 ppm2 2.137 CV 1
OR { 524}
(( segid " " and resid 56 and name H ))
(( segid " " and resid 57 and name HB2 ))
ASSI { 527}
(( segid " " and resid 56 and name H ))
(( segid " " and resid 57 and name H ))
2.800 1.000 1.000 peak 527 spectrum 1 weight 0.10000E+01 volume 0.16727E-02 ppm1 8.082 ppm2 7.878 CV 1
OR { 527}
(( segid " " and resid 56 and name H ))
(( segid " " and resid 58 and name H ))
ASSI { 539}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 57 and name HA ))
2.700 0.900 0.900 peak 539 spectrum 1 weight 0.10000E+01 volume 0.43632E-02 ppm1 7.869 ppm2 3.976 CV 1
OR { 539}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 53 and name HA ))
ASSI { 544}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 57 and name HB3 ))
2.400 0.700 0.700 peak 544 spectrum 1 weight 0.10000E+01 volume 0.45445E-02 ppm1 7.868 ppm2 1.709 CV 1
OR { 544}
(( segid " " and resid 57 and name H ))
(( segid " " and resid 56 and name HB2 ))
ASSI { 546}
(( segid " " and resid 57 and name H ))
( segid " " and resid 55 and name HG2%)
4.100 2.100 1.900 peak 546 spectrum 1 weight 0.10000E+01 volume 0.14164E-02 ppm1 7.871 ppm2 0.817 CV 1
OR { 546}
(( segid " " and resid 57 and name H ))
( segid " " and resid 55 and name HG1%)
OR { 546}
(( segid " " and resid 57 and name H ))
( segid " " and resid 59 and name HD1%)
ASSI { 551}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 58 and name HA2 ))
2.300 0.700 0.700 peak 551 spectrum 1 weight 0.10000E+01 volume 0.73729E-02 ppm1 7.925 ppm2 3.939 CV 1
OR { 551}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name HA ))
ASSI { 554}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 57 and name HB3 ))
3.900 1.900 1.900 peak 554 spectrum 1 weight 0.10000E+01 volume 0.79594E-03 ppm1 7.923 ppm2 1.714 CV 1
OR { 554}
(( segid " " and resid 58 and name H ))
(( segid " " and resid 56 and name HB2 ))
ASSI { 556}
(( segid " " and resid 58 and name H ))
( segid " " and resid 55 and name HG2%)
4.100 2.100 1.900 peak 556 spectrum 1 weight 0.10000E+01 volume 0.12014E-02 ppm1 7.927 ppm2 0.831 CV 1
OR { 556}
(( segid " " and resid 58 and name H ))
( segid " " and resid 55 and name HG1%)
OR { 556}
(( segid " " and resid 58 and name H ))
( segid " " and resid 59 and name HD1%)
ASSI { 562}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 55 and name HA ))
3.100 1.200 1.200 peak 562 spectrum 1 weight 0.10000E+01 volume 0.34184E-02 ppm1 7.671 ppm2 3.961 CV 1
OR { 562}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 57 and name HA ))
ASSI { 571}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 58 and name H ))
2.500 0.800 0.800 peak 571 spectrum 1 weight 0.10000E+01 volume 0.47228E-02 ppm1 7.668 ppm2 7.917 CV 1
OR { 571}
(( segid " " and resid 59 and name H ))
(( segid " " and resid 57 and name H ))
ASSI { 576}
(( segid " " and resid 60 and name H ))
( segid " " and resid 60 and name HB% )
2.500 0.800 0.800 peak 576 spectrum 1 weight 0.10000E+01 volume 0.45908E-02 ppm1 7.067 ppm2 1.248 CV 1
OR { 576}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 579}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 58 and name H ))
3.400 1.400 1.400 peak 579 spectrum 1 weight 0.10000E+01 volume 0.15146E-02 ppm1 7.070 ppm2 7.912 CV 1
OR { 579}
(( segid " " and resid 60 and name H ))
(( segid " " and resid 57 and name H ))
ASSI { 582}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 60 and name HA ))
2.300 0.600 0.600 peak 582 spectrum 1 weight 0.10000E+01 volume 0.93921E-02 ppm1 8.648 ppm2 4.546 CV 1
OR { 582}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 61 and name HA ))
ASSI { 587}
(( segid " " and resid 61 and name H ))
(( segid " " and resid 60 and name H ))
4.500 2.500 1.500 peak 587 spectrum 1 weight 0.10000E+01 volume 0.55131E-03 ppm1 8.649 ppm2 7.068 CV 1
OR { 587}
(( segid " " and resid 61 and name H ))
( segid " " and resid 66 and name HE% )
ASSI { 588}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 62 and name HA ))
2.500 0.800 0.800 peak 588 spectrum 1 weight 0.10000E+01 volume 0.68880E-02 ppm1 7.868 ppm2 4.561 CV 1
OR { 588}
(( segid " " and resid 62 and name H ))
(( segid " " and resid 61 and name HA ))
ASSI { 604}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 62 and name HB2 ))
2.500 0.800 0.800 peak 604 spectrum 1 weight 0.10000E+01 volume 0.46202E-02 ppm1 8.295 ppm2 3.989 CV 1
OR { 604}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 98 and name HA ))
OR { 604}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 100 and name HA ))
ASSI { 605}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 63 and name HB ))
3.300 1.400 1.400 peak 605 spectrum 1 weight 0.10000E+01 volume 0.34117E-02 ppm1 8.300 ppm2 2.238 CV 1
OR { 605}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 609}
(( segid " " and resid 64 and name H ))
( segid " " and resid 63 and name HG1%)
2.500 0.800 0.800 peak 609 spectrum 1 weight 0.10000E+01 volume 0.84560E-02 ppm1 8.299 ppm2 0.971 CV 1
OR { 609}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 100 and name HB3 ))
OR { 609}
(( segid " " and resid 101 and name H ))
( segid " " and resid 101 and name HD1%)
OR { 609}
(( segid " " and resid 101 and name H ))
( segid " " and resid 101 and name HG2%)
ASSI { 613}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 102 and name HG2 ))
4.400 2.400 1.600 peak 613 spectrum 1 weight 0.10000E+01 volume 0.48680E-03 ppm1 8.287 ppm2 2.706 CV 1
OR { 613}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 91 and name HB3 ))
OR { 613}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 61 and name HB3 ))
ASSI { 615}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 62 and name H ))
3.700 1.700 1.700 peak 615 spectrum 1 weight 0.10000E+01 volume 0.96592E-03 ppm1 8.298 ppm2 7.826 CV 1
OR { 615}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 99 and name H ))
OR { 615}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 67 and name H ))
ASSI { 616}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 100 and name H ))
2.300 0.700 0.700 peak 616 spectrum 1 weight 0.10000E+01 volume 0.41689E-02 ppm1 8.294 ppm2 7.708 CV 1
OR { 616}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 65 and name H ))
ASSI { 617}
(( segid " " and resid 64 and name H ))
(( segid " " and resid 66 and name H ))
4.100 2.100 1.900 peak 617 spectrum 1 weight 0.10000E+01 volume 0.35343E-03 ppm1 8.287 ppm2 7.505 CV 1
OR { 617}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 103 and name H ))
ASSI { 618}
(( segid " " and resid 64 and name H ))
( segid " " and resid 66 and name HE% )
4.500 2.500 1.500 peak 618 spectrum 1 weight 0.10000E+01 volume 0.48613E-03 ppm1 8.300 ppm2 7.087 CV 1
OR { 618}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 100 and name HD2 ))
OR { 618}
(( segid " " and resid 101 and name H ))
( segid " " and resid 91 and name HD% )
ASSI { 620}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 62 and name HA ))
3.800 1.800 1.800 peak 620 spectrum 1 weight 0.10000E+01 volume 0.15380E-02 ppm1 7.702 ppm2 4.560 CV 1
OR { 620}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 66 and name HA ))
OR { 620}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 60 and name HA ))
ASSI { 629}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 63 and name H ))
4.500 2.500 1.500 peak 629 spectrum 1 weight 0.10000E+01 volume 0.61645E-03 ppm1 7.707 ppm2 8.666 CV 1
OR { 629}
(( segid " " and resid 65 and name H ))
(( segid " " and resid 61 and name H ))
ASSI { 632}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 65 and name HA ))
3.100 1.200 1.200 peak 632 spectrum 1 weight 0.10000E+01 volume 0.21444E-02 ppm1 7.516 ppm2 4.420 CV 1
OR { 632}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 67 and name HA ))
ASSI { 637}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 65 and name HB3 ))
2.900 1.000 1.000 peak 637 spectrum 1 weight 0.10000E+01 volume 0.20998E-02 ppm1 7.519 ppm2 2.413 CV 1
OR { 637}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 67 and name HG2 ))
OR { 637}
(( segid " " and resid 66 and name H ))
(( segid " " and resid 67 and name HG3 ))
ASSI { 639}
(( segid " " and resid 66 and name H ))
( segid " " and resid 63 and name HG2%)
5.300 3.500 0.700 peak 639 spectrum 1 weight 0.10000E+01 volume 0.69202E-03 ppm1 7.511 ppm2 0.939 CV 1
OR { 639}
(( segid " " and resid 66 and name H ))
( segid " " and resid 33 and name HG1%)
OR { 639}
(( segid " " and resid 66 and name H ))
( segid " " and resid 33 and name HG2%)
ASSI { 646}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 67 and name HG2 ))
2.600 0.900 0.900 peak 646 spectrum 1 weight 0.10000E+01 volume 0.44768E-02 ppm1 7.803 ppm2 2.424 CV 1
OR { 646}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 67 and name HG3 ))
OR { 646}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 65 and name HB3 ))
ASSI { 649}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 64 and name HD2 ))
4.400 2.400 1.600 peak 649 spectrum 1 weight 0.10000E+01 volume 0.54005E-03 ppm1 7.801 ppm2 1.650 CV 1
OR { 649}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 64 and name HD3 ))
OR { 649}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 51 and name HB ))
OR { 649}
(( segid " " and resid 67 and name H ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 659}
(( segid " " and resid 67 and name HE22))
( segid " " and resid 63 and name HG2%)
2.500 2.500 3.500 peak 659 spectrum 1 weight 0.10000E+01 volume 0.70455E-03 ppm1 6.949 ppm2 0.959 CV 1
OR { 659}
(( segid " " and resid 67 and name HE22))
( segid " " and resid 33 and name HG1%)
OR { 659}
(( segid " " and resid 67 and name HE22))
( segid " " and resid 33 and name HG2%)
ASSI { 681}
(( segid " " and resid 71 and name H ))
(( segid " " and resid 71 and name HB ))
3.300 1.300 1.300 peak 681 spectrum 1 weight 0.10000E+01 volume 0.17863E-02 ppm1 8.099 ppm2 4.165 CV 1
OR { 681}
(( segid " " and resid 71 and name H ))
(( segid " " and resid 121 and name HA ))
ASSI { 686}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 117 and name HB3 ))
4.200 2.200 1.800 peak 686 spectrum 1 weight 0.10000E+01 volume 0.76200E-03 ppm1 8.164 ppm2 1.595 CV 1
OR { 686}
(( segid " " and resid 73 and name H ))
(( segid " " and resid 121 and name HG ))
ASSI { 695}
(( segid " " and resid 74 and name H ))
(( segid " " and resid 73 and name HA ))
2.300 0.700 0.700 peak 695 spectrum 1 weight 0.10000E+01 volume 0.37884E-02 ppm1 8.396 ppm2 4.137 CV 1
OR { 695}
(( segid " " and resid 74 and name H ))
(( segid " " and resid 74 and name HA ))
ASSI { 705}
(( segid " " and resid 75 and name H ))
( segid " " and resid 75 and name HD1%)
2.800 1.000 1.000 peak 705 spectrum 1 weight 0.10000E+01 volume 0.38106E-02 ppm1 8.394 ppm2 0.898 CV 1
OR { 705}
(( segid " " and resid 75 and name H ))
( segid " " and resid 75 and name HD2%)
OR { 705}
(( segid " " and resid 75 and name H ))
( segid " " and resid 74 and name HG2%)
ASSI { 710}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 76 and name HB2 ))
3.100 1.200 1.200 peak 710 spectrum 1 weight 0.10000E+01 volume 0.17585E-02 ppm1 8.660 ppm2 3.094 CV 1
OR { 710}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 76 and name HB3 ))
OR { 710}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 76 and name HB3 ))
ASSI { 713}
(( segid " " and resid 76 and name H ))
( segid " " and resid 74 and name HG1%)
3.000 1.200 1.200 peak 713 spectrum 1 weight 0.10000E+01 volume 0.24735E-02 ppm1 8.662 ppm2 0.906 CV 1
OR { 713}
(( segid " " and resid 76 and name H ))
( segid " " and resid 74 and name HG2%)
OR { 713}
(( segid " " and resid 81 and name H ))
( segid " " and resid 82 and name HD2%)
ASSI { 715}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 81 and name HG2 ))
3.300 1.400 1.400 peak 715 spectrum 1 weight 0.10000E+01 volume 0.14592E-02 ppm1 8.652 ppm2 2.827 CV 1
OR { 715}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 80 and name HG3 ))
ASSI { 716}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 81 and name HB2 ))
3.100 1.200 1.200 peak 716 spectrum 1 weight 0.10000E+01 volume 0.16914E-02 ppm1 8.649 ppm2 1.779 CV 1
OR { 716}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 73 and name HB ))
ASSI { 718}
(( segid " " and resid 76 and name H ))
(( segid " " and resid 76 and name HD1 ))
3.200 1.300 1.300 peak 718 spectrum 1 weight 0.10000E+01 volume 0.19170E-02 ppm1 8.662 ppm2 7.369 CV 1
OR { 718}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 76 and name HE3 ))
ASSI { 720}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 82 and name H ))
3.100 1.200 1.200 peak 720 spectrum 1 weight 0.10000E+01 volume 0.12722E-02 ppm1 8.650 ppm2 8.148 CV 1
OR { 720}
(( segid " " and resid 81 and name H ))
(( segid " " and resid 83 and name H ))
ASSI { 721}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 74 and name HB ))
4.400 2.500 1.600 peak 721 spectrum 1 weight 0.10000E+01 volume 0.45764E-03 ppm1 10.469 ppm2 2.055 CV 1
OR { 721}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 84 and name HB3 ))
ASSI { 722}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 81 and name HB3 ))
4.200 2.300 1.800 peak 722 spectrum 1 weight 0.10000E+01 volume 0.65489E-03 ppm1 10.472 ppm2 1.959 CV 1
OR { 722}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 113 and name HG2 ))
OR { 722}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 113 and name HG3 ))
OR { 722}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 105 and name HB ))
ASSI { 724}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 109 and name HB2 ))
4.100 2.100 1.900 peak 724 spectrum 1 weight 0.10000E+01 volume 0.59537E-03 ppm1 10.461 ppm2 1.818 CV 1
OR { 724}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 73 and name HB ))
OR { 724}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 84 and name HB2 ))
OR { 724}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 114 and name HG13))
ASSI { 725}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 109 and name HB2 ))
4.100 2.100 1.900 peak 725 spectrum 1 weight 0.10000E+01 volume 0.53664E-03 ppm1 10.468 ppm2 1.795 CV 1
OR { 725}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 73 and name HB ))
OR { 725}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 84 and name HB2 ))
ASSI { 726}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 109 and name HG2 ))
4.100 2.100 1.900 peak 726 spectrum 1 weight 0.10000E+01 volume 0.82354E-03 ppm1 10.471 ppm2 1.401 CV 1
OR { 726}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 105 and name HG13))
ASSI { 727}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 114 and name HG12))
4.500 2.500 1.500 peak 727 spectrum 1 weight 0.10000E+01 volume 0.60973E-03 ppm1 10.470 ppm2 1.274 CV 1
OR { 727}
(( segid " " and resid 76 and name HE1 ))
( segid " " and resid 106 and name HG2%)
ASSI { 730}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 76 and name H ))
4.700 2.800 1.300 peak 730 spectrum 1 weight 0.10000E+01 volume 0.43301E-03 ppm1 10.464 ppm2 8.663 CV 1
OR { 730}
(( segid " " and resid 76 and name HE1 ))
(( segid " " and resid 77 and name H ))
ASSI { 753}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 79 and name HB3 ))
3.900 1.900 1.900 peak 753 spectrum 1 weight 0.10000E+01 volume 0.14850E-02 ppm1 7.888 ppm2 2.693 CV 1
OR { 753}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 80 and name HG2 ))
ASSI { 754}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 80 and name HB3 ))
2.800 1.000 1.000 peak 754 spectrum 1 weight 0.10000E+01 volume 0.23512E-02 ppm1 7.890 ppm2 2.567 CV 1
OR { 754}
(( segid " " and resid 80 and name H ))
(( segid " " and resid 79 and name HB2 ))
ASSI { 760}
(( segid " " and resid 49 and name HE21))
( segid " " and resid 6 and name HB% )
2.600 2.600 3.400 peak 760 spectrum 1 weight 0.10000E+01 volume 0.97923E-03 ppm1 7.057 ppm2 1.315 CV 1
OR { 760}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 48 and name HG2 ))
ASSI { 762}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 46 and name H ))
3.500 1.500 1.500 peak 762 spectrum 1 weight 0.10000E+01 volume 0.98008E-03 ppm1 7.061 ppm2 7.691 CV 1
OR { 762}
(( segid " " and resid 49 and name HE21))
(( segid " " and resid 49 and name H ))
ASSI { 766}
(( segid " " and resid 49 and name HE22))
(( segid " " and resid 46 and name H ))
4.200 2.200 1.800 peak 766 spectrum 1 weight 0.10000E+01 volume 0.76409E-03 ppm1 7.469 ppm2 7.704 CV 1
OR { 766}
(( segid " " and resid 49 and name HE22))
(( segid " " and resid 49 and name H ))
ASSI { 773}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 81 and name HG3 ))
3.200 1.200 1.200 peak 773 spectrum 1 weight 0.10000E+01 volume 0.18031E-02 ppm1 8.151 ppm2 2.465 CV 1
OR { 773}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 83 and name HG3 ))
ASSI { 774}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 83 and name HB3 ))
4.100 2.100 1.900 peak 774 spectrum 1 weight 0.10000E+01 volume 0.15384E-02 ppm1 8.152 ppm2 2.219 CV 1
OR { 774}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 85 and name HB3 ))
ASSI { 775}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 82 and name HB2 ))
2.600 0.800 0.800 peak 775 spectrum 1 weight 0.10000E+01 volume 0.44104E-02 ppm1 8.154 ppm2 1.908 CV 1
OR { 775}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 81 and name HB3 ))
ASSI { 776}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 81 and name HB2 ))
2.700 0.900 0.900 peak 776 spectrum 1 weight 0.10000E+01 volume 0.43512E-02 ppm1 8.152 ppm2 1.817 CV 1
OR { 776}
(( segid " " and resid 82 and name H ))
(( segid " " and resid 82 and name HG ))
ASSI { 781}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 83 and name HA ))
3.100 1.200 1.200 peak 781 spectrum 1 weight 0.10000E+01 volume 0.17829E-02 ppm1 8.104 ppm2 4.060 CV 1
OR { 781}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 64 and name HA ))
ASSI { 784}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 67 and name HB2 ))
3.700 1.700 1.700 peak 784 spectrum 1 weight 0.10000E+01 volume 0.14415E-02 ppm1 8.104 ppm2 2.009 CV 1
OR { 784}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 84 and name HB3 ))
OR { 784}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 86 and name HB2 ))
ASSI { 786}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 69 and name HB2 ))
3.100 1.200 1.200 peak 786 spectrum 1 weight 0.10000E+01 volume 0.19616E-02 ppm1 8.105 ppm2 1.819 CV 1
OR { 786}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 69 and name HB3 ))
OR { 786}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 68 and name HB3 ))
OR { 786}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 68 and name HB2 ))
ASSI { 787}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 64 and name HD2 ))
2.900 1.100 1.100 peak 787 spectrum 1 weight 0.10000E+01 volume 0.22675E-02 ppm1 8.106 ppm2 1.704 CV 1
OR { 787}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 64 and name HD3 ))
OR { 787}
(( segid " " and resid 83 and name H ))
(( segid " " and resid 82 and name HB3 ))
OR { 787}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 68 and name HG3 ))
OR { 787}
(( segid " " and resid 69 and name H ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 788}
(( segid " " and resid 69 and name H ))
( segid " " and resid 63 and name HG1%)
3.100 1.200 1.200 peak 788 spectrum 1 weight 0.10000E+01 volume 0.17495E-02 ppm1 8.103 ppm2 0.985 CV 1
OR { 788}
(( segid " " and resid 83 and name H ))
( segid " " and resid 82 and name HD1%)
OR { 788}
(( segid " " and resid 69 and name H ))
( segid " " and resid 63 and name HG2%)
ASSI { 796}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 83 and name HB3 ))
3.200 1.300 1.300 peak 796 spectrum 1 weight 0.10000E+01 volume 0.13594E-02 ppm1 8.028 ppm2 2.196 CV 1
OR { 796}
(( segid " " and resid 84 and name H ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 797}
(( segid " " and resid 84 and name H ))
( segid " " and resid 84 and name HD1%)
4.000 2.000 2.000 peak 797 spectrum 1 weight 0.10000E+01 volume 0.11007E-02 ppm1 8.025 ppm2 1.063 CV 1
OR { 797}
(( segid " " and resid 84 and name H ))
( segid " " and resid 105 and name HD1%)
OR { 797}
(( segid " " and resid 84 and name H ))
( segid " " and resid 87 and name HD2%)
ASSI { 798}
(( segid " " and resid 84 and name H ))
( segid " " and resid 82 and name HD1%)
4.400 2.400 1.600 peak 798 spectrum 1 weight 0.10000E+01 volume 0.74713E-03 ppm1 8.022 ppm2 0.960 CV 1
OR { 798}
(( segid " " and resid 84 and name H ))
( segid " " and resid 82 and name HD2%)
OR { 798}
(( segid " " and resid 84 and name H ))
( segid " " and resid 101 and name HG2%)
OR { 798}
(( segid " " and resid 84 and name H ))
( segid " " and resid 114 and name HG2%)
ASSI { 801}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 84 and name HA ))
3.300 1.400 1.400 peak 801 spectrum 1 weight 0.10000E+01 volume 0.15273E-02 ppm1 8.133 ppm2 4.126 CV 1
OR { 801}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 86 and name HA ))
ASSI { 807}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 82 and name HB3 ))
4.000 2.000 2.000 peak 807 spectrum 1 weight 0.10000E+01 volume 0.10445E-02 ppm1 8.145 ppm2 1.721 CV 1
OR { 807}
(( segid " " and resid 85 and name H ))
(( segid " " and resid 90 and name HG3 ))
ASSI { 808}
(( segid " " and resid 85 and name H ))
( segid " " and resid 84 and name HD1%)
3.500 1.500 1.500 peak 808 spectrum 1 weight 0.10000E+01 volume 0.15297E-02 ppm1 8.134 ppm2 1.045 CV 1
OR { 808}
(( segid " " and resid 85 and name H ))
( segid " " and resid 87 and name HD2%)
OR { 808}
(( segid " " and resid 85 and name H ))
( segid " " and resid 105 and name HD1%)
ASSI { 809}
(( segid " " and resid 85 and name H ))
( segid " " and resid 84 and name HD2%)
3.600 1.600 1.600 peak 809 spectrum 1 weight 0.10000E+01 volume 0.15428E-02 ppm1 8.133 ppm2 0.606 CV 1
OR { 809}
(( segid " " and resid 85 and name H ))
( segid " " and resid 121 and name HD2%)
ASSI { 813}
(( segid " " and resid 85 and name HE21))
(( segid " " and resid 82 and name HG ))
4.800 2.900 1.200 peak 813 spectrum 1 weight 0.10000E+01 volume 0.43454E-03 ppm1 6.845 ppm2 1.784 CV 1
OR { 813}
(( segid " " and resid 85 and name HE21))
(( segid " " and resid 86 and name HG2 ))
OR { 813}
(( segid " " and resid 85 and name HE21))
(( segid " " and resid 84 and name HB2 ))
ASSI { 816}
(( segid " " and resid 85 and name HE21))
( segid " " and resid 121 and name HD2%)
3.800 1.800 1.800 peak 816 spectrum 1 weight 0.10000E+01 volume 0.94306E-03 ppm1 6.851 ppm2 0.618 CV 1
OR { 816}
(( segid " " and resid 85 and name HE21))
( segid " " and resid 123 and name HD2%)
ASSI { 817}
(( segid " " and resid 85 and name HE21))
( segid " " and resid 73 and name HD1%)
3.300 1.400 1.400 peak 817 spectrum 1 weight 0.10000E+01 volume 0.10583E-02 ppm1 6.856 ppm2 0.806 CV 1
OR { 817}
(( segid " " and resid 85 and name HE21))
( segid " " and resid 123 and name HD1%)
ASSI { 824}
(( segid " " and resid 85 and name HE22))
( segid " " and resid 73 and name HD1%)
3.400 1.400 1.400 peak 824 spectrum 1 weight 0.10000E+01 volume 0.17783E-02 ppm1 7.239 ppm2 0.799 CV 1
OR { 824}
(( segid " " and resid 85 and name HE22))
( segid " " and resid 123 and name HD1%)
ASSI { 825}
(( segid " " and resid 85 and name HE22))
( segid " " and resid 123 and name HD2%)
3.300 1.400 1.400 peak 825 spectrum 1 weight 0.10000E+01 volume 0.13678E-02 ppm1 7.237 ppm2 0.599 CV 1
OR { 825}
(( segid " " and resid 85 and name HE22))
( segid " " and resid 121 and name HD2%)
ASSI { 827}
(( segid " " and resid 85 and name HE22))
(( segid " " and resid 121 and name H ))
4.200 2.200 1.800 peak 827 spectrum 1 weight 0.10000E+01 volume 0.56029E-03 ppm1 7.236 ppm2 8.139 CV 1
OR { 827}
(( segid " " and resid 85 and name HE22))
(( segid " " and resid 71 and name H ))
OR { 827}
(( segid " " and resid 85 and name HE22))
(( segid " " and resid 73 and name H ))
ASSI { 831}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 85 and name HB3 ))
2.300 0.600 0.600 peak 831 spectrum 1 weight 0.10000E+01 volume 0.37946E-02 ppm1 8.379 ppm2 2.216 CV 1
OR { 831}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 835}
(( segid " " and resid 86 and name H ))
( segid " " and resid 87 and name HD2%)
3.600 1.600 1.600 peak 835 spectrum 1 weight 0.10000E+01 volume 0.20940E-02 ppm1 8.385 ppm2 1.031 CV 1
OR { 835}
(( segid " " and resid 86 and name H ))
( segid " " and resid 84 and name HD1%)
OR { 835}
(( segid " " and resid 86 and name H ))
(( segid " " and resid 90 and name HG2 ))
OR { 835}
(( segid " " and resid 86 and name H ))
( segid " " and resid 101 and name HD1%)
OR { 835}
(( segid " " and resid 86 and name H ))
( segid " " and resid 101 and name HG2%)
ASSI { 840}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 84 and name HA ))
3.400 1.500 1.500 peak 840 spectrum 1 weight 0.10000E+01 volume 0.11753E-02 ppm1 8.687 ppm2 4.130 CV 1
OR { 840}
(( segid " " and resid 87 and name H ))
(( segid " " and resid 86 and name HA ))
ASSI { 844}
(( segid " " and resid 87 and name H ))
( segid " " and resid 87 and name HD2%)
3.200 1.300 1.300 peak 844 spectrum 1 weight 0.10000E+01 volume 0.28293E-02 ppm1 8.682 ppm2 1.030 CV 1
OR { 844}
(( segid " " and resid 87 and name H ))
( segid " " and resid 84 and name HD1%)
OR { 844}
(( segid " " and resid 87 and name H ))
( segid " " and resid 101 and name HD1%)
OR { 844}
(( segid " " and resid 87 and name H ))
( segid " " and resid 101 and name HG2%)
ASSI { 850}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 87 and name HB2 ))
3.200 1.300 1.300 peak 850 spectrum 1 weight 0.10000E+01 volume 0.11535E-02 ppm1 8.901 ppm2 2.206 CV 1
OR { 850}
(( segid " " and resid 88 and name H ))
(( segid " " and resid 89 and name HB3 ))
ASSI { 853}
(( segid " " and resid 88 and name H ))
( segid " " and resid 101 and name HD1%)
3.100 1.200 1.200 peak 853 spectrum 1 weight 0.10000E+01 volume 0.31154E-02 ppm1 8.902 ppm2 1.036 CV 1
OR { 853}
(( segid " " and resid 88 and name H ))
( segid " " and resid 84 and name HD1%)
OR { 853}
(( segid " " and resid 88 and name H ))
( segid " " and resid 97 and name HG2%)
OR { 853}
(( segid " " and resid 88 and name H ))
( segid " " and resid 87 and name HD2%)
ASSI { 866}
(( segid " " and resid 89 and name H ))
( segid " " and resid 97 and name HG2%)
4.300 2.400 1.700 peak 866 spectrum 1 weight 0.10000E+01 volume 0.10675E-02 ppm1 8.192 ppm2 1.024 CV 1
OR { 866}
(( segid " " and resid 89 and name H ))
( segid " " and resid 101 and name HD1%)
OR { 866}
(( segid " " and resid 89 and name H ))
(( segid " " and resid 90 and name HG2 ))
OR { 866}
(( segid " " and resid 89 and name H ))
( segid " " and resid 97 and name HG1%)
ASSI { 874}
(( segid " " and resid 90 and name H ))
(( segid " " and resid 90 and name HG2 ))
3.200 1.300 1.300 peak 874 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 7.920 ppm2 1.027 CV 1
OR { 874}
(( segid " " and resid 90 and name H ))
( segid " " and resid 97 and name HG2%)
ASSI { 877}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 90 and name HA ))
3.200 1.300 1.300 peak 877 spectrum 1 weight 0.10000E+01 volume 0.17346E-02 ppm1 7.750 ppm2 3.741 CV 1
OR { 877}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 89 and name HA ))
ASSI { 880}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 97 and name HB ))
4.900 3.000 1.100 peak 880 spectrum 1 weight 0.10000E+01 volume 0.44784E-03 ppm1 7.762 ppm2 2.211 CV 1
OR { 880}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 89 and name HB3 ))
ASSI { 882}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 90 and name HG3 ))
2.500 2.500 3.500 peak 882 spectrum 1 weight 0.10000E+01 volume 0.16285E-02 ppm1 7.745 ppm2 1.711 CV 1
OR { 882}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 98 and name HG ))
OR { 882}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 130 and name HB3 ))
ASSI { 883}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 90 and name HB3 ))
3.700 1.700 1.700 peak 883 spectrum 1 weight 0.10000E+01 volume 0.19594E-02 ppm1 7.752 ppm2 1.487 CV 1
OR { 883}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 92 and name HG3 ))
OR { 883}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 92 and name HB2 ))
ASSI { 884}
(( segid " " and resid 91 and name H ))
( segid " " and resid 97 and name HG2%)
3.000 1.100 1.100 peak 884 spectrum 1 weight 0.10000E+01 volume 0.30214E-02 ppm1 7.750 ppm2 1.025 CV 1
OR { 884}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 90 and name HG2 ))
OR { 884}
(( segid " " and resid 91 and name H ))
( segid " " and resid 101 and name HD1%)
ASSI { 887}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 92 and name H ))
2.300 0.700 0.700 peak 887 spectrum 1 weight 0.10000E+01 volume 0.46295E-02 ppm1 7.747 ppm2 7.881 CV 1
OR { 887}
(( segid " " and resid 91 and name H ))
(( segid " " and resid 90 and name H ))
ASSI { 888}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 89 and name HA ))
3.300 1.400 1.400 peak 888 spectrum 1 weight 0.10000E+01 volume 0.13250E-02 ppm1 7.846 ppm2 3.735 CV 1
OR { 888}
(( segid " " and resid 92 and name H ))
(( segid " " and resid 90 and name HA ))
ASSI { 897}
(( segid " " and resid 92 and name H ))
( segid " " and resid 91 and name HD% )
4.300 2.300 1.700 peak 897 spectrum 1 weight 0.10000E+01 volume 0.83978E-03 ppm1 7.846 ppm2 7.078 CV 1
OR { 897}
(( segid " " and resid 92 and name H ))
( segid " " and resid 88 and name HD% )
ASSI { 901}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 92 and name HD3 ))
3.000 3.000 3.000 peak 901 spectrum 1 weight 0.10000E+01 volume 0.71750E-03 ppm1 8.386 ppm2 2.997 CV 1
OR { 901}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 88 and name HB2 ))
ASSI { 907}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 92 and name H ))
2.400 0.700 0.700 peak 907 spectrum 1 weight 0.10000E+01 volume 0.55779E-02 ppm1 8.381 ppm2 7.836 CV 1
OR { 907}
(( segid " " and resid 93 and name H ))
(( segid " " and resid 94 and name H ))
ASSI { 913}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 92 and name HA ))
3.400 1.400 1.400 peak 913 spectrum 1 weight 0.10000E+01 volume 0.84099E-03 ppm1 7.824 ppm2 3.614 CV 1
OR { 913}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 97 and name HA ))
ASSI { 917}
(( segid " " and resid 94 and name H ))
( segid " " and resid 91 and name HD% )
3.800 1.800 1.800 peak 917 spectrum 1 weight 0.10000E+01 volume 0.10270E-02 ppm1 7.828 ppm2 7.098 CV 1
OR { 917}
(( segid " " and resid 94 and name H ))
(( segid " " and resid 100 and name HD2 ))
ASSI { 922}
(( segid " " and resid 95 and name H ))
(( segid " " and resid 94 and name HA ))
2.800 1.000 1.000 peak 922 spectrum 1 weight 0.10000E+01 volume 0.28834E-02 ppm1 8.711 ppm2 4.543 CV 1
OR { 922}
(( segid " " and resid 95 and name H ))
(( segid " " and resid 95 and name HA ))
ASSI { 926}
(( segid " " and resid 96 and name H ))
(( segid " " and resid 95 and name HA ))
3.200 1.300 1.300 peak 926 spectrum 1 weight 0.10000E+01 volume 0.28150E-02 ppm1 7.876 ppm2 4.541 CV 1
OR { 926}
(( segid " " and resid 96 and name H ))
(( segid " " and resid 94 and name HA ))
ASSI { 936}
(( segid " " and resid 97 and name H ))
(( segid " " and resid 99 and name H ))
3.500 1.500 1.500 peak 936 spectrum 1 weight 0.10000E+01 volume 0.12566E-02 ppm1 8.639 ppm2 7.871 CV 1
OR { 936}
(( segid " " and resid 97 and name H ))
(( segid " " and resid 96 and name H ))
ASSI { 943}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 114 and name HB ))
3.500 3.500 2.500 peak 943 spectrum 1 weight 0.10000E+01 volume 0.80166E-03 ppm1 7.852 ppm2 2.232 CV 1
OR { 943}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 115 and name HB ))
OR { 943}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 944}
(( segid " " and resid 99 and name H ))
( segid " " and resid 102 and name HE% )
3.900 1.900 1.900 peak 944 spectrum 1 weight 0.10000E+01 volume 0.84432E-03 ppm1 7.849 ppm2 2.174 CV 1
OR { 944}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 102 and name HB3 ))
OR { 944}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 115 and name HB ))
ASSI { 946}
(( segid " " and resid 99 and name H ))
( segid " " and resid 97 and name HG1%)
4.000 2.000 2.000 peak 946 spectrum 1 weight 0.10000E+01 volume 0.17634E-02 ppm1 7.851 ppm2 1.020 CV 1
OR { 946}
(( segid " " and resid 99 and name H ))
( segid " " and resid 101 and name HD1%)
OR { 946}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 100 and name HB3 ))
ASSI { 948}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 111 and name HG2 ))
4.000 2.000 2.000 peak 948 spectrum 1 weight 0.10000E+01 volume 0.11466E-02 ppm1 7.840 ppm2 1.757 CV 1
OR { 948}
(( segid " " and resid 99 and name H ))
(( segid " " and resid 98 and name HG ))
ASSI { 950}
(( segid " " and resid 99 and name H ))
( segid " " and resid 98 and name HD1%)
3.800 1.800 1.800 peak 950 spectrum 1 weight 0.10000E+01 volume 0.17200E-02 ppm1 7.842 ppm2 0.923 CV 1
OR { 950}
(( segid " " and resid 99 and name H ))
( segid " " and resid 114 and name HG2%)
OR { 950}
(( segid " " and resid 99 and name H ))
( segid " " and resid 130 and name HD2%)
ASSI { 954}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 100 and name HA ))
2.700 0.900 0.900 peak 954 spectrum 1 weight 0.10000E+01 volume 0.39986E-02 ppm1 7.749 ppm2 3.944 CV 1
OR { 954}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 98 and name HA ))
ASSI { 955}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 99 and name HA3 ))
2.800 0.900 0.900 peak 955 spectrum 1 weight 0.10000E+01 volume 0.29219E-02 ppm1 7.748 ppm2 3.631 CV 1
OR { 955}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 101 and name HA ))
ASSI { 956}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 96 and name HB3 ))
3.900 1.900 1.900 peak 956 spectrum 1 weight 0.10000E+01 volume 0.82989E-03 ppm1 7.747 ppm2 2.590 CV 1
OR { 956}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 96 and name HB2 ))
OR { 956}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 104 and name HB2 ))
ASSI { 958}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 98 and name HB3 ))
3.900 1.900 1.900 peak 958 spectrum 1 weight 0.10000E+01 volume 0.96853E-03 ppm1 7.751 ppm2 1.837 CV 1
OR { 958}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 103 and name HB3 ))
OR { 958}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 103 and name HB2 ))
ASSI { 959}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 98 and name HB2 ))
4.300 2.300 1.700 peak 959 spectrum 1 weight 0.10000E+01 volume 0.73243E-03 ppm1 7.746 ppm2 1.429 CV 1
OR { 959}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 103 and name HG3 ))
ASSI { 960}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 100 and name HB3 ))
3.300 1.400 1.400 peak 960 spectrum 1 weight 0.10000E+01 volume 0.47503E-02 ppm1 7.748 ppm2 0.993 CV 1
OR { 960}
(( segid " " and resid 100 and name H ))
( segid " " and resid 101 and name HD1%)
ASSI { 962}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 98 and name H ))
3.400 1.400 1.400 peak 962 spectrum 1 weight 0.10000E+01 volume 0.14661E-02 ppm1 7.748 ppm2 8.600 CV 1
OR { 962}
(( segid " " and resid 100 and name H ))
(( segid " " and resid 102 and name H ))
ASSI { 964}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 101 and name HA ))
3.100 1.200 1.200 peak 964 spectrum 1 weight 0.10000E+01 volume 0.13694E-02 ppm1 8.309 ppm2 3.633 CV 1
OR { 964}
(( segid " " and resid 101 and name H ))
(( segid " " and resid 99 and name HA3 ))
ASSI { 966}
(( segid " " and resid 102 and name H ))
( segid " " and resid 101 and name HG2%)
3.100 1.200 1.200 peak 966 spectrum 1 weight 0.10000E+01 volume 0.24073E-02 ppm1 8.598 ppm2 1.003 CV 1
OR { 966}
(( segid " " and resid 102 and name H ))
( segid " " and resid 105 and name HG2%)
OR { 966}
(( segid " " and resid 102 and name H ))
( segid " " and resid 101 and name HD1%)
ASSI { 976}
(( segid " " and resid 103 and name H ))
( segid " " and resid 105 and name HG2%)
3.600 1.700 1.700 peak 976 spectrum 1 weight 0.10000E+01 volume 0.14463E-02 ppm1 7.472 ppm2 1.012 CV 1
OR { 976}
(( segid " " and resid 103 and name H ))
( segid " " and resid 101 and name HG2%)
OR { 976}
(( segid " " and resid 103 and name H ))
(( segid " " and resid 100 and name HB3 ))
ASSI { 978}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 87 and name HB3 ))
4.000 2.000 2.000 peak 978 spectrum 1 weight 0.10000E+01 volume 0.54978E-03 ppm1 7.375 ppm2 1.552 CV 1
OR { 978}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 105 and name HG12))
ASSI { 983}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 103 and name HG3 ))
4.100 2.100 1.900 peak 983 spectrum 1 weight 0.10000E+01 volume 0.68048E-03 ppm1 7.371 ppm2 1.447 CV 1
OR { 983}
(( segid " " and resid 104 and name H ))
(( segid " " and resid 105 and name HG13))
ASSI { 990}
(( segid " " and resid 105 and name H ))
(( segid " " and resid 102 and name HA ))
3.700 1.700 1.700 peak 990 spectrum 1 weight 0.10000E+01 volume 0.10317E-02 ppm1 8.082 ppm2 4.034 CV 1
OR { 990}
(( segid " " and resid 105 and name H ))
(( segid " " and resid 106 and name HA ))
ASSI { 1016}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 105 and name H ))
3.100 3.100 2.900 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.35558E-03 ppm1 7.635 ppm2 8.080 CV 1
OR { 1016}
(( segid " " and resid 107 and name H ))
(( segid " " and resid 114 and name H ))
ASSI { 1023}
(( segid " " and resid 109 and name H ))
(( segid " " and resid 109 and name HB2 ))
2.900 1.100 1.100 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.47222E-02 ppm1 7.637 ppm2 1.736 CV 1
OR { 1023}
(( segid " " and resid 109 and name H ))
(( segid " " and resid 108 and name HB3 ))
OR { 1023}
(( segid " " and resid 109 and name H ))
(( segid " " and resid 108 and name HB2 ))
ASSI { 1031}
(( segid " " and resid 110 and name H ))
( segid " " and resid 105 and name HD1%)
4.000 2.000 2.000 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.70913E-03 ppm1 8.371 ppm2 1.059 CV 1
OR { 1031}
(( segid " " and resid 110 and name H ))
( segid " " and resid 84 and name HD1%)
ASSI { 1032}
(( segid " " and resid 110 and name H ))
( segid " " and resid 114 and name HD1%)
3.900 1.900 1.900 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.79077E-03 ppm1 8.377 ppm2 0.946 CV 1
OR { 1032}
(( segid " " and resid 110 and name H ))
( segid " " and resid 74 and name HG2%)
ASSI { 1038}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 114 and name HG13))
3.200 1.300 1.300 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.16204E-02 ppm1 8.378 ppm2 1.853 CV 1
OR { 1038}
(( segid " " and resid 110 and name H ))
(( segid " " and resid 111 and name HB3 ))
ASSI { 1044}
(( segid " " and resid 127 and name H ))
(( segid " " and resid 126 and name HB2 ))
3.500 1.500 1.500 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.92239E-03 ppm1 9.021 ppm2 2.189 CV 1
OR { 1044}
(( segid " " and resid 111 and name H ))
( segid " " and resid 102 and name HE% )
OR { 1044}
(( segid " " and resid 127 and name H ))
(( segid " " and resid 126 and name HG3 ))
ASSI { 1048}
(( segid " " and resid 111 and name H ))
(( segid " " and resid 111 and name HA ))
3.000 1.100 1.100 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.17673E-02 ppm1 9.006 ppm2 4.001 CV 1
OR { 1048}
(( segid " " and resid 111 and name H ))
(( segid " " and resid 110 and name HB3 ))
ASSI { 1053}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 110 and name HB2 ))
4.300 2.300 1.700 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.55236E-03 ppm1 8.526 ppm2 4.293 CV 1
OR { 1053}
(( segid " " and resid 112 and name H ))
(( segid " " and resid 113 and name HA ))
ASSI { 1061}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 113 and name HA ))
3.400 1.400 1.400 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.98588E-03 ppm1 7.552 ppm2 4.326 CV 1
OR { 1061}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 110 and name HB2 ))
ASSI { 1062}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 110 and name HB3 ))
3.400 1.500 1.500 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.81500E-03 ppm1 7.555 ppm2 4.003 CV 1
OR { 1062}
(( segid " " and resid 113 and name H ))
(( segid " " and resid 111 and name HA ))
ASSI { 1067}
(( segid " " and resid 113 and name H ))
( segid " " and resid 115 and name HG2%)
4.100 2.100 1.900 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.55375E-03 ppm1 7.559 ppm2 0.970 CV 1
OR { 1067}
(( segid " " and resid 113 and name H ))
( segid " " and resid 114 and name HD1%)
OR { 1067}
(( segid " " and resid 113 and name H ))
( segid " " and resid 114 and name HG2%)
ASSI { 1070}
(( segid " " and resid 114 and name H ))
(( segid " " and resid 112 and name HA ))
4.000 2.000 2.000 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.69338E-03 ppm1 8.103 ppm2 4.071 CV 1
OR { 1070}
(( segid " " and resid 114 and name H ))
(( segid " " and resid 74 and name HA ))
ASSI { 1073}
(( segid " " and resid 114 and name H ))
(( segid " " and resid 113 and name HB3 ))
2.600 0.900 0.900 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.23130E-02 ppm1 8.099 ppm2 2.240 CV 1
OR { 1073}
(( segid " " and resid 114 and name H ))
(( segid " " and resid 114 and name HB ))
OR { 1073}
(( segid " " and resid 114 and name H ))
(( segid " " and resid 113 and name HB2 ))
ASSI { 1077}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 114 and name HB ))
2.700 0.900 0.900 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.18082E-02 ppm1 8.565 ppm2 2.238 CV 1
OR { 1077}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 115 and name HB ))
ASSI { 1078}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 114 and name HG13))
4.200 2.200 1.800 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.65903E-03 ppm1 8.568 ppm2 1.892 CV 1
OR { 1078}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 111 and name HB2 ))
OR { 1078}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 111 and name HB3 ))
OR { 1078}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 127 and name HB3 ))
OR { 1078}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 127 and name HB2 ))
ASSI { 1080}
(( segid " " and resid 115 and name H ))
( segid " " and resid 115 and name HG2%)
2.600 0.800 0.800 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.29275E-02 ppm1 8.560 ppm2 0.959 CV 1
OR { 1080}
(( segid " " and resid 115 and name H ))
( segid " " and resid 114 and name HG2%)
OR { 1080}
(( segid " " and resid 115 and name H ))
( segid " " and resid 130 and name HD2%)
ASSI { 1081}
(( segid " " and resid 115 and name H ))
( segid " " and resid 98 and name HD1%)
3.400 1.400 1.400 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.22011E-02 ppm1 8.561 ppm2 0.885 CV 1
OR { 1081}
(( segid " " and resid 115 and name H ))
( segid " " and resid 98 and name HD2%)
OR { 1081}
(( segid " " and resid 115 and name H ))
( segid " " and resid 130 and name HD2%)
ASSI { 1082}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 116 and name H ))
2.700 0.900 0.900 peak 1082 spectrum 1 weight 0.10000E+01 volume 0.18454E-02 ppm1 8.562 ppm2 8.107 CV 1
OR { 1082}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 114 and name H ))
ASSI { 1083}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 113 and name H ))
4.300 2.300 1.700 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.23929E-03 ppm1 8.557 ppm2 7.559 CV 1
OR { 1083}
(( segid " " and resid 115 and name H ))
(( segid " " and resid 117 and name H ))
ASSI { 1084}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 116 and name HA ))
2.700 0.900 0.900 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.26081E-02 ppm1 8.114 ppm2 4.311 CV 1
OR { 1084}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 113 and name HA ))
ASSI { 1089}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 117 and name HB3 ))
4.500 2.600 1.500 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.96399E-03 ppm1 8.122 ppm2 1.550 CV 1
OR { 1089}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 127 and name HG3 ))
OR { 1089}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 118 and name HB3 ))
ASSI { 1090}
(( segid " " and resid 116 and name H ))
( segid " " and resid 112 and name HB% )
4.400 2.400 1.600 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.85229E-03 ppm1 8.117 ppm2 1.456 CV 1
OR { 1090}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 130 and name HB2 ))
ASSI { 1093}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 127 and name HG3 ))
4.600 2.700 1.400 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.78490E-03 ppm1 8.112 ppm2 1.519 CV 1
OR { 1093}
(( segid " " and resid 116 and name H ))
(( segid " " and resid 118 and name HB3 ))
ASSI { 1097}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 116 and name HA ))
3.800 1.800 1.800 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.51994E-03 ppm1 7.542 ppm2 4.314 CV 1
OR { 1097}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 113 and name HA ))
ASSI { 1101}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 117 and name HB3 ))
3.800 1.800 1.800 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.14193E-02 ppm1 7.541 ppm2 1.556 CV 1
OR { 1101}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 118 and name HB3 ))
ASSI { 1102}
(( segid " " and resid 117 and name H ))
( segid " " and resid 120 and name HB% )
3.800 1.800 1.800 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.13655E-02 ppm1 7.546 ppm2 1.466 CV 1
OR { 1102}
(( segid " " and resid 117 and name H ))
( segid " " and resid 112 and name HB% )
ASSI { 1104}
(( segid " " and resid 117 and name H ))
( segid " " and resid 84 and name HD1%)
4.400 2.400 1.600 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.76275E-03 ppm1 7.550 ppm2 1.069 CV 1
OR { 1104}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 123 and name HB2 ))
ASSI { 1105}
(( segid " " and resid 117 and name H ))
( segid " " and resid 115 and name HG2%)
4.000 2.000 2.000 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.10437E-02 ppm1 7.549 ppm2 0.958 CV 1
OR { 1105}
(( segid " " and resid 117 and name H ))
( segid " " and resid 114 and name HG2%)
ASSI { 1106}
(( segid " " and resid 117 and name H ))
( segid " " and resid 130 and name HD2%)
4.400 2.400 1.600 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.75099E-03 ppm1 7.546 ppm2 0.886 CV 1
OR { 1106}
(( segid " " and resid 117 and name H ))
( segid " " and resid 74 and name HG1%)
ASSI { 1107}
(( segid " " and resid 117 and name H ))
( segid " " and resid 118 and name HD2%)
4.500 2.600 1.500 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.64583E-03 ppm1 7.546 ppm2 0.740 CV 1
OR { 1107}
(( segid " " and resid 117 and name H ))
( segid " " and resid 121 and name HD1%)
ASSI { 1109}
(( segid " " and resid 117 and name H ))
(( segid " " and resid 117 and name HD3 ))
3.800 1.800 1.800 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.12286E-02 ppm1 7.546 ppm2 0.540 CV 1
OR { 1109}
(( segid " " and resid 117 and name H ))
( segid " " and resid 118 and name HD1%)
ASSI { 1111}
(( segid " " and resid 117 and name H ))
( segid " " and resid 73 and name HG2%)
4.600 2.600 1.400 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.80160E-03 ppm1 7.538 ppm2 0.816 CV 1
OR { 1111}
(( segid " " and resid 117 and name H ))
( segid " " and resid 119 and name HD2%)
OR { 1111}
(( segid " " and resid 117 and name H ))
( segid " " and resid 73 and name HD1%)
OR { 1111}
(( segid " " and resid 117 and name H ))
( segid " " and resid 123 and name HD1%)
ASSI { 1116}
(( segid " " and resid 118 and name H ))
(( segid " " and resid 117 and name HB3 ))
3.600 1.600 1.600 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.12994E-02 ppm1 8.401 ppm2 1.546 CV 1
OR { 1116}
(( segid " " and resid 118 and name H ))
(( segid " " and resid 118 and name HB3 ))
ASSI { 1117}
(( segid " " and resid 118 and name H ))
( segid " " and resid 120 and name HB% )
4.000 2.000 2.000 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.98228E-03 ppm1 8.401 ppm2 1.452 CV 1
OR { 1117}
(( segid " " and resid 118 and name H ))
(( segid " " and resid 130 and name HB2 ))
OR { 1117}
(( segid " " and resid 118 and name H ))
(( segid " " and resid 121 and name HB3 ))
ASSI { 1118}
(( segid " " and resid 118 and name H ))
(( segid " " and resid 123 and name HB2 ))
3.700 1.700 1.700 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.22794E-02 ppm1 8.401 ppm2 1.029 CV 1
OR { 1118}
(( segid " " and resid 118 and name H ))
( segid " " and resid 84 and name HD1%)
ASSI { 1119}
(( segid " " and resid 118 and name H ))
( segid " " and resid 114 and name HG2%)
3.200 1.300 1.300 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.27244E-02 ppm1 8.401 ppm2 0.909 CV 1
OR { 1119}
(( segid " " and resid 118 and name H ))
( segid " " and resid 115 and name HG2%)
OR { 1119}
(( segid " " and resid 118 and name H ))
( segid " " and resid 130 and name HD2%)
ASSI { 1120}
(( segid " " and resid 118 and name H ))
( segid " " and resid 118 and name HD2%)
3.600 1.600 1.600 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.20842E-02 ppm1 8.401 ppm2 0.750 CV 1
OR { 1120}
(( segid " " and resid 118 and name H ))
( segid " " and resid 121 and name HD1%)
OR { 1120}
(( segid " " and resid 118 and name H ))
( segid " " and resid 123 and name HD1%)
ASSI { 1121}
(( segid " " and resid 118 and name H ))
( segid " " and resid 119 and name HD1%)
3.400 1.500 1.500 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.24375E-02 ppm1 8.403 ppm2 0.607 CV 1
OR { 1121}
(( segid " " and resid 118 and name H ))
(( segid " " and resid 123 and name HB3 ))
ASSI { 1122}
(( segid " " and resid 118 and name H ))
( segid " " and resid 118 and name HD1%)
3.400 1.400 1.400 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.21431E-02 ppm1 8.399 ppm2 0.528 CV 1
OR { 1122}
(( segid " " and resid 118 and name H ))
( segid " " and resid 124 and name HG1%)
ASSI { 1125}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 116 and name HA ))
3.600 1.600 1.600 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.10292E-02 ppm1 7.880 ppm2 4.297 CV 1
OR { 1125}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 124 and name HA ))
ASSI { 1129}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 118 and name HB3 ))
2.800 1.000 1.000 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.46446E-02 ppm1 7.885 ppm2 1.544 CV 1
OR { 1129}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 119 and name HB3 ))
OR { 1129}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 119 and name HG ))
ASSI { 1130}
(( segid " " and resid 119 and name H ))
( segid " " and resid 119 and name HD2%)
3.800 1.800 1.800 peak 1130 spectrum 1 weight 0.10000E+01 volume 0.28702E-02 ppm1 7.883 ppm2 0.795 CV 1
OR { 1130}
(( segid " " and resid 119 and name H ))
( segid " " and resid 118 and name HD2%)
OR { 1130}
(( segid " " and resid 119 and name H ))
( segid " " and resid 124 and name HG2%)
ASSI { 1132}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 117 and name H ))
3.800 1.800 1.800 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.75289E-03 ppm1 7.886 ppm2 7.563 CV 1
OR { 1132}
(( segid " " and resid 119 and name H ))
(( segid " " and resid 123 and name H ))
ASSI { 1140}
(( segid " " and resid 120 and name H ))
( segid " " and resid 119 and name HD2%)
4.200 2.200 1.800 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.15700E-02 ppm1 8.153 ppm2 0.782 CV 1
OR { 1140}
(( segid " " and resid 120 and name H ))
( segid " " and resid 118 and name HD2%)
OR { 1140}
(( segid " " and resid 120 and name H ))
( segid " " and resid 124 and name HG2%)
OR { 1140}
(( segid " " and resid 120 and name H ))
( segid " " and resid 123 and name HD1%)
ASSI { 1141}
(( segid " " and resid 120 and name H ))
( segid " " and resid 119 and name HD1%)
3.900 1.900 1.900 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.17028E-02 ppm1 8.153 ppm2 0.678 CV 1
OR { 1141}
(( segid " " and resid 120 and name H ))
( segid " " and resid 121 and name HD1%)
ASSI { 1142}
(( segid " " and resid 120 and name H ))
(( segid " " and resid 119 and name H ))
2.600 0.900 0.900 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.26231E-02 ppm1 8.155 ppm2 7.878 CV 1
OR { 1142}
(( segid " " and resid 120 and name H ))
(( segid " " and resid 122 and name H ))
ASSI { 1144}
(( segid " " and resid 121 and name H ))
(( segid " " and resid 121 and name HA ))
2.800 1.000 1.000 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.26738E-02 ppm1 8.153 ppm2 4.173 CV 1
OR { 1144}
(( segid " " and resid 121 and name H ))
(( segid " " and resid 71 and name HB ))
ASSI { 1147}
(( segid " " and resid 121 and name H ))
( segid " " and resid 120 and name HB% )
2.600 0.800 0.800 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.41668E-02 ppm1 8.145 ppm2 1.458 CV 1
OR { 1147}
(( segid " " and resid 121 and name H ))
(( segid " " and resid 121 and name HB3 ))
ASSI { 1152}
(( segid " " and resid 122 and name H ))
(( segid " " and resid 121 and name HG ))
3.600 1.600 1.600 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.17714E-02 ppm1 7.838 ppm2 1.551 CV 1
OR { 1152}
(( segid " " and resid 122 and name H ))
(( segid " " and resid 119 and name HB3 ))
OR { 1152}
(( segid " " and resid 122 and name H ))
(( segid " " and resid 119 and name HG ))
ASSI { 1154}
(( segid " " and resid 122 and name H ))
( segid " " and resid 123 and name HD2%)
3.700 1.700 1.700 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.16654E-02 ppm1 7.837 ppm2 0.617 CV 1
OR { 1154}
(( segid " " and resid 122 and name H ))
( segid " " and resid 119 and name HD1%)
OR { 1154}
(( segid " " and resid 122 and name H ))
(( segid " " and resid 123 and name HB3 ))
ASSI { 1157}
(( segid " " and resid 122 and name H ))
(( segid " " and resid 121 and name H ))
2.700 0.900 0.900 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.24187E-02 ppm1 7.836 ppm2 8.148 CV 1
OR { 1157}
(( segid " " and resid 122 and name H ))
(( segid " " and resid 120 and name H ))
ASSI { 1158}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 119 and name HA ))
3.700 1.700 1.700 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.82969E-03 ppm1 7.580 ppm2 4.151 CV 1
OR { 1158}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 121 and name HA ))
ASSI { 1159}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 123 and name HA ))
2.800 1.000 1.000 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.21753E-02 ppm1 7.576 ppm2 3.982 CV 1
OR { 1159}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 122 and name HA2 ))
ASSI { 1165}
(( segid " " and resid 123 and name H ))
( segid " " and resid 123 and name HD1%)
3.700 1.700 1.700 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.23308E-02 ppm1 7.576 ppm2 0.796 CV 1
OR { 1165}
(( segid " " and resid 123 and name H ))
( segid " " and resid 118 and name HD2%)
ASSI { 1168}
(( segid " " and resid 123 and name H ))
( segid " " and resid 121 and name HD1%)
3.500 1.500 1.500 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.25426E-02 ppm1 7.573 ppm2 0.700 CV 1
OR { 1168}
(( segid " " and resid 123 and name H ))
( segid " " and resid 119 and name HD1%)
ASSI { 1170}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 121 and name H ))
3.800 1.800 1.800 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.66903E-03 ppm1 7.573 ppm2 8.145 CV 1
OR { 1170}
(( segid " " and resid 123 and name H ))
(( segid " " and resid 120 and name H ))
ASSI { 1174}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 122 and name HA2 ))
2.900 1.100 1.100 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.19686E-02 ppm1 6.800 ppm2 3.973 CV 1
OR { 1174}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 123 and name HA ))
ASSI { 1175}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 124 and name HB ))
3.700 1.700 1.700 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.10672E-02 ppm1 6.796 ppm2 1.897 CV 1
OR { 1175}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 118 and name HG ))
ASSI { 1176}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 118 and name HB3 ))
3.900 1.900 1.900 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.73512E-03 ppm1 6.799 ppm2 1.549 CV 1
OR { 1176}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 119 and name HG ))
OR { 1176}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 119 and name HB3 ))
ASSI { 1180}
(( segid " " and resid 124 and name H ))
( segid " " and resid 124 and name HG2%)
3.400 1.400 1.400 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.24294E-02 ppm1 6.800 ppm2 0.792 CV 1
OR { 1180}
(( segid " " and resid 124 and name H ))
( segid " " and resid 118 and name HD2%)
ASSI { 1185}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 122 and name H ))
4.100 2.100 1.900 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.82038E-03 ppm1 6.797 ppm2 7.848 CV 1
OR { 1185}
(( segid " " and resid 124 and name H ))
(( segid " " and resid 119 and name H ))
ASSI { 1187}
(( segid " " and resid 125 and name H ))
(( segid " " and resid 124 and name HA ))
2.200 0.600 0.600 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.77004E-02 ppm1 8.864 ppm2 4.283 CV 1
OR { 1187}
(( segid " " and resid 125 and name H ))
(( segid " " and resid 125 and name HA ))
ASSI { 1188}
(( segid " " and resid 125 and name H ))
(( segid " " and resid 126 and name HG3 ))
4.600 2.600 1.400 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.98254E-03 ppm1 8.862 ppm2 2.213 CV 1
OR { 1188}
(( segid " " and resid 125 and name H ))
(( segid " " and resid 129 and name HB3 ))
OR { 1188}
(( segid " " and resid 125 and name H ))
(( segid " " and resid 126 and name HB2 ))
ASSI { 1197}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 125 and name HA ))
3.200 1.300 1.300 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.34252E-02 ppm1 7.632 ppm2 4.294 CV 1
OR { 1197}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 124 and name HA ))
ASSI { 1199}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 126 and name HG3 ))
3.000 1.100 1.100 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.35241E-02 ppm1 7.632 ppm2 2.218 CV 1
OR { 1199}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 126 and name HB2 ))
OR { 1199}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 129 and name HB3 ))
ASSI { 1200}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 126 and name HB3 ))
3.100 1.200 1.200 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.29226E-02 ppm1 7.632 ppm2 1.909 CV 1
OR { 1200}
(( segid " " and resid 126 and name H ))
(( segid " " and resid 124 and name HB ))
ASSI { 1214}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 128 and name HB3 ))
2.500 0.800 0.800 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.46531E-02 ppm1 8.614 ppm2 1.875 CV 1
OR { 1214}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 128 and name HB2 ))
OR { 1214}
(( segid " " and resid 128 and name H ))
(( segid " " and resid 127 and name HB2 ))
ASSI { 1222}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 126 and name HG3 ))
2.200 0.600 0.600 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.55993E-02 ppm1 7.791 ppm2 2.224 CV 1
OR { 1222}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 129 and name HB2 ))
OR { 1222}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 129 and name HB3 ))
ASSI { 1223}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 128 and name HB3 ))
3.000 1.200 1.200 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.21412E-02 ppm1 7.792 ppm2 1.890 CV 1
OR { 1223}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 128 and name HB2 ))
OR { 1223}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 124 and name HB ))
ASSI { 1224}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 128 and name HG2 ))
3.200 1.300 1.300 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.21568E-02 ppm1 7.791 ppm2 1.648 CV 1
OR { 1224}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 128 and name HG3 ))
OR { 1224}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 130 and name HG ))
ASSI { 1225}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 118 and name HB3 ))
3.600 3.600 2.400 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.78965E-03 ppm1 7.787 ppm2 1.490 CV 1
OR { 1225}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 133 and name HG2 ))
OR { 1225}
(( segid " " and resid 129 and name H ))
( segid " " and resid 112 and name HB% )
OR { 1225}
(( segid " " and resid 129 and name H ))
(( segid " " and resid 133 and name HG3 ))
ASSI { 1230}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 129 and name HB3 ))
3.500 1.500 1.500 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.21480E-02 ppm1 7.760 ppm2 2.228 CV 1
OR { 1230}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 115 and name HB ))
OR { 1230}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 126 and name HG3 ))
ASSI { 1231}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 127 and name HB3 ))
3.400 1.500 1.500 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.22176E-02 ppm1 7.763 ppm2 1.847 CV 1
OR { 1231}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 124 and name HB ))
OR { 1231}
(( segid " " and resid 130 and name H ))
(( segid " " and resid 127 and name HB2 ))
ASSI { 1239}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 128 and name HB3 ))
4.000 2.000 2.000 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.84930E-03 ppm1 7.427 ppm2 1.899 CV 1
OR { 1239}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 128 and name HB2 ))
OR { 1239}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 132 and name HB3 ))
OR { 1239}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 127 and name HB3 ))
OR { 1239}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 133 and name HB3 ))
ASSI { 1246}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 128 and name HB3 ))
4.200 2.200 1.800 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.65653E-03 ppm1 7.421 ppm2 1.823 CV 1
OR { 1246}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 128 and name HB2 ))
OR { 1246}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 132 and name HB3 ))
OR { 1246}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 133 and name HB2 ))
OR { 1246}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 127 and name HB3 ))
OR { 1246}
(( segid " " and resid 131 and name H ))
(( segid " " and resid 132 and name HB2 ))
ASSI { 1252}
(( segid " " and resid 133 and name H ))
(( segid " " and resid 132 and name HA ))
2.100 0.600 0.600 peak 1252 spectrum 1 weight 0.10000E+01 volume 0.13606E-01 ppm1 8.487 ppm2 4.378 CV 1
OR { 1252}
(( segid " " and resid 133 and name H ))
(( segid " " and resid 133 and name HA ))
ASSI { 1253}
(( segid " " and resid 133 and name H ))
(( segid " " and resid 133 and name HB2 ))
2.400 0.700 0.700 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.93045E-02 ppm1 8.487 ppm2 1.835 CV 1
OR { 1253}
(( segid " " and resid 133 and name H ))
(( segid " " and resid 133 and name HB3 ))
OR { 1253}
(( segid " " and resid 133 and name H ))
(( segid " " and resid 132 and name HB2 ))
ASSI { 1254}
(( segid " " and resid 133 and name H ))
(( segid " " and resid 133 and name HG2 ))
3.200 1.300 1.300 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.38001E-02 ppm1 8.486 ppm2 1.496 CV 1
OR { 1254}
(( segid " " and resid 133 and name H ))
(( segid " " and resid 133 and name HG3 ))
OR { 1254}
(( segid " " and resid 133 and name H ))
(( segid " " and resid 132 and name HG3 ))
ASSI { 1256}
(( segid " " and resid 134 and name H ))
(( segid " " and resid 133 and name HA ))
2.000 0.500 0.500 peak 1256 spectrum 1 weight 0.10000E+01 volume 0.16882E-01 ppm1 8.531 ppm2 4.375 CV 1
OR { 1256}
(( segid " " and resid 134 and name H ))
(( segid " " and resid 134 and name HA ))
ASSI { 1258}
(( segid " " and resid 134 and name H ))
(( segid " " and resid 134 and name HB2 ))
2.300 0.700 0.700 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.11193E-01 ppm1 8.531 ppm2 1.822 CV 1
OR { 1258}
(( segid " " and resid 134 and name H ))
(( segid " " and resid 133 and name HB3 ))
OR { 1258}
(( segid " " and resid 134 and name H ))
(( segid " " and resid 134 and name HB3 ))
ASSI { 1260}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 134 and name HA ))
2.300 0.700 0.700 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.74138E-02 ppm1 8.523 ppm2 4.357 CV 1
OR { 1260}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 135 and name HA ))
ASSI { 1261}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 134 and name HD3 ))
3.100 1.200 1.200 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.37111E-03 ppm1 8.527 ppm2 3.234 CV 1
OR { 1261}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 134 and name HD2 ))
OR { 1261}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 128 and name HD2 ))
OR { 1261}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 128 and name HD3 ))
ASSI { 1266}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 134 and name HG2 ))
2.800 2.800 3.200 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.12846E-02 ppm1 8.523 ppm2 1.711 CV 1
OR { 1266}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 134 and name HG3 ))
OR { 1266}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 136 and name HD3 ))
OR { 1266}
(( segid " " and resid 135 and name H ))
(( segid " " and resid 136 and name HD2 ))
ASSI { 1271}
(( segid " " and resid 135 and name HE21))
(( segid " " and resid 129 and name HB2 ))
2.600 2.600 3.400 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.57320E-03 ppm1 7.611 ppm2 2.208 CV 1
OR { 1271}
(( segid " " and resid 135 and name HE21))
(( segid " " and resid 129 and name HB3 ))
OR { 1271}
(( segid " " and resid 135 and name HE21))
(( segid " " and resid 126 and name HG3 ))
ASSI { 1274}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 135 and name HA ))
2.300 0.600 0.600 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.93459E-02 ppm1 8.456 ppm2 4.344 CV 1
OR { 1274}
(( segid " " and resid 136 and name H ))
(( segid " " and resid 136 and name HA ))
ASSI { 1280}
(( segid " " and resid 137 and name H ))
(( segid " " and resid 136 and name HA ))
2.200 0.600 0.600 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.11862E-01 ppm1 8.423 ppm2 4.303 CV 1
OR { 1280}
(( segid " " and resid 137 and name H ))
(( segid " " and resid 137 and name HA ))
ASSI { 1281}
(( segid " " and resid 137 and name H ))
(( segid " " and resid 136 and name HB2 ))
2.500 0.800 0.800 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.64747E-02 ppm1 8.422 ppm2 1.775 CV 1
OR { 1281}
(( segid " " and resid 137 and name H ))
(( segid " " and resid 137 and name HB3 ))
OR { 1281}
(( segid " " and resid 137 and name H ))
(( segid " " and resid 137 and name HB2 ))
OR { 1281}
(( segid " " and resid 137 and name H ))
(( segid " " and resid 136 and name HB3 ))
ASSI { 1282}
(( segid " " and resid 137 and name H ))
(( segid " " and resid 137 and name HG2 ))
3.200 1.300 1.300 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.20540E-02 ppm1 8.423 ppm2 1.441 CV 1
OR { 1282}
(( segid " " and resid 137 and name H ))
(( segid " " and resid 137 and name HG3 ))
OR { 1282}
(( segid " " and resid 137 and name H ))
(( segid " " and resid 136 and name HG3 ))
ASSI { 1287}
(( segid " " and resid 139 and name H ))
(( segid " " and resid 137 and name HA ))
2.900 2.900 3.100 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.11525E-02 ppm1 8.378 ppm2 4.252 CV 1
OR { 1287}
(( segid " " and resid 139 and name H ))
(( segid " " and resid 141 and name HA ))
ASSI { 1296}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 141 and name HB3 ))
3.800 1.800 1.800 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.94903E-03 ppm1 7.980 ppm2 3.889 CV 1
OR { 1296}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 141 and name HB2 ))
OR { 1296}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 140 and name HB2 ))
OR { 1296}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 140 and name HB3 ))
ASSI { 1298}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 124 and name HB ))
2.300 2.300 3.700 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.12002E-02 ppm1 7.980 ppm2 1.852 CV 1
OR { 1298}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 128 and name HB3 ))
OR { 1298}
(( segid " " and resid 141 and name H ))
(( segid " " and resid 128 and name HB2 ))
ASSI { 1304}
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3.500 1.500 1.500 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.14578E-02 ppm1 7.492 ppm2 1.435 CV 1
OR { 1304}
(( segid " " and resid 24 and name HD22))
( segid " " and resid 35 and name HB% )
ASSI { 1317}
(( segid " " and resid 45 and name HE ))
(( segid " " and resid 45 and name HD2 ))
3.300 1.400 1.400 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.84219E-03 ppm1 7.114 ppm2 2.312 CV 1
OR { 1317}
(( segid " " and resid 45 and name HE ))
(( segid " " and resid 49 and name HG3 ))
ASSI { 1320}
(( segid " " and resid 45 and name HE ))
(( segid " " and resid 45 and name HG2 ))
3.800 1.800 1.800 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.11442E-02 ppm1 7.113 ppm2 1.527 CV 1
OR { 1320}
(( segid " " and resid 45 and name HE ))
(( segid " " and resid 50 and name HG12))
ASSI { 1327}
(( segid " " and resid 111 and name HE ))
( segid " " and resid 101 and name HG2%)
2.600 2.600 3.400 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.58013E-03 ppm1 7.423 ppm2 0.943 CV 1
OR { 1327}
(( segid " " and resid 111 and name HE ))
( segid " " and resid 114 and name HD1%)
OR { 1327}
(( segid " " and resid 111 and name HE ))
( segid " " and resid 114 and name HG2%)
OR { 1327}
(( segid " " and resid 111 and name HE ))
( segid " " and resid 115 and name HG2%)
ASSI { 1328}
(( segid " " and resid 109 and name HE ))
( segid " " and resid 105 and name HD1%)
4.000 2.000 2.000 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.53815E-03 ppm1 6.510 ppm2 1.026 CV 1
OR { 1328}
(( segid " " and resid 109 and name HE ))
( segid " " and resid 101 and name HG2%)
ASSI { 1331}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 69 and name H ))
4.300 2.300 1.700 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.29019E-03 ppm1 8.548 ppm2 8.084 CV 1
OR { 1331}
(( segid " " and resid 70 and name H ))
(( segid " " and resid 71 and name H ))
ASSI { 1}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 73 and name HA ))
2.600 0.900 0.900 peak 1 spectrum 1 weight 0.10000E+01 volume 0.35019E-02 ppm1 1.775 ppm2 4.141 CV 1
OR { 1}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 74 and name HA ))
ASSI { 9}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 51 and name H ))
3.200 1.300 1.300 peak 9 spectrum 1 weight 0.10000E+01 volume 0.21039E-02 ppm1 3.885 ppm2 8.212 CV 1
OR { 9}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 89 and name H ))
OR { 9}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 52 and name H ))
ASSI { 16}
(( segid " " and resid 114 and name HA ))
( segid " " and resid 84 and name HD2%)
4.100 2.100 1.900 peak 16 spectrum 1 weight 0.10000E+01 volume 0.10327E-02 ppm1 3.872 ppm2 0.605 CV 1
OR { 16}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 117 and name HD3 ))
ASSI { 17}
(( segid " " and resid 141 and name HB3 ))
(( segid " " and resid 138 and name HG ))
2.400 2.400 3.600 peak 17 spectrum 1 weight 0.10000E+01 volume 0.79852E-03 ppm1 3.879 ppm2 1.643 CV 1
OR { 17}
(( segid " " and resid 141 and name HB2 ))
(( segid " " and resid 138 and name HG ))
OR { 17}
(( segid " " and resid 141 and name HB3 ))
(( segid " " and resid 138 and name HB2 ))
OR { 17}
(( segid " " and resid 141 and name HB2 ))
(( segid " " and resid 138 and name HB2 ))
OR { 17}
(( segid " " and resid 141 and name HB3 ))
(( segid " " and resid 138 and name HB3 ))
OR { 17}
(( segid " " and resid 141 and name HB2 ))
(( segid " " and resid 138 and name HB3 ))
OR { 17}
(( segid " " and resid 141 and name HB2 ))
(( segid " " and resid 130 and name HG ))
ASSI { 19}
(( segid " " and resid 140 and name HA ))
( segid " " and resid 139 and name HB% )
2.500 2.500 3.500 peak 19 spectrum 1 weight 0.10000E+01 volume 0.71738E-03 ppm1 4.488 ppm2 1.438 CV 1
OR { 19}
(( segid " " and resid 140 and name HA ))
( segid " " and resid 125 and name HB% )
ASSI { 25}
(( segid " " and resid 140 and name HB2 ))
(( segid " " and resid 140 and name HA ))
2.700 0.900 0.900 peak 25 spectrum 1 weight 0.10000E+01 volume 0.37729E-02 ppm1 3.886 ppm2 4.489 CV 1
OR { 25}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 3 and name HA ))
OR { 25}
(( segid " " and resid 140 and name HB3 ))
(( segid " " and resid 140 and name HA ))
OR { 25}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HA ))
ASSI { 31}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 4 and name HG2 ))
3.800 1.800 1.800 peak 31 spectrum 1 weight 0.10000E+01 volume 0.82381E-03 ppm1 3.933 ppm2 1.648 CV 1
OR { 31}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 4 and name HG3 ))
OR { 31}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 45 and name HB3 ))
ASSI { 32}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 4 and name HG3 ))
3.800 1.800 1.800 peak 32 spectrum 1 weight 0.10000E+01 volume 0.10794E-02 ppm1 3.880 ppm2 1.661 CV 1
OR { 32}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 4 and name HG2 ))
OR { 32}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 45 and name HB3 ))
OR { 32}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 45 and name HB2 ))
ASSI { 33}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HB ))
2.300 0.600 0.600 peak 33 spectrum 1 weight 0.10000E+01 volume 0.61198E-02 ppm1 3.956 ppm2 2.211 CV 1
OR { 33}
(( segid " " and resid 110 and name HB3 ))
(( segid " " and resid 113 and name HB2 ))
ASSI { 35}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 53 and name HB2 ))
2.800 1.000 1.000 peak 35 spectrum 1 weight 0.10000E+01 volume 0.19240E-02 ppm1 3.779 ppm2 2.196 CV 1
OR { 35}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HB ))
OR { 35}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 47}
(( segid " " and resid 138 and name HA ))
(( segid " " and resid 139 and name H ))
2.600 0.900 0.900 peak 47 spectrum 1 weight 0.10000E+01 volume 0.31064E-02 ppm1 4.357 ppm2 8.363 CV 1
OR { 47}
(( segid " " and resid 138 and name HA ))
(( segid " " and resid 138 and name H ))
ASSI { 48}
(( segid " " and resid 138 and name HB2 ))
(( segid " " and resid 138 and name H ))
2.900 1.100 1.100 peak 48 spectrum 1 weight 0.10000E+01 volume 0.27415E-02 ppm1 1.658 ppm2 8.366 CV 1
OR { 48}
(( segid " " and resid 138 and name HB3 ))
(( segid " " and resid 138 and name H ))
OR { 48}
(( segid " " and resid 138 and name HB2 ))
(( segid " " and resid 139 and name H ))
ASSI { 50}
(( segid " " and resid 138 and name HG ))
(( segid " " and resid 139 and name H ))
2.500 0.800 0.800 peak 50 spectrum 1 weight 0.10000E+01 volume 0.34599E-02 ppm1 1.659 ppm2 8.363 CV 1
OR { 50}
(( segid " " and resid 86 and name HG3 ))
(( segid " " and resid 86 and name H ))
OR { 50}
(( segid " " and resid 5 and name HG3 ))
(( segid " " and resid 6 and name H ))
OR { 50}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 6 and name H ))
ASSI { 51}
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(( segid " " and resid 75 and name H ))
3.500 1.600 1.600 peak 51 spectrum 1 weight 0.10000E+01 volume 0.23714E-02 ppm1 0.928 ppm2 8.389 CV 1
OR { 51}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 86 and name H ))
OR { 51}
( segid " " and resid 138 and name HD2%)
(( segid " " and resid 139 and name H ))
OR { 51}
( segid " " and resid 138 and name HD2%)
(( segid " " and resid 138 and name H ))
ASSI { 53}
( segid " " and resid 138 and name HD1%)
(( segid " " and resid 139 and name H ))
3.000 1.200 1.200 peak 53 spectrum 1 weight 0.10000E+01 volume 0.24852E-02 ppm1 0.888 ppm2 8.380 CV 1
OR { 53}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 75 and name H ))
ASSI { 54}
(( segid " " and resid 130 and name HG ))
(( segid " " and resid 130 and name H ))
2.900 1.100 1.100 peak 54 spectrum 1 weight 0.10000E+01 volume 0.22792E-02 ppm1 1.641 ppm2 7.770 CV 1
OR { 54}
(( segid " " and resid 128 and name HG2 ))
(( segid " " and resid 129 and name H ))
OR { 54}
(( segid " " and resid 128 and name HG3 ))
(( segid " " and resid 129 and name H ))
ASSI { 55}
(( segid " " and resid 37 and name HG ))
(( segid " " and resid 37 and name H ))
2.000 0.500 0.500 peak 55 spectrum 1 weight 0.10000E+01 volume 0.42147E-02 ppm1 1.667 ppm2 8.582 CV 1
OR { 55}
(( segid " " and resid 134 and name HG2 ))
(( segid " " and resid 134 and name H ))
OR { 55}
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(( segid " " and resid 134 and name H ))
ASSI { 56}
( segid " " and resid 33 and name HG1%)
(( segid " " and resid 37 and name H ))
3.500 1.600 1.600 peak 56 spectrum 1 weight 0.10000E+01 volume 0.25928E-02 ppm1 0.932 ppm2 8.586 CV 1
OR { 56}
( segid " " and resid 130 and name HD2%)
(( segid " " and resid 115 and name H ))
ASSI { 57}
( segid " " and resid 130 and name HD2%)
(( segid " " and resid 128 and name H ))
2.100 2.100 3.900 peak 57 spectrum 1 weight 0.10000E+01 volume 0.21874E-02 ppm1 0.887 ppm2 8.657 CV 1
OR { 57}
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(( segid " " and resid 76 and name H ))
OR { 57}
( segid " " and resid 130 and name HD2%)
(( segid " " and resid 97 and name H ))
ASSI { 59}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 115 and name H ))
2.900 1.100 1.100 peak 59 spectrum 1 weight 0.10000E+01 volume 0.42970E-02 ppm1 0.892 ppm2 8.565 CV 1
OR { 59}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 98 and name H ))
ASSI { 61}
( segid " " and resid 33 and name HG1%)
(( segid " " and resid 34 and name H ))
2.100 0.600 0.600 peak 61 spectrum 1 weight 0.10000E+01 volume 0.79447E-02 ppm1 0.940 ppm2 7.982 CV 1
OR { 61}
( segid " " and resid 33 and name HG1%)
(( segid " " and resid 33 and name H ))
ASSI { 63}
( segid " " and resid 130 and name HD2%)
(( segid " " and resid 130 and name H ))
3.500 1.600 1.600 peak 63 spectrum 1 weight 0.10000E+01 volume 0.36930E-02 ppm1 0.930 ppm2 7.761 CV 1
OR { 63}
( segid " " and resid 33 and name HG1%)
(( segid " " and resid 67 and name H ))
ASSI { 64}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 85 and name H ))
3.100 1.200 1.200 peak 64 spectrum 1 weight 0.10000E+01 volume 0.60911E-02 ppm1 0.942 ppm2 8.135 CV 1
OR { 64}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 82 and name H ))
OR { 64}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 83 and name H ))
ASSI { 66}
( segid " " and resid 130 and name HD2%)
(( segid " " and resid 131 and name H ))
2.900 2.900 3.100 peak 66 spectrum 1 weight 0.10000E+01 volume 0.18790E-02 ppm1 0.934 ppm2 7.406 CV 1
OR { 66}
( segid " " and resid 33 and name HG1%)
(( segid " " and resid 39 and name HD2 ))
OR { 66}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 76 and name HE3 ))
ASSI { 68}
( segid " " and resid 82 and name HD2%)
(( segid " " and resid 85 and name HE22))
2.500 0.800 0.800 peak 68 spectrum 1 weight 0.10000E+01 volume 0.66572E-02 ppm1 0.933 ppm2 7.227 CV 1
OR { 68}
( segid " " and resid 130 and name HD2%)
( segid " " and resid 88 and name HE% )
ASSI { 72}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 114 and name H ))
4.100 2.100 1.900 peak 72 spectrum 1 weight 0.10000E+01 volume 0.12394E-02 ppm1 0.894 ppm2 8.103 CV 1
OR { 72}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 116 and name H ))
ASSI { 74}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 113 and name H ))
4.700 2.800 1.300 peak 74 spectrum 1 weight 0.10000E+01 volume 0.44124E-03 ppm1 0.895 ppm2 7.530 CV 1
OR { 74}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 117 and name H ))
ASSI { 75}
( segid " " and resid 98 and name HD1%)
( segid " " and resid 131 and name HD% )
4.000 2.000 2.000 peak 75 spectrum 1 weight 0.10000E+01 volume 0.13637E-02 ppm1 0.893 ppm2 7.117 CV 1
OR { 75}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 76 and name HZ2 ))
OR { 75}
( segid " " and resid 98 and name HD1%)
( segid " " and resid 91 and name HD% )
OR { 75}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 88 and name HZ ))
ASSI { 78}
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( segid " " and resid 21 and name HD% )
4.200 2.200 1.800 peak 78 spectrum 1 weight 0.10000E+01 volume 0.27206E-02 ppm1 0.947 ppm2 6.891 CV 1
OR { 78}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 9 and name HZ2 ))
ASSI { 79}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 83 and name H ))
3.300 1.300 1.300 peak 79 spectrum 1 weight 0.10000E+01 volume 0.17291E-02 ppm1 0.945 ppm2 8.103 CV 1
OR { 79}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 85 and name H ))
ASSI { 81}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 39 and name H ))
2.500 2.500 3.500 peak 81 spectrum 1 weight 0.10000E+01 volume 0.85131E-03 ppm1 0.945 ppm2 7.551 CV 1
OR { 81}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 38 and name H ))
OR { 81}
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ASSI { 82}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 39 and name H ))
3.400 1.400 1.400 peak 82 spectrum 1 weight 0.10000E+01 volume 0.84571E-03 ppm1 0.939 ppm2 7.502 CV 1
OR { 82}
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(( segid " " and resid 41 and name HD21))
OR { 82}
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(( segid " " and resid 80 and name HE21))
ASSI { 85}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HA ))
2.300 0.700 0.700 peak 85 spectrum 1 weight 0.10000E+01 volume 0.11131E-01 ppm1 1.654 ppm2 4.331 CV 1
OR { 85}
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(( segid " " and resid 5 and name HA ))
OR { 85}
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(( segid " " and resid 130 and name HA ))
OR { 85}
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(( segid " " and resid 5 and name HA ))
OR { 85}
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(( segid " " and resid 138 and name HA ))
OR { 85}
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(( segid " " and resid 4 and name HA ))
OR { 85}
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ASSI { 86}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HA ))
2.300 0.700 0.700 peak 86 spectrum 1 weight 0.10000E+01 volume 0.10122E-01 ppm1 1.636 ppm2 4.315 CV 1
OR { 86}
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(( segid " " and resid 5 and name HA ))
OR { 86}
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OR { 86}
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(( segid " " and resid 138 and name HA ))
OR { 86}
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ASSI { 87}
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(( segid " " and resid 75 and name HA ))
3.100 1.200 1.200 peak 87 spectrum 1 weight 0.10000E+01 volume 0.40920E-02 ppm1 0.937 ppm2 4.454 CV 1
OR { 87}
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(( segid " " and resid 40 and name HA ))
ASSI { 93}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 98 and name HA ))
2.400 0.700 0.700 peak 93 spectrum 1 weight 0.10000E+01 volume 0.56302E-02 ppm1 0.892 ppm2 3.998 CV 1
OR { 93}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 111 and name HA ))
ASSI { 94}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 130 and name HA ))
4.100 2.100 1.900 peak 94 spectrum 1 weight 0.10000E+01 volume 0.75959E-03 ppm1 0.892 ppm2 4.296 CV 1
OR { 94}
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(( segid " " and resid 113 and name HA ))
OR { 94}
( segid " " and resid 98 and name HD1%)
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OR { 94}
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(( segid " " and resid 110 and name HB2 ))
OR { 94}
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ASSI { 95}
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(( segid " " and resid 82 and name HA ))
3.100 1.200 1.200 peak 95 spectrum 1 weight 0.10000E+01 volume 0.50080E-02 ppm1 0.979 ppm2 4.221 CV 1
OR { 95}
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(( segid " " and resid 42 and name HB ))
ASSI { 98}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 74 and name HA ))
2.100 2.100 3.900 peak 98 spectrum 1 weight 0.10000E+01 volume 0.18781E-02 ppm1 0.888 ppm2 4.099 CV 1
OR { 98}
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(( segid " " and resid 119 and name HA ))
OR { 98}
( segid " " and resid 130 and name HD2%)
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ASSI { 100}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 101 and name HA ))
4.300 2.300 1.700 peak 100 spectrum 1 weight 0.10000E+01 volume 0.11270E-02 ppm1 0.895 ppm2 3.657 CV 1
OR { 100}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 97 and name HA ))
ASSI { 102}
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(( segid " " and resid 37 and name HA ))
2.600 0.900 0.900 peak 102 spectrum 1 weight 0.10000E+01 volume 0.30640E-02 ppm1 1.556 ppm2 3.950 CV 1
OR { 102}
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(( segid " " and resid 34 and name HA ))
ASSI { 103}
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(( segid " " and resid 4 and name HD2 ))
1.900 0.500 0.500 peak 103 spectrum 1 weight 0.10000E+01 volume 0.22700E-01 ppm1 1.700 ppm2 3.227 CV 1
OR { 103}
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(( segid " " and resid 134 and name HD3 ))
OR { 103}
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(( segid " " and resid 134 and name HD2 ))
OR { 103}
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(( segid " " and resid 4 and name HD3 ))
OR { 103}
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(( segid " " and resid 134 and name HD2 ))
OR { 103}
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(( segid " " and resid 134 and name HD3 ))
OR { 103}
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(( segid " " and resid 4 and name HD3 ))
OR { 103}
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ASSI { 104}
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(( segid " " and resid 5 and name HD2 ))
1.800 0.400 0.400 peak 104 spectrum 1 weight 0.10000E+01 volume 0.37324E-01 ppm1 1.657 ppm2 3.220 CV 1
OR { 104}
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(( segid " " and resid 4 and name HD2 ))
OR { 104}
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(( segid " " and resid 134 and name HD3 ))
OR { 104}
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(( segid " " and resid 134 and name HD2 ))
OR { 104}
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(( segid " " and resid 4 and name HD3 ))
OR { 104}
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(( segid " " and resid 5 and name HD3 ))
OR { 104}
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(( segid " " and resid 134 and name HD3 ))
OR { 104}
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(( segid " " and resid 5 and name HD2 ))
OR { 104}
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(( segid " " and resid 5 and name HD3 ))
OR { 104}
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(( segid " " and resid 4 and name HD3 ))
OR { 104}
(( segid " " and resid 4 and name HG3 ))
(( segid " " and resid 4 and name HD2 ))
ASSI { 105}
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(( segid " " and resid 5 and name HD2 ))
1.800 0.400 0.400 peak 105 spectrum 1 weight 0.10000E+01 volume 0.40752E-01 ppm1 1.638 ppm2 3.205 CV 1
OR { 105}
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(( segid " " and resid 4 and name HD2 ))
OR { 105}
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(( segid " " and resid 128 and name HD3 ))
OR { 105}
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(( segid " " and resid 4 and name HD3 ))
OR { 105}
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(( segid " " and resid 128 and name HD2 ))
OR { 105}
(( segid " " and resid 128 and name HG3 ))
(( segid " " and resid 128 and name HD2 ))
OR { 105}
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(( segid " " and resid 5 and name HD3 ))
OR { 105}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HD2 ))
OR { 105}
(( segid " " and resid 5 and name HG3 ))
(( segid " " and resid 5 and name HD3 ))
OR { 105}
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(( segid " " and resid 4 and name HD3 ))
ASSI { 106}
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(( segid " " and resid 115 and name HA ))
3.400 1.500 1.500 peak 106 spectrum 1 weight 0.10000E+01 volume 0.19632E-02 ppm1 0.893 ppm2 3.338 CV 1
OR { 106}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 111 and name HD2 ))
ASSI { 107}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 111 and name HD2 ))
3.200 1.300 1.300 peak 107 spectrum 1 weight 0.10000E+01 volume 0.27839E-02 ppm1 0.892 ppm2 3.247 CV 1
OR { 107}
( segid " " and resid 98 and name HD1%)
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ASSI { 246}
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ASSI { 268}
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(( segid " " and resid 133 and name HB3 ))
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(( segid " " and resid 132 and name HB2 ))
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ASSI { 269}
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3.000 1.100 1.100 peak 270 spectrum 1 weight 0.10000E+01 volume 0.22313E-02 ppm1 1.471 ppm2 8.487 CV 1
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3.700 1.700 1.700 peak 271 spectrum 1 weight 0.10000E+01 volume 0.14522E-02 ppm1 1.736 ppm2 8.492 CV 1
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ASSI { 273}
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2.700 0.900 0.900 peak 273 spectrum 1 weight 0.10000E+01 volume 0.18335E-02 ppm1 1.737 ppm2 7.870 CV 1
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ASSI { 274}
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ASSI { 275}
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3.300 1.300 1.300 peak 275 spectrum 1 weight 0.10000E+01 volume 0.16895E-02 ppm1 1.512 ppm2 8.333 CV 1
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ASSI { 281}
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1.500 0.300 0.700 peak 281 spectrum 1 weight 0.10000E+01 volume 0.74452E-01 ppm1 1.731 ppm2 1.503 CV 1
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(( segid " " and resid 132 and name HG2 ))
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(( segid " " and resid 132 and name HD2 ))
(( segid " " and resid 132 and name HG2 ))
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1.600 0.300 0.600 peak 282 spectrum 1 weight 0.10000E+01 volume 0.70502E-01 ppm1 1.700 ppm2 1.498 CV 1
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ASSI { 283}
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2.100 0.500 0.500 peak 283 spectrum 1 weight 0.10000E+01 volume 0.18014E-01 ppm1 4.380 ppm2 1.485 CV 1
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ASSI { 284}
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3.700 1.700 1.700 peak 284 spectrum 1 weight 0.10000E+01 volume 0.24730E-02 ppm1 4.374 ppm2 3.037 CV 1
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ASSI { 297}
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2.700 0.900 0.900 peak 297 spectrum 1 weight 0.10000E+01 volume 0.29448E-02 ppm1 4.730 ppm2 3.324 CV 1
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ASSI { 300}
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3.400 1.500 1.500 peak 300 spectrum 1 weight 0.10000E+01 volume 0.11429E-02 ppm1 3.276 ppm2 1.833 CV 1
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(( segid " " and resid 133 and name HB3 ))
OR { 300}
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(( segid " " and resid 132 and name HB2 ))
OR { 300}
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(( segid " " and resid 132 and name HB3 ))
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ASSI { 301}
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3.400 1.400 1.400 peak 301 spectrum 1 weight 0.10000E+01 volume 0.11134E-02 ppm1 3.280 ppm2 1.696 CV 1
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(( segid " " and resid 130 and name HB3 ))
ASSI { 302}
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3.800 1.800 1.800 peak 302 spectrum 1 weight 0.10000E+01 volume 0.13590E-02 ppm1 2.841 ppm2 0.966 CV 1
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( segid " " and resid 40 and name HD1%)
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( segid " " and resid 40 and name HD1%)
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ASSI { 304}
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3.300 1.300 1.300 peak 304 spectrum 1 weight 0.10000E+01 volume 0.19116E-02 ppm1 2.841 ppm2 1.976 CV 1
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(( segid " " and resid 57 and name HG2 ))
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ASSI { 306}
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2.700 0.900 0.900 peak 306 spectrum 1 weight 0.10000E+01 volume 0.23715E-02 ppm1 2.851 ppm2 2.402 CV 1
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(( segid " " and resid 14 and name HB2 ))
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ASSI { 314}
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2.100 2.100 3.900 peak 314 spectrum 1 weight 0.10000E+01 volume 0.18798E-02 ppm1 6.742 ppm2 1.566 CV 1
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( segid " " and resid 131 and name HE% )
(( segid " " and resid 133 and name HG2 ))
ASSI { 315}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 130 and name HB2 ))
3.000 1.100 1.100 peak 315 spectrum 1 weight 0.10000E+01 volume 0.18179E-02 ppm1 6.741 ppm2 1.446 CV 1
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( segid " " and resid 131 and name HE% )
( segid " " and resid 112 and name HB% )
ASSI { 325}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 130 and name H ))
2.500 2.500 3.500 peak 325 spectrum 1 weight 0.10000E+01 volume 0.74065E-03 ppm1 6.741 ppm2 7.761 CV 1
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( segid " " and resid 131 and name HE% )
(( segid " " and resid 129 and name H ))
ASSI { 335}
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2.900 1.100 1.100 peak 335 spectrum 1 weight 0.10000E+01 volume 0.13208E-02 ppm1 1.410 ppm2 7.763 CV 1
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(( segid " " and resid 129 and name H ))
ASSI { 338}
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3.700 1.800 1.800 peak 338 spectrum 1 weight 0.10000E+01 volume 0.12572E-02 ppm1 1.686 ppm2 2.238 CV 1
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(( segid " " and resid 85 and name HB3 ))
ASSI { 339}
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2.000 0.500 0.500 peak 339 spectrum 1 weight 0.10000E+01 volume 0.43686E-02 ppm1 1.432 ppm2 1.720 CV 1
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(( segid " " and resid 98 and name HG ))
ASSI { 340}
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2.100 0.500 0.500 peak 340 spectrum 1 weight 0.10000E+01 volume 0.34779E-02 ppm1 1.398 ppm2 1.692 CV 1
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(( segid " " and resid 98 and name HG ))
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ASSI { 345}
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2.400 2.400 3.600 peak 345 spectrum 1 weight 0.10000E+01 volume 0.81646E-03 ppm1 0.975 ppm2 8.112 CV 1
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(( segid " " and resid 120 and name H ))
ASSI { 346}
( segid " " and resid 130 and name HD1%)
(( segid " " and resid 115 and name H ))
4.000 2.000 2.000 peak 346 spectrum 1 weight 0.10000E+01 volume 0.97495E-03 ppm1 0.969 ppm2 8.569 CV 1
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(( segid " " and resid 128 and name H ))
ASSI { 349}
( segid " " and resid 130 and name HD1%)
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3.800 1.800 1.800 peak 349 spectrum 1 weight 0.10000E+01 volume 0.10690E-02 ppm1 0.971 ppm2 4.038 CV 1
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(( segid " " and resid 128 and name HA ))
ASSI { 353}
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1.900 0.500 0.500 peak 353 spectrum 1 weight 0.10000E+01 volume 0.16268E-01 ppm1 0.939 ppm2 4.214 CV 1
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(( segid " " and resid 82 and name HA ))
ASSI { 363}
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2.500 0.800 0.800 peak 363 spectrum 1 weight 0.10000E+01 volume 0.28768E-02 ppm1 0.976 ppm2 2.221 CV 1
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(( segid " " and resid 129 and name HB2 ))
ASSI { 364}
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2.600 0.800 0.800 peak 364 spectrum 1 weight 0.10000E+01 volume 0.37116E-02 ppm1 4.143 ppm2 7.775 CV 1
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(( segid " " and resid 129 and name H ))
ASSI { 365}
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2.800 1.000 1.000 peak 365 spectrum 1 weight 0.10000E+01 volume 0.21409E-02 ppm1 2.242 ppm2 7.779 CV 1
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(( segid " " and resid 130 and name H ))
ASSI { 366}
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2.400 0.700 0.700 peak 366 spectrum 1 weight 0.10000E+01 volume 0.39175E-02 ppm1 2.394 ppm2 7.782 CV 1
OR { 366}
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(( segid " " and resid 129 and name H ))
OR { 366}
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ASSI { 367}
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3.400 1.500 1.500 peak 367 spectrum 1 weight 0.10000E+01 volume 0.26290E-02 ppm1 2.174 ppm2 7.776 CV 1
OR { 367}
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(( segid " " and resid 130 and name H ))
ASSI { 368}
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2.800 1.000 1.000 peak 368 spectrum 1 weight 0.10000E+01 volume 0.32563E-02 ppm1 4.149 ppm2 7.465 CV 1
OR { 368}
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ASSI { 372}
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(( segid " " and resid 86 and name HA ))
OR { 372}
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(( segid " " and resid 28 and name HA ))
ASSI { 375}
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3.800 1.800 1.800 peak 375 spectrum 1 weight 0.10000E+01 volume 0.20158E-02 ppm1 2.234 ppm2 1.711 CV 1
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(( segid " " and resid 130 and name HB3 ))
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(( segid " " and resid 113 and name HB3 ))
(( segid " " and resid 98 and name HG ))
OR { 375}
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ASSI { 376}
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3.500 1.500 1.500 peak 376 spectrum 1 weight 0.10000E+01 volume 0.14949E-02 ppm1 2.230 ppm2 1.472 CV 1
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(( segid " " and resid 109 and name HB3 ))
OR { 376}
(( segid " " and resid 113 and name HB3 ))
(( segid " " and resid 109 and name HG3 ))
OR { 376}
(( segid " " and resid 113 and name HB3 ))
( segid " " and resid 112 and name HB% )
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(( segid " " and resid 109 and name HB3 ))
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(( segid " " and resid 113 and name HB2 ))
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ASSI { 378}
(( segid " " and resid 129 and name HG2 ))
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3.100 1.200 1.200 peak 378 spectrum 1 weight 0.10000E+01 volume 0.19347E-02 ppm1 2.400 ppm2 1.481 CV 1
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(( segid " " and resid 40 and name HB3 ))
OR { 378}
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(( segid " " and resid 17 and name HG ))
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OR { 378}
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(( segid " " and resid 45 and name HG2 ))
OR { 378}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 45 and name HG2 ))
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(( segid " " and resid 13 and name HG2 ))
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ASSI { 379}
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3.100 1.200 1.200 peak 379 spectrum 1 weight 0.10000E+01 volume 0.46151E-02 ppm1 2.396 ppm2 1.943 CV 1
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(( segid " " and resid 43 and name HB ))
OR { 379}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 40 and name HG ))
OR { 379}
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(( segid " " and resid 12 and name HB3 ))
OR { 379}
(( segid " " and resid 13 and name HG3 ))
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ASSI { 380}
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2.000 0.500 0.500 peak 380 spectrum 1 weight 0.10000E+01 volume 0.19353E-01 ppm1 2.396 ppm2 2.253 CV 1
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(( segid " " and resid 126 and name HG3 ))
OR { 380}
(( segid " " and resid 129 and name HG2 ))
(( segid " " and resid 129 and name HB3 ))
OR { 380}
(( segid " " and resid 129 and name HG2 ))
(( segid " " and resid 126 and name HG2 ))
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(( segid " " and resid 129 and name HG3 ))
(( segid " " and resid 126 and name HG3 ))
ASSI { 382}
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4.600 2.600 1.400 peak 382 spectrum 1 weight 0.10000E+01 volume 0.83371E-03 ppm1 2.234 ppm2 0.516 CV 1
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( segid " " and resid 124 and name HG1%)
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ASSI { 383}
(( segid " " and resid 113 and name HB3 ))
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4.700 2.700 1.300 peak 383 spectrum 1 weight 0.10000E+01 volume 0.70681E-03 ppm1 2.176 ppm2 0.517 CV 1
OR { 383}
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( segid " " and resid 124 and name HG1%)
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(( segid " " and resid 113 and name HB2 ))
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2.700 0.900 0.900 peak 391 spectrum 1 weight 0.10000E+01 volume 0.27851E-02 ppm1 4.046 ppm2 8.599 CV 1
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(( segid " " and resid 128 and name H ))
ASSI { 392}
(( segid " " and resid 128 and name HA ))
(( segid " " and resid 129 and name H ))
3.000 1.100 1.100 peak 392 spectrum 1 weight 0.10000E+01 volume 0.18444E-02 ppm1 4.046 ppm2 7.773 CV 1
OR { 392}
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(( segid " " and resid 130 and name H ))
ASSI { 396}
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4.000 2.000 2.000 peak 396 spectrum 1 weight 0.10000E+01 volume 0.83552E-03 ppm1 3.201 ppm2 7.785 CV 1
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(( segid " " and resid 129 and name H ))
OR { 396}
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(( segid " " and resid 127 and name HD2 ))
(( segid " " and resid 129 and name H ))
ASSI { 397}
(( segid " " and resid 128 and name HD3 ))
(( segid " " and resid 128 and name H ))
3.900 1.900 1.900 peak 397 spectrum 1 weight 0.10000E+01 volume 0.13112E-02 ppm1 3.198 ppm2 8.606 CV 1
OR { 397}
(( segid " " and resid 128 and name HD2 ))
(( segid " " and resid 128 and name H ))
OR { 397}
(( segid " " and resid 127 and name HD2 ))
(( segid " " and resid 115 and name H ))
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(( segid " " and resid 111 and name HD3 ))
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ASSI { 398}
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(( segid " " and resid 127 and name H ))
3.100 1.200 1.200 peak 398 spectrum 1 weight 0.10000E+01 volume 0.95504E-03 ppm1 3.738 ppm2 9.008 CV 1
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(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name H ))
ASSI { 399}
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3.300 1.400 1.400 peak 399 spectrum 1 weight 0.10000E+01 volume 0.13586E-02 ppm1 3.746 ppm2 7.758 CV 1
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(( segid " " and resid 127 and name HA ))
(( segid " " and resid 129 and name H ))
ASSI { 400}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 50 and name H ))
3.200 1.300 1.300 peak 400 spectrum 1 weight 0.10000E+01 volume 0.13390E-02 ppm1 3.733 ppm2 8.206 CV 1
OR { 400}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 51 and name H ))
ASSI { 401}
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3.800 1.800 1.800 peak 401 spectrum 1 weight 0.10000E+01 volume 0.58209E-03 ppm1 3.753 ppm2 8.602 CV 1
OR { 401}
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(( segid " " and resid 22 and name H ))
ASSI { 402}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name H ))
3.100 1.200 1.200 peak 402 spectrum 1 weight 0.10000E+01 volume 0.92251E-03 ppm1 3.740 ppm2 8.320 CV 1
OR { 402}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name H ))
ASSI { 403}
(( segid " " and resid 47 and name HG3 ))
(( segid " " and resid 47 and name H ))
4.100 2.100 1.900 peak 403 spectrum 1 weight 0.10000E+01 volume 0.67363E-03 ppm1 1.745 ppm2 9.012 CV 1
OR { 403}
(( segid " " and resid 127 and name HG2 ))
(( segid " " and resid 127 and name H ))
OR { 403}
(( segid " " and resid 111 and name HG2 ))
(( segid " " and resid 111 and name H ))
ASSI { 406}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 9 and name HH2 ))
3.900 1.900 1.900 peak 406 spectrum 1 weight 0.10000E+01 volume 0.60068E-03 ppm1 1.555 ppm2 6.732 CV 1
OR { 406}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 9 and name HH2 ))
OR { 406}
(( segid " " and resid 127 and name HG3 ))
( segid " " and resid 131 and name HE% )
ASSI { 417}
(( segid " " and resid 126 and name HA ))
(( segid " " and resid 126 and name HB2 ))
2.400 0.700 0.700 peak 417 spectrum 1 weight 0.10000E+01 volume 0.64533E-02 ppm1 4.569 ppm2 2.205 CV 1
OR { 417}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HG3 ))
ASSI { 439}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 125 and name H ))
4.000 2.000 2.000 peak 439 spectrum 1 weight 0.10000E+01 volume 0.10178E-02 ppm1 2.304 ppm2 8.854 CV 1
OR { 439}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 29 and name H ))
ASSI { 440}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 28 and name H ))
3.500 1.500 1.500 peak 440 spectrum 1 weight 0.10000E+01 volume 0.34491E-02 ppm1 2.309 ppm2 8.623 CV 1
OR { 440}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 128 and name H ))
ASSI { 442}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 31 and name H ))
4.700 2.700 1.300 peak 442 spectrum 1 weight 0.10000E+01 volume 0.63608E-03 ppm1 2.208 ppm2 8.855 CV 1
OR { 442}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 125 and name H ))
ASSI { 443}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 28 and name H ))
2.900 1.100 1.100 peak 443 spectrum 1 weight 0.10000E+01 volume 0.32617E-02 ppm1 2.254 ppm2 8.622 CV 1
OR { 443}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 128 and name H ))
OR { 443}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 28 and name H ))
ASSI { 446}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 124 and name HA ))
4.100 2.100 1.900 peak 446 spectrum 1 weight 0.10000E+01 volume 0.84038E-03 ppm1 2.299 ppm2 4.293 CV 1
OR { 446}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 130 and name HA ))
ASSI { 447}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 124 and name HA ))
4.700 2.700 1.300 peak 447 spectrum 1 weight 0.10000E+01 volume 0.65003E-03 ppm1 2.207 ppm2 4.302 CV 1
OR { 447}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 130 and name HA ))
ASSI { 448}
(( segid " " and resid 50 and name HB ))
(( segid " " and resid 50 and name HA ))
3.100 1.200 1.200 peak 448 spectrum 1 weight 0.10000E+01 volume 0.13104E-02 ppm1 2.184 ppm2 3.758 CV 1
OR { 448}
(( segid " " and resid 50 and name HB ))
(( segid " " and resid 47 and name HA ))
ASSI { 451}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 27 and name HA ))
3.800 1.800 1.800 peak 451 spectrum 1 weight 0.10000E+01 volume 0.14172E-02 ppm1 2.310 ppm2 3.893 CV 1
OR { 451}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 141 and name HB2 ))
ASSI { 452}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 127 and name HA ))
4.500 2.500 1.500 peak 452 spectrum 1 weight 0.10000E+01 volume 0.87687E-03 ppm1 2.307 ppm2 3.751 CV 1
OR { 452}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 29 and name HA3 ))
ASSI { 458}
(( segid " " and resid 126 and name HG2 ))
( segid " " and resid 130 and name HD2%)
3.300 1.400 1.400 peak 458 spectrum 1 weight 0.10000E+01 volume 0.33525E-02 ppm1 2.309 ppm2 0.909 CV 1
OR { 458}
(( segid " " and resid 28 and name HG2 ))
( segid " " and resid 27 and name HG2%)
ASSI { 460}
(( segid " " and resid 126 and name HG3 ))
( segid " " and resid 125 and name HB% )
2.300 2.300 3.700 peak 460 spectrum 1 weight 0.10000E+01 volume 0.47836E-02 ppm1 2.205 ppm2 1.471 CV 1
OR { 460}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 51 and name HG12))
OR { 460}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 40 and name HB3 ))
ASSI { 461}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 128 and name HG2 ))
3.600 1.600 1.600 peak 461 spectrum 1 weight 0.10000E+01 volume 0.31085E-02 ppm1 2.298 ppm2 1.612 CV 1
OR { 461}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 128 and name HG3 ))
OR { 461}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 130 and name HG ))
ASSI { 462}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 128 and name HG2 ))
3.000 1.100 1.100 peak 462 spectrum 1 weight 0.10000E+01 volume 0.34659E-02 ppm1 2.202 ppm2 1.624 CV 1
OR { 462}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 128 and name HG3 ))
OR { 462}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 37 and name HG ))
OR { 462}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 130 and name HG ))
ASSI { 463}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 28 and name HB2 ))
2.000 0.500 0.500 peak 463 spectrum 1 weight 0.10000E+01 volume 0.23131E-01 ppm1 2.307 ppm2 1.982 CV 1
OR { 463}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 126 and name HB3 ))
OR { 463}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 28 and name HB3 ))
ASSI { 464}
(( segid " " and resid 125 and name HA ))
( segid " " and resid 124 and name HG2%)
3.800 1.800 1.800 peak 464 spectrum 1 weight 0.10000E+01 volume 0.11089E-02 ppm1 4.306 ppm2 0.802 CV 1
OR { 464}
(( segid " " and resid 125 and name HA ))
( segid " " and resid 119 and name HD2%)
ASSI { 467}
(( segid " " and resid 125 and name HA ))
(( segid " " and resid 124 and name HB ))
4.800 2.900 1.200 peak 467 spectrum 1 weight 0.10000E+01 volume 0.59774E-03 ppm1 4.296 ppm2 1.900 CV 1
OR { 467}
(( segid " " and resid 125 and name HA ))
(( segid " " and resid 127 and name HB2 ))
ASSI { 475}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 126 and name HG3 ))
3.300 1.300 1.300 peak 475 spectrum 1 weight 0.10000E+01 volume 0.63710E-02 ppm1 1.465 ppm2 2.211 CV 1
OR { 475}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 126 and name HB2 ))
OR { 475}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 129 and name HB3 ))
ASSI { 476}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 124 and name HB ))
3.800 1.800 1.800 peak 476 spectrum 1 weight 0.10000E+01 volume 0.39014E-02 ppm1 1.467 ppm2 1.901 CV 1
OR { 476}
( segid " " and resid 125 and name HB% )
(( segid " " and resid 128 and name HB3 ))
ASSI { 488}
(( segid " " and resid 124 and name HA ))
( segid " " and resid 125 and name HB% )
3.600 1.600 1.600 peak 488 spectrum 1 weight 0.10000E+01 volume 0.25609E-02 ppm1 4.268 ppm2 1.468 CV 1
OR { 488}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 48 and name HG3 ))
ASSI { 496}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 129 and name HB3 ))
3.800 1.800 1.800 peak 496 spectrum 1 weight 0.10000E+01 volume 0.25034E-02 ppm1 1.894 ppm2 2.209 CV 1
OR { 496}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 129 and name HB2 ))
OR { 496}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 115 and name HB ))
OR { 496}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 126 and name HG3 ))
ASSI { 502}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 126 and name HG3 ))
2.900 1.100 1.100 peak 502 spectrum 1 weight 0.10000E+01 volume 0.91083E-02 ppm1 0.806 ppm2 2.225 CV 1
OR { 502}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 129 and name HB3 ))
OR { 502}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 115 and name HB ))
ASSI { 505}
( segid " " and resid 124 and name HG2%)
( segid " " and resid 125 and name HB% )
2.900 1.100 1.100 peak 505 spectrum 1 weight 0.10000E+01 volume 0.86185E-02 ppm1 0.805 ppm2 1.468 CV 1
OR { 505}
( segid " " and resid 123 and name HD1%)
(( segid " " and resid 121 and name HB3 ))
ASSI { 506}
( segid " " and resid 123 and name HD1%)
(( segid " " and resid 88 and name HB3 ))
3.000 1.100 1.100 peak 506 spectrum 1 weight 0.10000E+01 volume 0.14388E-02 ppm1 0.802 ppm2 3.216 CV 1
OR { 506}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 52 and name HB2 ))
ASSI { 507}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 124 and name HA ))
2.500 0.800 0.800 peak 507 spectrum 1 weight 0.10000E+01 volume 0.75813E-02 ppm1 0.807 ppm2 4.274 CV 1
OR { 507}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 125 and name HA ))
ASSI { 508}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 119 and name HA ))
3.100 1.200 1.200 peak 508 spectrum 1 weight 0.10000E+01 volume 0.38077E-02 ppm1 0.807 ppm2 4.154 CV 1
OR { 508}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 129 and name HA ))
ASSI { 509}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 127 and name HA ))
3.000 1.200 1.200 peak 509 spectrum 1 weight 0.10000E+01 volume 0.29930E-02 ppm1 0.804 ppm2 3.749 CV 1
OR { 509}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 62 and name HB3 ))
ASSI { 511}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 115 and name HB ))
3.400 1.400 1.400 peak 511 spectrum 1 weight 0.10000E+01 volume 0.36821E-02 ppm1 0.514 ppm2 2.216 CV 1
OR { 511}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 126 and name HG3 ))
OR { 511}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 129 and name HB3 ))
ASSI { 512}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 124 and name HB ))
2.000 0.500 0.500 peak 512 spectrum 1 weight 0.10000E+01 volume 0.11894E-01 ppm1 0.514 ppm2 1.894 CV 1
OR { 512}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 118 and name HG ))
ASSI { 513}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 119 and name HB2 ))
3.400 1.500 1.500 peak 513 spectrum 1 weight 0.10000E+01 volume 0.37848E-02 ppm1 0.514 ppm2 1.737 CV 1
OR { 513}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 127 and name HG2 ))
ASSI { 514}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 118 and name HB3 ))
2.000 0.500 0.500 peak 514 spectrum 1 weight 0.10000E+01 volume 0.72638E-02 ppm1 0.514 ppm2 1.552 CV 1
OR { 514}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 119 and name HG ))
ASSI { 516}
( segid " " and resid 124 and name HG1%)
( segid " " and resid 124 and name HG2%)
1.800 0.400 0.400 peak 516 spectrum 1 weight 0.10000E+01 volume 0.31453E-01 ppm1 0.514 ppm2 0.805 CV 1
OR { 516}
( segid " " and resid 124 and name HG1%)
( segid " " and resid 119 and name HD2%)
ASSI { 517}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 124 and name HA ))
3.000 1.100 1.100 peak 517 spectrum 1 weight 0.10000E+01 volume 0.44615E-02 ppm1 0.514 ppm2 4.275 CV 1
OR { 517}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 116 and name HA ))
ASSI { 522}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 115 and name H ))
5.300 3.500 0.700 peak 522 spectrum 1 weight 0.10000E+01 volume 0.37999E-03 ppm1 0.515 ppm2 8.583 CV 1
OR { 522}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 128 and name H ))
ASSI { 526}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 123 and name H ))
3.200 1.300 1.300 peak 526 spectrum 1 weight 0.10000E+01 volume 0.31421E-02 ppm1 0.514 ppm2 7.607 CV 1
OR { 526}
( segid " " and resid 124 and name HG1%)
(( segid " " and resid 126 and name H ))
ASSI { 529}
( segid " " and resid 123 and name HD1%)
(( segid " " and resid 86 and name H ))
2.600 2.600 3.400 peak 529 spectrum 1 weight 0.10000E+01 volume 0.87539E-03 ppm1 0.805 ppm2 8.392 CV 1
OR { 529}
( segid " " and resid 123 and name HD1%)
(( segid " " and resid 118 and name H ))
OR { 529}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 68 and name H ))
ASSI { 530}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 130 and name H ))
3.400 1.500 1.500 peak 530 spectrum 1 weight 0.10000E+01 volume 0.34374E-02 ppm1 0.807 ppm2 7.776 CV 1
OR { 530}
( segid " " and resid 124 and name HG2%)
(( segid " " and resid 129 and name H ))
ASSI { 534}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 130 and name H ))
5.000 3.100 1.000 peak 534 spectrum 1 weight 0.10000E+01 volume 0.57984E-03 ppm1 1.894 ppm2 7.783 CV 1
OR { 534}
(( segid " " and resid 124 and name HB ))
(( segid " " and resid 129 and name H ))
ASSI { 554}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 118 and name HA ))
3.200 1.300 1.300 peak 554 spectrum 1 weight 0.10000E+01 volume 0.29598E-02 ppm1 0.628 ppm2 3.660 CV 1
OR { 554}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 101 and name HA ))
ASSI { 555}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 115 and name HA ))
4.800 2.900 1.200 peak 555 spectrum 1 weight 0.10000E+01 volume 0.41721E-03 ppm1 0.636 ppm2 3.335 CV 1
OR { 555}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 91 and name HB2 ))
ASSI { 557}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 88 and name HB2 ))
2.300 2.300 3.700 peak 557 spectrum 1 weight 0.10000E+01 volume 0.12277E-02 ppm1 0.631 ppm2 2.949 CV 1
OR { 557}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 92 and name HD2 ))
ASSI { 558}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 89 and name HG3 ))
3.100 1.200 1.200 peak 558 spectrum 1 weight 0.10000E+01 volume 0.29459E-02 ppm1 0.631 ppm2 2.491 CV 1
OR { 558}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 85 and name HG2 ))
ASSI { 561}
( segid " " and resid 123 and name HD1%)
(( segid " " and resid 123 and name HA ))
2.400 0.700 0.700 peak 561 spectrum 1 weight 0.10000E+01 volume 0.17977E-01 ppm1 0.791 ppm2 3.966 CV 1
OR { 561}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 55 and name HA ))
ASSI { 564}
( segid " " and resid 123 and name HD1%)
(( segid " " and resid 89 and name HG3 ))
3.200 1.300 1.300 peak 564 spectrum 1 weight 0.10000E+01 volume 0.37268E-02 ppm1 0.797 ppm2 2.494 CV 1
OR { 564}
( segid " " and resid 123 and name HD1%)
(( segid " " and resid 85 and name HG2 ))
ASSI { 567}
(( segid " " and resid 123 and name HG ))
( segid " " and resid 123 and name HD2%)
2.600 0.800 0.800 peak 567 spectrum 1 weight 0.10000E+01 volume 0.39046E-02 ppm1 1.348 ppm2 0.628 CV 1
OR { 567}
(( segid " " and resid 123 and name HG ))
(( segid " " and resid 123 and name HB3 ))
OR { 567}
(( segid " " and resid 73 and name HG13))
( segid " " and resid 121 and name HD2%)
ASSI { 568}
(( segid " " and resid 123 and name HG ))
(( segid " " and resid 123 and name HA ))
3.500 1.500 1.500 peak 568 spectrum 1 weight 0.10000E+01 volume 0.95654E-03 ppm1 1.350 ppm2 3.965 CV 1
OR { 568}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 81 and name HA ))
ASSI { 570}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 113 and name HB3 ))
4.100 2.100 1.900 peak 570 spectrum 1 weight 0.10000E+01 volume 0.72475E-03 ppm1 1.362 ppm2 2.210 CV 1
OR { 570}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 113 and name HB2 ))
OR { 570}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 114 and name HB ))
OR { 570}
(( segid " " and resid 123 and name HG ))
(( segid " " and resid 85 and name HB3 ))
ASSI { 571}
(( segid " " and resid 123 and name HB2 ))
( segid " " and resid 123 and name HD1%)
3.100 1.200 1.200 peak 571 spectrum 1 weight 0.10000E+01 volume 0.14879E-02 ppm1 1.056 ppm2 0.795 CV 1
OR { 571}
(( segid " " and resid 123 and name HB2 ))
( segid " " and resid 118 and name HD2%)
ASSI { 573}
(( segid " " and resid 123 and name HB2 ))
( segid " " and resid 118 and name HD1%)
3.300 1.400 1.400 peak 573 spectrum 1 weight 0.10000E+01 volume 0.89545E-03 ppm1 1.065 ppm2 0.525 CV 1
OR { 573}
(( segid " " and resid 123 and name HB2 ))
( segid " " and resid 124 and name HG1%)
ASSI { 575}
(( segid " " and resid 123 and name HB3 ))
( segid " " and resid 123 and name HD1%)
3.200 1.300 1.300 peak 575 spectrum 1 weight 0.10000E+01 volume 0.85044E-03 ppm1 0.609 ppm2 0.797 CV 1
OR { 575}
(( segid " " and resid 123 and name HB3 ))
( segid " " and resid 118 and name HD2%)
ASSI { 582}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 63 and name H ))
3.300 1.400 1.400 peak 582 spectrum 1 weight 0.10000E+01 volume 0.15656E-02 ppm1 0.782 ppm2 8.655 CV 1
OR { 582}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 61 and name H ))
ASSI { 583}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 54 and name H ))
3.700 1.700 1.700 peak 583 spectrum 1 weight 0.10000E+01 volume 0.17211E-02 ppm1 0.782 ppm2 8.289 CV 1
OR { 583}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 64 and name H ))
ASSI { 585}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 62 and name H ))
3.400 1.400 1.400 peak 585 spectrum 1 weight 0.10000E+01 volume 0.28021E-02 ppm1 0.786 ppm2 7.857 CV 1
OR { 585}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 57 and name H ))
ASSI { 587}
( segid " " and resid 123 and name HD1%)
( segid " " and resid 88 and name HD% )
2.300 0.700 0.700 peak 587 spectrum 1 weight 0.10000E+01 volume 0.60670E-02 ppm1 0.788 ppm2 7.074 CV 1
OR { 587}
( segid " " and resid 55 and name HG2%)
( segid " " and resid 66 and name HE% )
OR { 587}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 60 and name H ))
ASSI { 590}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 85 and name HE21))
2.200 2.200 3.800 peak 590 spectrum 1 weight 0.10000E+01 volume 0.13591E-02 ppm1 0.629 ppm2 6.808 CV 1
OR { 590}
( segid " " and resid 123 and name HD2%)
(( segid " " and resid 124 and name H ))
ASSI { 597}
(( segid " " and resid 122 and name HA3 ))
(( segid " " and resid 121 and name H ))
5.600 3.900 0.400 peak 597 spectrum 1 weight 0.10000E+01 volume 0.31828E-03 ppm1 3.782 ppm2 8.139 CV 1
OR { 597}
(( segid " " and resid 122 and name HA3 ))
(( segid " " and resid 120 and name H ))
ASSI { 600}
(( segid " " and resid 122 and name HA3 ))
( segid " " and resid 121 and name HD1%)
5.300 3.500 0.700 peak 600 spectrum 1 weight 0.10000E+01 volume 0.43450E-03 ppm1 3.785 ppm2 0.683 CV 1
OR { 600}
(( segid " " and resid 122 and name HA3 ))
( segid " " and resid 119 and name HD1%)
ASSI { 601}
(( segid " " and resid 122 and name HA2 ))
( segid " " and resid 119 and name HD1%)
5.100 3.300 0.900 peak 601 spectrum 1 weight 0.10000E+01 volume 0.30401E-03 ppm1 3.997 ppm2 0.639 CV 1
OR { 601}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 123 and name HB3 ))
OR { 601}
(( segid " " and resid 70 and name HA2 ))
( segid " " and resid 121 and name HD2%)
OR { 601}
(( segid " " and resid 122 and name HA2 ))
( segid " " and resid 123 and name HD2%)
ASSI { 607}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 121 and name H ))
3.000 1.100 1.100 peak 607 spectrum 1 weight 0.10000E+01 volume 0.20148E-02 ppm1 4.153 ppm2 8.136 CV 1
OR { 607}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name H ))
OR { 607}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 71 and name H ))
ASSI { 611}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 122 and name HA3 ))
5.000 3.200 1.000 peak 611 spectrum 1 weight 0.10000E+01 volume 0.35709E-03 ppm1 4.158 ppm2 3.801 CV 1
OR { 611}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HA ))
OR { 611}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 18 and name HA ))
ASSI { 615}
(( segid " " and resid 121 and name HB3 ))
( segid " " and resid 121 and name HD2%)
3.000 1.100 1.100 peak 615 spectrum 1 weight 0.10000E+01 volume 0.13990E-02 ppm1 1.458 ppm2 0.614 CV 1
OR { 615}
(( segid " " and resid 121 and name HB3 ))
( segid " " and resid 123 and name HD2%)
ASSI { 618}
(( segid " " and resid 121 and name HG ))
(( segid " " and resid 121 and name H ))
2.900 1.000 1.000 peak 618 spectrum 1 weight 0.10000E+01 volume 0.11364E-02 ppm1 1.529 ppm2 8.111 CV 1
OR { 618}
(( segid " " and resid 45 and name HG2 ))
(( segid " " and resid 45 and name H ))
ASSI { 619}
(( segid " " and resid 75 and name HG ))
(( segid " " and resid 75 and name H ))
2.700 0.900 0.900 peak 619 spectrum 1 weight 0.10000E+01 volume 0.22653E-02 ppm1 1.584 ppm2 8.388 CV 1
OR { 619}
(( segid " " and resid 5 and name HG3 ))
(( segid " " and resid 6 and name H ))
ASSI { 623}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 122 and name H ))
4.000 2.100 2.000 peak 623 spectrum 1 weight 0.10000E+01 volume 0.12115E-02 ppm1 0.726 ppm2 7.837 CV 1
OR { 623}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 119 and name H ))
ASSI { 624}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 121 and name H ))
3.000 1.100 1.100 peak 624 spectrum 1 weight 0.10000E+01 volume 0.39190E-02 ppm1 0.726 ppm2 8.139 CV 1
OR { 624}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 120 and name H ))
ASSI { 627}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 87 and name H ))
2.800 2.800 3.200 peak 627 spectrum 1 weight 0.10000E+01 volume 0.48596E-03 ppm1 0.733 ppm2 8.643 CV 1
OR { 627}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 81 and name H ))
OR { 627}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 128 and name H ))
ASSI { 628}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 39 and name H ))
3.300 1.400 1.400 peak 628 spectrum 1 weight 0.10000E+01 volume 0.26763E-02 ppm1 0.600 ppm2 7.542 CV 1
OR { 628}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 117 and name H ))
ASSI { 629}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 39 and name HD2 ))
4.100 2.100 1.900 peak 629 spectrum 1 weight 0.10000E+01 volume 0.11071E-02 ppm1 0.600 ppm2 7.407 CV 1
OR { 629}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 76 and name HE3 ))
ASSI { 631}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 76 and name HH2 ))
3.100 1.200 1.200 peak 631 spectrum 1 weight 0.10000E+01 volume 0.17098E-02 ppm1 0.603 ppm2 6.881 CV 1
OR { 631}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 85 and name HE21))
ASSI { 634}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 86 and name H ))
3.400 1.400 1.400 peak 634 spectrum 1 weight 0.10000E+01 volume 0.17461E-02 ppm1 0.602 ppm2 8.392 CV 1
OR { 634}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 74 and name H ))
OR { 634}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 118 and name H ))
ASSI { 635}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 121 and name H ))
2.700 0.900 0.900 peak 635 spectrum 1 weight 0.10000E+01 volume 0.50969E-02 ppm1 0.597 ppm2 8.132 CV 1
OR { 635}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 85 and name H ))
OR { 635}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 73 and name H ))
OR { 635}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 24 and name HD21))
ASSI { 636}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 40 and name H ))
3.300 1.300 1.300 peak 636 spectrum 1 weight 0.10000E+01 volume 0.19767E-02 ppm1 0.598 ppm2 7.864 CV 1
OR { 636}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 23 and name H ))
ASSI { 637}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 73 and name HG12))
2.000 0.500 0.500 peak 637 spectrum 1 weight 0.10000E+01 volume 0.14888E-01 ppm1 0.603 ppm2 1.082 CV 1
OR { 637}
( segid " " and resid 84 and name HD2%)
( segid " " and resid 84 and name HD1%)
ASSI { 638}
( segid " " and resid 84 and name HD2%)
( segid " " and resid 114 and name HG2%)
2.000 0.500 0.500 peak 638 spectrum 1 weight 0.10000E+01 volume 0.20913E-01 ppm1 0.600 ppm2 0.975 CV 1
OR { 638}
( segid " " and resid 84 and name HD2%)
( segid " " and resid 101 and name HD1%)
OR { 638}
( segid " " and resid 84 and name HD2%)
( segid " " and resid 114 and name HD1%)
OR { 638}
( segid " " and resid 20 and name HD2%)
( segid " " and resid 36 and name HG2%)
ASSI { 640}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 84 and name HG ))
2.100 0.600 0.600 peak 640 spectrum 1 weight 0.10000E+01 volume 0.11815E-01 ppm1 0.599 ppm2 1.460 CV 1
OR { 640}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 121 and name HB3 ))
OR { 640}
( segid " " and resid 121 and name HD2%)
( segid " " and resid 120 and name HB% )
ASSI { 641}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 84 and name HB3 ))
2.600 0.800 0.800 peak 641 spectrum 1 weight 0.10000E+01 volume 0.69440E-02 ppm1 0.600 ppm2 2.043 CV 1
OR { 641}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 20 and name HB3 ))
ASSI { 642}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 114 and name HG13))
2.800 1.000 1.000 peak 642 spectrum 1 weight 0.10000E+01 volume 0.68033E-02 ppm1 0.600 ppm2 1.891 CV 1
OR { 642}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 40 and name HB2 ))
OR { 642}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 40 and name HG ))
ASSI { 643}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 89 and name HG3 ))
2.900 2.900 3.100 peak 643 spectrum 1 weight 0.10000E+01 volume 0.27646E-02 ppm1 0.597 ppm2 2.481 CV 1
OR { 643}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 24 and name HB2 ))
OR { 643}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 85 and name HG2 ))
ASSI { 644}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 87 and name HB2 ))
3.100 1.200 1.200 peak 644 spectrum 1 weight 0.10000E+01 volume 0.43230E-02 ppm1 0.600 ppm2 2.258 CV 1
OR { 644}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 19 and name HB3 ))
OR { 644}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 114 and name HB ))
OR { 644}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 36 and name HG12))
ASSI { 646}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 71 and name HB ))
2.800 0.900 0.900 peak 646 spectrum 1 weight 0.10000E+01 volume 0.31828E-02 ppm1 0.597 ppm2 4.145 CV 1
OR { 646}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 121 and name HA ))
OR { 646}
( segid " " and resid 84 and name HD2%)
(( segid " " and resid 84 and name HA ))
ASSI { 648}
( segid " " and resid 121 and name HD2%)
(( segid " " and resid 118 and name HA ))
3.300 1.400 1.400 peak 648 spectrum 1 weight 0.10000E+01 volume 0.45584E-02 ppm1 0.599 ppm2 3.659 CV 1
OR { 648}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 36 and name HA ))
ASSI { 651}
( segid " " and resid 121 and name HD1%)
( segid " " and resid 123 and name HD2%)
2.000 0.500 0.500 peak 651 spectrum 1 weight 0.10000E+01 volume 0.23225E-01 ppm1 0.726 ppm2 0.606 CV 1
OR { 651}
( segid " " and resid 121 and name HD1%)
( segid " " and resid 121 and name HD2%)
ASSI { 654}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 85 and name HG2 ))
4.400 2.500 1.600 peak 654 spectrum 1 weight 0.10000E+01 volume 0.13912E-02 ppm1 0.726 ppm2 2.486 CV 1
OR { 654}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 89 and name HG3 ))
ASSI { 658}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 71 and name HB ))
2.700 0.900 0.900 peak 658 spectrum 1 weight 0.10000E+01 volume 0.78982E-02 ppm1 0.726 ppm2 4.153 CV 1
OR { 658}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 121 and name HA ))
ASSI { 668}
(( segid " " and resid 120 and name HA ))
( segid " " and resid 119 and name HD2%)
3.900 1.900 1.900 peak 668 spectrum 1 weight 0.10000E+01 volume 0.18264E-02 ppm1 4.057 ppm2 0.799 CV 1
OR { 668}
(( segid " " and resid 112 and name HA ))
( segid " " and resid 98 and name HD2%)
OR { 668}
(( segid " " and resid 112 and name HA ))
( segid " " and resid 118 and name HD2%)
OR { 668}
(( segid " " and resid 120 and name HA ))
( segid " " and resid 73 and name HG2%)
OR { 668}
(( segid " " and resid 120 and name HA ))
( segid " " and resid 73 and name HD1%)
OR { 668}
(( segid " " and resid 112 and name HA ))
( segid " " and resid 119 and name HD2%)
OR { 668}
(( segid " " and resid 120 and name HA ))
( segid " " and resid 123 and name HD1%)
ASSI { 669}
(( segid " " and resid 120 and name HA ))
( segid " " and resid 119 and name HD1%)
4.300 2.300 1.700 peak 669 spectrum 1 weight 0.10000E+01 volume 0.13211E-02 ppm1 4.061 ppm2 0.646 CV 1
OR { 669}
(( segid " " and resid 112 and name HA ))
( segid " " and resid 119 and name HD1%)
ASSI { 670}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 115 and name HB ))
3.800 1.800 1.800 peak 670 spectrum 1 weight 0.10000E+01 volume 0.18603E-02 ppm1 4.065 ppm2 2.234 CV 1
OR { 670}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 113 and name HB2 ))
OR { 670}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 113 and name HB3 ))
ASSI { 671}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 111 and name HB3 ))
3.500 1.500 1.500 peak 671 spectrum 1 weight 0.10000E+01 volume 0.16435E-02 ppm1 4.060 ppm2 1.862 CV 1
OR { 671}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 127 and name HB3 ))
OR { 671}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 127 and name HB2 ))
ASSI { 672}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 115 and name HA ))
4.600 2.600 1.400 peak 672 spectrum 1 weight 0.10000E+01 volume 0.41366E-03 ppm1 4.067 ppm2 3.344 CV 1
OR { 672}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 113 and name HD2 ))
ASSI { 676}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 113 and name HB2 ))
3.200 1.300 1.300 peak 676 spectrum 1 weight 0.10000E+01 volume 0.39496E-02 ppm1 1.445 ppm2 2.233 CV 1
OR { 676}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 113 and name HB3 ))
OR { 676}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 115 and name HB ))
ASSI { 677}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 111 and name HB3 ))
3.000 1.200 1.200 peak 677 spectrum 1 weight 0.10000E+01 volume 0.68325E-02 ppm1 1.445 ppm2 1.898 CV 1
OR { 677}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 111 and name HB2 ))
OR { 677}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 113 and name HG3 ))
OR { 677}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 113 and name HG2 ))
ASSI { 681}
( segid " " and resid 120 and name HB% )
(( segid " " and resid 119 and name HB2 ))
2.900 1.000 1.000 peak 681 spectrum 1 weight 0.10000E+01 volume 0.64226E-02 ppm1 1.442 ppm2 1.708 CV 1
OR { 681}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 111 and name HG2 ))
OR { 681}
( segid " " and resid 112 and name HB% )
(( segid " " and resid 127 and name HG2 ))
ASSI { 685}
( segid " " and resid 120 and name HB% )
(( segid " " and resid 120 and name H ))
2.100 0.600 0.600 peak 685 spectrum 1 weight 0.10000E+01 volume 0.13363E-01 ppm1 1.450 ppm2 8.141 CV 1
OR { 685}
( segid " " and resid 120 and name HB% )
(( segid " " and resid 121 and name H ))
ASSI { 687}
(( segid " " and resid 120 and name HA ))
(( segid " " and resid 120 and name H ))
2.800 1.000 1.000 peak 687 spectrum 1 weight 0.10000E+01 volume 0.41701E-02 ppm1 4.057 ppm2 8.139 CV 1
OR { 687}
(( segid " " and resid 120 and name HA ))
(( segid " " and resid 121 and name H ))
ASSI { 688}
(( segid " " and resid 120 and name HA ))
(( segid " " and resid 122 and name H ))
3.600 1.600 1.600 peak 688 spectrum 1 weight 0.10000E+01 volume 0.96037E-03 ppm1 4.059 ppm2 7.857 CV 1
OR { 688}
(( segid " " and resid 120 and name HA ))
(( segid " " and resid 119 and name H ))
ASSI { 695}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 73 and name HB ))
2.000 2.000 4.000 peak 695 spectrum 1 weight 0.10000E+01 volume 0.29467E-02 ppm1 0.726 ppm2 1.809 CV 1
OR { 695}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 81 and name HB2 ))
OR { 695}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 84 and name HB2 ))
OR { 695}
( segid " " and resid 121 and name HD1%)
(( segid " " and resid 127 and name HB3 ))
ASSI { 698}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 119 and name H ))
2.800 1.000 1.000 peak 698 spectrum 1 weight 0.10000E+01 volume 0.20745E-02 ppm1 4.140 ppm2 7.865 CV 1
OR { 698}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 122 and name H ))
ASSI { 699}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 120 and name H ))
3.100 1.200 1.200 peak 699 spectrum 1 weight 0.10000E+01 volume 0.16669E-02 ppm1 4.145 ppm2 8.133 CV 1
OR { 699}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 121 and name H ))
ASSI { 704}
( segid " " and resid 119 and name HD1%)
( segid " " and resid 119 and name HD2%)
1.700 0.400 0.500 peak 704 spectrum 1 weight 0.10000E+01 volume 0.40334E-01 ppm1 0.656 ppm2 0.800 CV 1
OR { 704}
( segid " " and resid 119 and name HD1%)
( segid " " and resid 124 and name HG2%)
ASSI { 706}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 115 and name HB ))
3.100 1.200 1.200 peak 706 spectrum 1 weight 0.10000E+01 volume 0.33571E-02 ppm1 0.656 ppm2 2.216 CV 1
OR { 706}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 126 and name HB2 ))
OR { 706}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 126 and name HG3 ))
ASSI { 707}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 124 and name HB ))
3.100 1.200 1.200 peak 707 spectrum 1 weight 0.10000E+01 volume 0.66641E-02 ppm1 0.656 ppm2 1.876 CV 1
OR { 707}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 127 and name HB2 ))
OR { 707}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 127 and name HB3 ))
ASSI { 708}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 127 and name HG2 ))
2.100 0.500 0.500 peak 708 spectrum 1 weight 0.10000E+01 volume 0.85390E-02 ppm1 0.656 ppm2 1.753 CV 1
OR { 708}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 119 and name HB2 ))
ASSI { 712}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 116 and name HA ))
2.500 0.800 0.800 peak 712 spectrum 1 weight 0.10000E+01 volume 0.33773E-02 ppm1 0.656 ppm2 4.293 CV 1
OR { 712}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 124 and name HA ))
ASSI { 717}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 119 and name HG ))
1.900 0.400 0.400 peak 717 spectrum 1 weight 0.10000E+01 volume 0.26042E-01 ppm1 0.806 ppm2 1.549 CV 1
OR { 717}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 119 and name HB3 ))
OR { 717}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 127 and name HG3 ))
OR { 717}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HB2 ))
ASSI { 718}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 47 and name HD2 ))
2.900 1.100 1.100 peak 718 spectrum 1 weight 0.10000E+01 volume 0.34499E-02 ppm1 0.821 ppm2 3.303 CV 1
OR { 718}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 127 and name HD3 ))
OR { 718}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 18 and name HD3 ))
ASSI { 720}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 116 and name HB2 ))
4.100 2.100 1.900 peak 720 spectrum 1 weight 0.10000E+01 volume 0.10522E-02 ppm1 0.817 ppm2 2.852 CV 1
OR { 720}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 66 and name HB2 ))
OR { 720}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 31 and name HB3 ))
ASSI { 721}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 116 and name HB2 ))
4.200 2.200 1.800 peak 721 spectrum 1 weight 0.10000E+01 volume 0.10255E-02 ppm1 0.804 ppm2 2.821 CV 1
OR { 721}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 31 and name HB3 ))
ASSI { 724}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 116 and name HA ))
2.900 1.000 1.000 peak 724 spectrum 1 weight 0.10000E+01 volume 0.43610E-02 ppm1 0.801 ppm2 4.294 CV 1
OR { 724}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 125 and name HA ))
ASSI { 726}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 59 and name HA ))
3.400 1.500 1.500 peak 726 spectrum 1 weight 0.10000E+01 volume 0.42164E-02 ppm1 0.805 ppm2 4.151 CV 1
OR { 726}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 119 and name HA ))
ASSI { 727}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 34 and name HA ))
2.600 0.800 0.800 peak 727 spectrum 1 weight 0.10000E+01 volume 0.87049E-02 ppm1 0.823 ppm2 3.969 CV 1
OR { 727}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HA ))
ASSI { 728}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 47 and name HA ))
2.100 0.500 0.500 peak 728 spectrum 1 weight 0.10000E+01 volume 0.76913E-02 ppm1 0.823 ppm2 3.769 CV 1
OR { 728}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 18 and name HA ))
ASSI { 731}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 128 and name H ))
4.400 2.400 1.600 peak 731 spectrum 1 weight 0.10000E+01 volume 0.66159E-03 ppm1 0.656 ppm2 8.594 CV 1
OR { 731}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 115 and name H ))
ASSI { 733}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 120 and name H ))
3.600 1.600 1.600 peak 733 spectrum 1 weight 0.10000E+01 volume 0.23585E-02 ppm1 0.656 ppm2 8.142 CV 1
OR { 733}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 116 and name H ))
ASSI { 735}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 126 and name H ))
3.600 1.600 1.600 peak 735 spectrum 1 weight 0.10000E+01 volume 0.19111E-02 ppm1 0.656 ppm2 7.620 CV 1
OR { 735}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 123 and name H ))
ASSI { 737}
( segid " " and resid 119 and name HD1%)
( segid " " and resid 131 and name HD% )
4.900 3.000 1.100 peak 737 spectrum 1 weight 0.10000E+01 volume 0.40833E-03 ppm1 0.657 ppm2 7.104 CV 1
OR { 737}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 88 and name HZ ))
ASSI { 738}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 124 and name H ))
4.100 2.100 1.900 peak 738 spectrum 1 weight 0.10000E+01 volume 0.12951E-02 ppm1 0.655 ppm2 6.788 CV 1
OR { 738}
( segid " " and resid 119 and name HD1%)
( segid " " and resid 131 and name HE% )
ASSI { 739}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 124 and name H ))
4.900 3.000 1.100 peak 739 spectrum 1 weight 0.10000E+01 volume 0.31860E-03 ppm1 1.532 ppm2 6.792 CV 1
OR { 739}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 9 and name HZ3 ))
ASSI { 742}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 120 and name H ))
4.000 2.000 2.000 peak 742 spectrum 1 weight 0.10000E+01 volume 0.15401E-02 ppm1 1.548 ppm2 8.139 CV 1
OR { 742}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 121 and name H ))
ASSI { 743}
(( segid " " and resid 119 and name HB3 ))
(( segid " " and resid 120 and name H ))
3.500 1.600 1.600 peak 743 spectrum 1 weight 0.10000E+01 volume 0.14948E-02 ppm1 1.542 ppm2 8.138 CV 1
OR { 743}
(( segid " " and resid 118 and name HB3 ))
(( segid " " and resid 120 and name H ))
OR { 743}
(( segid " " and resid 119 and name HB3 ))
(( segid " " and resid 121 and name H ))
ASSI { 749}
(( segid " " and resid 118 and name HB3 ))
(( segid " " and resid 124 and name H ))
4.700 2.800 1.300 peak 749 spectrum 1 weight 0.10000E+01 volume 0.21219E-03 ppm1 1.531 ppm2 6.794 CV 1
OR { 749}
(( segid " " and resid 119 and name HB3 ))
(( segid " " and resid 124 and name H ))
ASSI { 751}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 29 and name HA3 ))
4.500 2.500 1.500 peak 751 spectrum 1 weight 0.10000E+01 volume 0.11133E-02 ppm1 4.147 ppm2 3.759 CV 1
OR { 751}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 122 and name HA3 ))
ASSI { 752}
(( segid " " and resid 84 and name HB2 ))
(( segid " " and resid 84 and name HA ))
2.900 1.000 1.000 peak 752 spectrum 1 weight 0.10000E+01 volume 0.13885E-02 ppm1 1.754 ppm2 4.144 CV 1
OR { 752}
(( segid " " and resid 119 and name HB2 ))
(( segid " " and resid 119 and name HA ))
ASSI { 755}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 87 and name HB2 ))
2.200 0.600 0.600 peak 755 spectrum 1 weight 0.10000E+01 volume 0.84837E-02 ppm1 4.141 ppm2 2.218 CV 1
OR { 755}
(( segid " " and resid 129 and name HA ))
(( segid " " and resid 129 and name HB3 ))
OR { 755}
(( segid " " and resid 129 and name HA ))
(( segid " " and resid 129 and name HB2 ))
ASSI { 756}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HB2 ))
2.300 0.700 0.700 peak 756 spectrum 1 weight 0.10000E+01 volume 0.11618E-01 ppm1 4.144 ppm2 1.817 CV 1
OR { 756}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HB2 ))
OR { 756}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HB3 ))
ASSI { 760}
(( segid " " and resid 119 and name HA ))
( segid " " and resid 119 and name HD2%)
3.500 1.500 1.500 peak 760 spectrum 1 weight 0.10000E+01 volume 0.31690E-02 ppm1 4.141 ppm2 0.805 CV 1
OR { 760}
(( segid " " and resid 119 and name HA ))
( segid " " and resid 124 and name HG2%)
ASSI { 766}
(( segid " " and resid 84 and name HB2 ))
(( segid " " and resid 114 and name HG12))
4.700 2.800 1.300 peak 766 spectrum 1 weight 0.10000E+01 volume 0.26344E-03 ppm1 1.745 ppm2 1.259 CV 1
OR { 766}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 42 and name HG2%)
ASSI { 770}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 59 and name HB2 ))
4.500 2.600 1.500 peak 770 spectrum 1 weight 0.10000E+01 volume 0.97179E-03 ppm1 1.524 ppm2 1.244 CV 1
OR { 770}
(( segid " " and resid 17 and name HG ))
( segid " " and resid 42 and name HG2%)
OR { 770}
(( segid " " and resid 17 and name HG ))
( segid " " and resid 60 and name HB% )
ASSI { 775}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 110 and name H ))
4.100 2.100 1.900 peak 775 spectrum 1 weight 0.10000E+01 volume 0.71769E-03 ppm1 1.387 ppm2 8.386 CV 1
OR { 775}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 74 and name H ))
ASSI { 776}
(( segid " " and resid 117 and name HD2 ))
(( segid " " and resid 74 and name H ))
3.300 1.400 1.400 peak 776 spectrum 1 weight 0.10000E+01 volume 0.64672E-03 ppm1 1.132 ppm2 8.389 CV 1
OR { 776}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 74 and name H ))
ASSI { 780}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 120 and name H ))
3.400 1.500 1.500 peak 780 spectrum 1 weight 0.10000E+01 volume 0.11160E-02 ppm1 4.009 ppm2 8.137 CV 1
OR { 780}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 121 and name H ))
OR { 780}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 116 and name H ))
ASSI { 781}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 118 and name H ))
4.100 2.100 1.900 peak 781 spectrum 1 weight 0.10000E+01 volume 0.40881E-03 ppm1 3.998 ppm2 8.399 CV 1
OR { 781}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 74 and name H ))
ASSI { 786}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 119 and name H ))
3.600 1.600 1.600 peak 786 spectrum 1 weight 0.10000E+01 volume 0.90441E-03 ppm1 4.288 ppm2 7.875 CV 1
OR { 786}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 90 and name H ))
ASSI { 790}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 96 and name H ))
3.800 1.800 1.800 peak 790 spectrum 1 weight 0.10000E+01 volume 0.74316E-03 ppm1 2.802 ppm2 7.864 CV 1
OR { 790}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 96 and name H ))
OR { 790}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 94 and name H ))
ASSI { 791}
(( segid " " and resid 116 and name HB2 ))
(( segid " " and resid 116 and name HA ))
2.900 1.000 1.000 peak 791 spectrum 1 weight 0.10000E+01 volume 0.14350E-02 ppm1 2.808 ppm2 4.307 CV 1
OR { 791}
(( segid " " and resid 116 and name HB2 ))
(( segid " " and resid 113 and name HA ))
ASSI { 792}
(( segid " " and resid 116 and name HB3 ))
(( segid " " and resid 113 and name HA ))
3.000 1.200 1.200 peak 792 spectrum 1 weight 0.10000E+01 volume 0.16246E-02 ppm1 2.667 ppm2 4.303 CV 1
OR { 792}
(( segid " " and resid 116 and name HB3 ))
(( segid " " and resid 116 and name HA ))
ASSI { 797}
(( segid " " and resid 116 and name HB3 ))
(( segid " " and resid 115 and name HA ))
4.700 2.800 1.300 peak 797 spectrum 1 weight 0.10000E+01 volume 0.35453E-03 ppm1 2.664 ppm2 3.390 CV 1
OR { 797}
(( segid " " and resid 116 and name HB3 ))
(( segid " " and resid 113 and name HD2 ))
OR { 797}
(( segid " " and resid 116 and name HB3 ))
(( segid " " and resid 113 and name HD3 ))
ASSI { 798}
(( segid " " and resid 116 and name HB2 ))
(( segid " " and resid 115 and name HA ))
5.100 3.300 0.900 peak 798 spectrum 1 weight 0.10000E+01 volume 0.28172E-03 ppm1 2.795 ppm2 3.379 CV 1
OR { 798}
(( segid " " and resid 116 and name HB2 ))
(( segid " " and resid 113 and name HD3 ))
ASSI { 799}
(( segid " " and resid 116 and name HB2 ))
(( segid " " and resid 115 and name HB ))
4.400 2.500 1.600 peak 799 spectrum 1 weight 0.10000E+01 volume 0.53070E-03 ppm1 2.818 ppm2 2.246 CV 1
OR { 799}
(( segid " " and resid 116 and name HB2 ))
(( segid " " and resid 113 and name HB3 ))
OR { 799}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 97 and name HB ))
ASSI { 800}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 132 and name HB3 ))
3.800 1.800 1.800 peak 800 spectrum 1 weight 0.10000E+01 volume 0.12687E-02 ppm1 2.799 ppm2 1.840 CV 1
OR { 800}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 132 and name HB2 ))
OR { 800}
(( segid " " and resid 116 and name HB2 ))
(( segid " " and resid 127 and name HB3 ))
OR { 800}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 132 and name HB2 ))
OR { 800}
(( segid " " and resid 116 and name HB2 ))
(( segid " " and resid 127 and name HB2 ))
ASSI { 801}
(( segid " " and resid 116 and name HB2 ))
(( segid " " and resid 127 and name HG2 ))
3.600 1.600 1.600 peak 801 spectrum 1 weight 0.10000E+01 volume 0.12201E-02 ppm1 2.799 ppm2 1.745 CV 1
OR { 801}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 132 and name HD2 ))
OR { 801}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 132 and name HD2 ))
OR { 801}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 132 and name HD3 ))
ASSI { 802}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 132 and name HG3 ))
3.600 1.600 1.600 peak 802 spectrum 1 weight 0.10000E+01 volume 0.11033E-02 ppm1 2.807 ppm2 1.489 CV 1
OR { 802}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 132 and name HG3 ))
OR { 802}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 132 and name HG2 ))
OR { 802}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 92 and name HG3 ))
OR { 802}
(( segid " " and resid 116 and name HB2 ))
( segid " " and resid 112 and name HB% )
OR { 802}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 132 and name HG2 ))
ASSI { 803}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB3 ))
2.900 1.100 1.100 peak 803 spectrum 1 weight 0.10000E+01 volume 0.22583E-02 ppm1 4.289 ppm2 1.542 CV 1
OR { 803}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 127 and name HG3 ))
OR { 803}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 119 and name HG ))
ASSI { 804}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 127 and name HG2 ))
2.600 0.800 0.800 peak 804 spectrum 1 weight 0.10000E+01 volume 0.20862E-02 ppm1 4.293 ppm2 1.785 CV 1
OR { 804}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 90 and name HB2 ))
ASSI { 805}
(( segid " " and resid 116 and name HA ))
( segid " " and resid 119 and name HD2%)
3.100 1.200 1.200 peak 805 spectrum 1 weight 0.10000E+01 volume 0.30497E-02 ppm1 4.293 ppm2 0.801 CV 1
OR { 805}
(( segid " " and resid 116 and name HA ))
( segid " " and resid 124 and name HG2%)
ASSI { 808}
(( segid " " and resid 116 and name HB2 ))
( segid " " and resid 119 and name HD2%)
5.200 3.400 0.800 peak 808 spectrum 1 weight 0.10000E+01 volume 0.35855E-03 ppm1 2.806 ppm2 0.794 CV 1
OR { 808}
(( segid " " and resid 116 and name HB2 ))
( segid " " and resid 124 and name HG2%)
ASSI { 809}
(( segid " " and resid 116 and name HB3 ))
( segid " " and resid 119 and name HD2%)
5.000 3.100 1.000 peak 809 spectrum 1 weight 0.10000E+01 volume 0.57804E-03 ppm1 2.666 ppm2 0.799 CV 1
OR { 809}
(( segid " " and resid 116 and name HB3 ))
( segid " " and resid 118 and name HD2%)
OR { 809}
(( segid " " and resid 116 and name HB3 ))
( segid " " and resid 73 and name HG2%)
OR { 809}
(( segid " " and resid 116 and name HB3 ))
( segid " " and resid 124 and name HG2%)
ASSI { 810}
(( segid " " and resid 116 and name HB3 ))
( segid " " and resid 112 and name HB% )
4.400 2.400 1.600 peak 810 spectrum 1 weight 0.10000E+01 volume 0.55686E-03 ppm1 2.656 ppm2 1.477 CV 1
OR { 810}
(( segid " " and resid 116 and name HB3 ))
( segid " " and resid 120 and name HB% )
ASSI { 815}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 118 and name HG ))
4.600 2.600 1.400 peak 815 spectrum 1 weight 0.10000E+01 volume 0.59369E-03 ppm1 3.343 ppm2 1.890 CV 1
OR { 815}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 124 and name HB ))
OR { 815}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 127 and name HB3 ))
OR { 815}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 114 and name HG13))
ASSI { 818}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 118 and name HB3 ))
4.600 2.600 1.400 peak 818 spectrum 1 weight 0.10000E+01 volume 0.36100E-03 ppm1 3.354 ppm2 1.559 CV 1
OR { 818}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 127 and name HG3 ))
ASSI { 819}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 130 and name HB2 ))
5.200 3.400 0.800 peak 819 spectrum 1 weight 0.10000E+01 volume 0.22349E-03 ppm1 3.364 ppm2 1.448 CV 1
OR { 819}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 98 and name HB2 ))
ASSI { 822}
(( segid " " and resid 115 and name HA ))
( segid " " and resid 130 and name HD1%)
2.400 0.700 0.700 peak 822 spectrum 1 weight 0.10000E+01 volume 0.48841E-02 ppm1 3.348 ppm2 0.961 CV 1
OR { 822}
(( segid " " and resid 115 and name HA ))
( segid " " and resid 115 and name HG2%)
OR { 822}
(( segid " " and resid 115 and name HA ))
( segid " " and resid 130 and name HD2%)
ASSI { 824}
(( segid " " and resid 115 and name HA ))
( segid " " and resid 119 and name HD1%)
4.200 2.200 1.800 peak 824 spectrum 1 weight 0.10000E+01 volume 0.61556E-03 ppm1 3.346 ppm2 0.644 CV 1
OR { 824}
(( segid " " and resid 115 and name HA ))
( segid " " and resid 84 and name HD2%)
OR { 824}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 123 and name HB3 ))
ASSI { 825}
(( segid " " and resid 115 and name HA ))
( segid " " and resid 124 and name HG1%)
4.000 2.000 2.000 peak 825 spectrum 1 weight 0.10000E+01 volume 0.88240E-03 ppm1 3.346 ppm2 0.516 CV 1
OR { 825}
(( segid " " and resid 115 and name HA ))
( segid " " and resid 118 and name HD1%)
ASSI { 828}
(( segid " " and resid 115 and name HB ))
(( segid " " and resid 130 and name HB2 ))
2.700 0.900 0.900 peak 828 spectrum 1 weight 0.10000E+01 volume 0.16850E-02 ppm1 2.233 ppm2 1.374 CV 1
OR { 828}
(( segid " " and resid 7 and name HB3 ))
( segid " " and resid 6 and name HB% )
ASSI { 830}
(( segid " " and resid 7 and name HB3 ))
( segid " " and resid 43 and name HG1%)
3.000 1.100 1.100 peak 830 spectrum 1 weight 0.10000E+01 volume 0.57417E-02 ppm1 2.231 ppm2 0.743 CV 1
OR { 830}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 118 and name HD2%)
OR { 830}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 51 and name HD1%)
ASSI { 831}
(( segid " " and resid 115 and name HB ))
(( segid " " and resid 130 and name HB2 ))
2.600 0.800 0.800 peak 831 spectrum 1 weight 0.10000E+01 volume 0.28181E-02 ppm1 2.214 ppm2 1.448 CV 1
OR { 831}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 51 and name HG12))
OR { 831}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 98 and name HB2 ))
OR { 831}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 64 and name HG2 ))
OR { 831}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 112 and name HB% )
ASSI { 832}
(( segid " " and resid 97 and name HB ))
( segid " " and resid 97 and name HG2%)
1.700 0.400 0.500 peak 832 spectrum 1 weight 0.10000E+01 volume 0.31490E-01 ppm1 2.213 ppm2 0.956 CV 1
OR { 832}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 63 and name HG2%)
OR { 832}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 115 and name HG2%)
OR { 832}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 63 and name HG1%)
OR { 832}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 130 and name HD2%)
ASSI { 833}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 118 and name HD2%)
3.100 1.200 1.200 peak 833 spectrum 1 weight 0.10000E+01 volume 0.56718E-02 ppm1 2.214 ppm2 0.798 CV 1
OR { 833}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 55 and name HG1%)
OR { 833}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 124 and name HG2%)
OR { 833}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 119 and name HD2%)
ASSI { 834}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 51 and name HG2%)
2.800 1.000 1.000 peak 834 spectrum 1 weight 0.10000E+01 volume 0.40718E-02 ppm1 2.215 ppm2 0.677 CV 1
OR { 834}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 119 and name HD1%)
ASSI { 836}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 88 and name HB2 ))
4.600 2.600 1.400 peak 836 spectrum 1 weight 0.10000E+01 volume 0.60007E-03 ppm1 2.213 ppm2 2.991 CV 1
OR { 836}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 51 and name HA ))
OR { 836}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 64 and name HE3 ))
ASSI { 837}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 66 and name HB2 ))
4.000 2.000 2.000 peak 837 spectrum 1 weight 0.10000E+01 volume 0.73469E-03 ppm1 2.218 ppm2 2.881 CV 1
OR { 837}
(( segid " " and resid 115 and name HB ))
(( segid " " and resid 131 and name HB2 ))
OR { 837}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 45 and name HD3 ))
ASSI { 838}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 115 and name HB ))
2.200 0.600 0.600 peak 838 spectrum 1 weight 0.10000E+01 volume 0.85433E-02 ppm1 1.126 ppm2 2.233 CV 1
OR { 838}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 114 and name HB ))
OR { 838}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 114 and name HB ))
ASSI { 839}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 98 and name HB3 ))
2.900 1.000 1.000 peak 839 spectrum 1 weight 0.10000E+01 volume 0.41441E-02 ppm1 1.125 ppm2 1.858 CV 1
OR { 839}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 111 and name HB3 ))
OR { 839}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 114 and name HG13))
OR { 839}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 127 and name HB3 ))
OR { 839}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 114 and name HG13))
OR { 839}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 124 and name HB ))
ASSI { 840}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 98 and name HG ))
2.400 0.700 0.700 peak 840 spectrum 1 weight 0.10000E+01 volume 0.50562E-02 ppm1 1.125 ppm2 1.735 CV 1
OR { 840}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HB2 ))
ASSI { 842}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HG ))
2.200 0.600 0.600 peak 842 spectrum 1 weight 0.10000E+01 volume 0.77110E-02 ppm1 1.125 ppm2 1.444 CV 1
OR { 842}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 130 and name HB2 ))
ASSI { 843}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 117 and name HB2 ))
3.100 1.200 1.200 peak 843 spectrum 1 weight 0.10000E+01 volume 0.40406E-02 ppm1 1.125 ppm2 1.317 CV 1
OR { 843}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 109 and name HG2 ))
OR { 843}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 123 and name HG ))
OR { 843}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 117 and name HB2 ))
ASSI { 845}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 62 and name HA ))
4.800 2.800 1.200 peak 845 spectrum 1 weight 0.10000E+01 volume 0.66780E-03 ppm1 2.228 ppm2 4.566 CV 1
OR { 845}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 6 and name HA ))
ASSI { 850}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 63 and name HA ))
2.300 0.700 0.700 peak 850 spectrum 1 weight 0.10000E+01 volume 0.60623E-02 ppm1 2.213 ppm2 3.961 CV 1
OR { 850}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 3 and name HB3 ))
OR { 850}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 88 and name HA ))
ASSI { 854}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 85 and name HA ))
3.300 1.400 1.400 peak 854 spectrum 1 weight 0.10000E+01 volume 0.20076E-02 ppm1 1.089 ppm2 3.892 CV 1
OR { 854}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 114 and name HA ))
OR { 854}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 114 and name HA ))
OR { 854}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 88 and name HA ))
ASSI { 860}
( segid " " and resid 33 and name HG2%)
( segid " " and resid 54 and name HD1%)
2.500 0.800 0.800 peak 860 spectrum 1 weight 0.10000E+01 volume 0.38461E-02 ppm1 0.950 ppm2 0.444 CV 1
OR { 860}
( segid " " and resid 22 and name HD2%)
( segid " " and resid 54 and name HD1%)
ASSI { 861}
( segid " " and resid 115 and name HG2%)
( segid " " and resid 124 and name HG1%)
3.500 1.500 1.500 peak 861 spectrum 1 weight 0.10000E+01 volume 0.43686E-02 ppm1 0.956 ppm2 0.520 CV 1
OR { 861}
( segid " " and resid 115 and name HG2%)
( segid " " and resid 118 and name HD1%)
ASSI { 864}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 51 and name HA ))
2.400 0.700 0.700 peak 864 spectrum 1 weight 0.10000E+01 volume 0.84000E-02 ppm1 0.945 ppm2 2.996 CV 1
OR { 864}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 21 and name HB2 ))
OR { 864}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 88 and name HB2 ))
OR { 864}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 21 and name HB3 ))
ASSI { 866}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name HG ))
2.000 0.500 0.500 peak 866 spectrum 1 weight 0.10000E+01 volume 0.16443E-01 ppm1 0.945 ppm2 2.066 CV 1
OR { 866}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 36 and name HB ))
OR { 866}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 18 and name HB3 ))
ASSI { 868}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 37 and name HG ))
2.100 0.500 0.500 peak 868 spectrum 1 weight 0.10000E+01 volume 0.10992E-01 ppm1 0.950 ppm2 1.662 CV 1
OR { 868}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 51 and name HB ))
OR { 868}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 18 and name HG2 ))
OR { 868}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 18 and name HG3 ))
ASSI { 869}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name HB3 ))
2.200 0.600 0.600 peak 869 spectrum 1 weight 0.10000E+01 volume 0.17249E-01 ppm1 0.947 ppm2 1.450 CV 1
OR { 869}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 51 and name HG12))
OR { 869}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 25 and name HB2 ))
ASSI { 877}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 67 and name HG2 ))
3.900 1.900 1.900 peak 877 spectrum 1 weight 0.10000E+01 volume 0.23824E-02 ppm1 0.936 ppm2 2.419 CV 1
OR { 877}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 67 and name HG3 ))
OR { 877}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 65 and name HB3 ))
ASSI { 879}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 92 and name HA ))
2.300 0.700 0.700 peak 879 spectrum 1 weight 0.10000E+01 volume 0.55866E-02 ppm1 0.955 ppm2 3.587 CV 1
OR { 879}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 33 and name HA ))
ASSI { 880}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 116 and name HA ))
3.300 1.400 1.400 peak 880 spectrum 1 weight 0.10000E+01 volume 0.17403E-02 ppm1 0.959 ppm2 4.298 CV 1
OR { 880}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 113 and name HA ))
ASSI { 881}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 62 and name HB2 ))
2.600 0.900 0.900 peak 881 spectrum 1 weight 0.10000E+01 volume 0.12857E-01 ppm1 0.940 ppm2 3.961 CV 1
OR { 881}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 63 and name HA ))
ASSI { 883}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 62 and name HA ))
4.700 2.800 1.300 peak 883 spectrum 1 weight 0.10000E+01 volume 0.82892E-03 ppm1 0.938 ppm2 4.582 CV 1
OR { 883}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 30 and name HA ))
ASSI { 886}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 116 and name H ))
3.700 1.700 1.700 peak 886 spectrum 1 weight 0.10000E+01 volume 0.54791E-03 ppm1 3.346 ppm2 8.109 CV 1
OR { 886}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 114 and name H ))
ASSI { 887}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 4 and name H ))
3.500 1.500 1.500 peak 887 spectrum 1 weight 0.10000E+01 volume 0.18707E-02 ppm1 2.215 ppm2 8.291 CV 1
OR { 887}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 64 and name H ))
ASSI { 888}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 97 and name H ))
2.500 0.800 0.800 peak 888 spectrum 1 weight 0.10000E+01 volume 0.36149E-02 ppm1 2.210 ppm2 8.636 CV 1
OR { 888}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 63 and name H ))
ASSI { 889}
(( segid " " and resid 115 and name HB ))
(( segid " " and resid 115 and name H ))
3.300 1.300 1.300 peak 889 spectrum 1 weight 0.10000E+01 volume 0.27101E-02 ppm1 2.218 ppm2 8.574 CV 1
OR { 889}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 98 and name H ))
ASSI { 890}
(( segid " " and resid 115 and name HB ))
(( segid " " and resid 116 and name H ))
3.600 1.600 1.600 peak 890 spectrum 1 weight 0.10000E+01 volume 0.23033E-02 ppm1 2.191 ppm2 8.100 CV 1
OR { 890}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 45 and name H ))
ASSI { 891}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 94 and name H ))
3.700 1.700 1.700 peak 891 spectrum 1 weight 0.10000E+01 volume 0.13606E-02 ppm1 2.206 ppm2 7.847 CV 1
OR { 891}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 92 and name H ))
OR { 891}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 99 and name H ))
OR { 891}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 67 and name H ))
ASSI { 892}
(( segid " " and resid 115 and name HB ))
(( segid " " and resid 117 and name H ))
4.300 2.300 1.700 peak 892 spectrum 1 weight 0.10000E+01 volume 0.87038E-03 ppm1 2.216 ppm2 7.523 CV 1
OR { 892}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 66 and name H ))
OR { 892}
(( segid " " and resid 115 and name HB ))
(( segid " " and resid 113 and name H ))
ASSI { 895}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 52 and name HD2 ))
3.900 1.900 1.900 peak 895 spectrum 1 weight 0.10000E+01 volume 0.94432E-03 ppm1 2.210 ppm2 7.078 CV 1
OR { 895}
(( segid " " and resid 97 and name HB ))
( segid " " and resid 88 and name HD% )
OR { 895}
(( segid " " and resid 115 and name HB ))
( segid " " and resid 131 and name HD% )
OR { 895}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 66 and name HE% )
ASSI { 899}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 85 and name H ))
3.300 1.300 1.300 peak 899 spectrum 1 weight 0.10000E+01 volume 0.34311E-02 ppm1 1.126 ppm2 8.103 CV 1
OR { 899}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 116 and name H ))
OR { 899}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 114 and name H ))
ASSI { 900}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 119 and name H ))
4.000 2.000 2.000 peak 900 spectrum 1 weight 0.10000E+01 volume 0.74138E-03 ppm1 1.126 ppm2 7.874 CV 1
OR { 900}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 132 and name H ))
OR { 900}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 90 and name H ))
OR { 900}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 119 and name H ))
OR { 900}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 99 and name H ))
ASSI { 901}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 113 and name H ))
4.100 2.100 1.900 peak 901 spectrum 1 weight 0.10000E+01 volume 0.88440E-03 ppm1 1.127 ppm2 7.536 CV 1
OR { 901}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 117 and name H ))
ASSI { 906}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 91 and name H ))
3.900 1.900 1.900 peak 906 spectrum 1 weight 0.10000E+01 volume 0.15390E-02 ppm1 1.104 ppm2 7.757 CV 1
OR { 906}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 100 and name H ))
ASSI { 908}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 103 and name H ))
4.200 2.200 1.800 peak 908 spectrum 1 weight 0.10000E+01 volume 0.11289E-02 ppm1 1.105 ppm2 7.516 CV 1
OR { 908}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 80 and name HE21))
ASSI { 911}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name H ))
2.300 0.600 0.600 peak 911 spectrum 1 weight 0.10000E+01 volume 0.72809E-02 ppm1 0.948 ppm2 8.557 CV 1
OR { 911}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 37 and name H ))
ASSI { 913}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 51 and name H ))
3.300 1.400 1.400 peak 913 spectrum 1 weight 0.10000E+01 volume 0.30579E-02 ppm1 0.955 ppm2 8.205 CV 1
OR { 913}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 89 and name H ))
OR { 913}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 50 and name H ))
ASSI { 914}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 33 and name H ))
2.800 1.000 1.000 peak 914 spectrum 1 weight 0.10000E+01 volume 0.42522E-02 ppm1 0.955 ppm2 7.989 CV 1
OR { 914}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 34 and name H ))
ASSI { 915}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 23 and name H ))
3.600 1.600 1.600 peak 915 spectrum 1 weight 0.10000E+01 volume 0.31390E-02 ppm1 0.950 ppm2 7.853 CV 1
OR { 915}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 35 and name H ))
OR { 915}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 67 and name H ))
ASSI { 917}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 115 and name H ))
2.300 0.600 0.600 peak 917 spectrum 1 weight 0.10000E+01 volume 0.71592E-02 ppm1 0.964 ppm2 8.571 CV 1
OR { 917}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 26 and name H ))
ASSI { 918}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 68 and name H ))
3.800 1.800 1.800 peak 918 spectrum 1 weight 0.10000E+01 volume 0.12791E-02 ppm1 0.961 ppm2 8.405 CV 1
OR { 918}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 118 and name H ))
ASSI { 920}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 30 and name HE22))
3.100 1.200 1.200 peak 920 spectrum 1 weight 0.10000E+01 volume 0.29377E-02 ppm1 0.973 ppm2 7.754 CV 1
OR { 920}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 130 and name H ))
ASSI { 921}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 113 and name H ))
3.500 1.500 1.500 peak 921 spectrum 1 weight 0.10000E+01 volume 0.18949E-02 ppm1 0.949 ppm2 7.517 CV 1
OR { 921}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 30 and name H ))
OR { 921}
( segid " " and resid 115 and name HG2%)
(( segid " " and resid 117 and name H ))
OR { 921}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 24 and name HD22))
ASSI { 922}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 30 and name H ))
3.700 1.700 1.700 peak 922 spectrum 1 weight 0.10000E+01 volume 0.15912E-02 ppm1 0.972 ppm2 7.491 CV 1
OR { 922}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 24 and name HD22))
OR { 922}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 66 and name H ))
ASSI { 929}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 30 and name HE21))
2.800 1.000 1.000 peak 929 spectrum 1 weight 0.10000E+01 volume 0.32405E-02 ppm1 0.939 ppm2 7.069 CV 1
OR { 929}
( segid " " and resid 63 and name HG1%)
( segid " " and resid 66 and name HE% )
ASSI { 930}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HB ))
3.400 1.500 1.500 peak 930 spectrum 1 weight 0.10000E+01 volume 0.86780E-03 ppm1 3.866 ppm2 2.253 CV 1
OR { 930}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 113 and name HB3 ))
ASSI { 932}
(( segid " " and resid 114 and name HB ))
( segid " " and resid 115 and name HG1%)
3.700 1.700 1.700 peak 932 spectrum 1 weight 0.10000E+01 volume 0.11949E-02 ppm1 2.256 ppm2 1.122 CV 1
OR { 932}
(( segid " " and resid 114 and name HB ))
( segid " " and resid 84 and name HD1%)
ASSI { 934}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 59 and name HD1%)
2.300 0.700 0.700 peak 934 spectrum 1 weight 0.10000E+01 volume 0.51273E-02 ppm1 1.864 ppm2 0.820 CV 1
OR { 934}
(( segid " " and resid 47 and name HB2 ))
( segid " " and resid 37 and name HD2%)
OR { 934}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 37 and name HD2%)
OR { 934}
(( segid " " and resid 127 and name HB2 ))
( segid " " and resid 119 and name HD2%)
ASSI { 937}
(( segid " " and resid 114 and name HG13))
( segid " " and resid 118 and name HD1%)
4.400 2.500 1.600 peak 937 spectrum 1 weight 0.10000E+01 volume 0.76263E-03 ppm1 1.853 ppm2 0.512 CV 1
OR { 937}
(( segid " " and resid 114 and name HG13))
(( segid " " and resid 117 and name HD3 ))
OR { 937}
(( segid " " and resid 128 and name HB3 ))
( segid " " and resid 124 and name HG1%)
ASSI { 940}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 98 and name HG ))
4.400 2.400 1.600 peak 940 spectrum 1 weight 0.10000E+01 volume 0.84518E-03 ppm1 1.233 ppm2 1.718 CV 1
OR { 940}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 111 and name HG2 ))
ASSI { 941}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 114 and name HB ))
3.300 1.400 1.400 peak 941 spectrum 1 weight 0.10000E+01 volume 0.10707E-02 ppm1 1.240 ppm2 2.250 CV 1
OR { 941}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 113 and name HB3 ))
ASSI { 943}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 84 and name HG ))
3.300 1.300 1.300 peak 943 spectrum 1 weight 0.10000E+01 volume 0.18391E-02 ppm1 1.242 ppm2 1.438 CV 1
OR { 943}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 109 and name HB3 ))
OR { 943}
(( segid " " and resid 114 and name HG12))
(( segid " " and resid 109 and name HG3 ))
ASSI { 944}
(( segid " " and resid 128 and name HB3 ))
(( segid " " and resid 126 and name HG3 ))
2.700 0.900 0.900 peak 944 spectrum 1 weight 0.10000E+01 volume 0.51337E-02 ppm1 1.864 ppm2 2.212 CV 1
OR { 944}
(( segid " " and resid 128 and name HB3 ))
(( segid " " and resid 126 and name HB2 ))
OR { 944}
(( segid " " and resid 128 and name HB2 ))
(( segid " " and resid 126 and name HB2 ))
OR { 944}
(( segid " " and resid 128 and name HB2 ))
(( segid " " and resid 126 and name HG3 ))
OR { 944}
(( segid " " and resid 128 and name HB3 ))
(( segid " " and resid 129 and name HB3 ))
ASSI { 945}
(( segid " " and resid 114 and name HG13))
(( segid " " and resid 109 and name HD3 ))
2.900 1.000 1.000 peak 945 spectrum 1 weight 0.10000E+01 volume 0.20494E-02 ppm1 1.868 ppm2 2.407 CV 1
OR { 945}
(( segid " " and resid 128 and name HB3 ))
(( segid " " and resid 129 and name HG2 ))
OR { 945}
(( segid " " and resid 128 and name HB2 ))
(( segid " " and resid 129 and name HG2 ))
OR { 945}
(( segid " " and resid 128 and name HB3 ))
(( segid " " and resid 129 and name HG3 ))
OR { 945}
(( segid " " and resid 128 and name HB2 ))
(( segid " " and resid 129 and name HG3 ))
ASSI { 955}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 84 and name HG ))
3.000 1.100 1.100 peak 955 spectrum 1 weight 0.10000E+01 volume 0.51370E-02 ppm1 0.951 ppm2 1.447 CV 1
OR { 955}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 17 and name HG ))
OR { 955}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 98 and name HB2 ))
OR { 955}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 51 and name HG12))
ASSI { 957}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 114 and name HG13))
2.800 1.000 1.000 peak 957 spectrum 1 weight 0.10000E+01 volume 0.69693E-02 ppm1 0.949 ppm2 1.864 CV 1
OR { 957}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 98 and name HB3 ))
ASSI { 958}
( segid " " and resid 114 and name HG2%)
( segid " " and resid 102 and name HE% )
3.100 1.200 1.200 peak 958 spectrum 1 weight 0.10000E+01 volume 0.58792E-02 ppm1 0.957 ppm2 2.202 CV 1
OR { 958}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 115 and name HB ))
ASSI { 959}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 104 and name HB2 ))
4.100 2.100 1.900 peak 959 spectrum 1 weight 0.10000E+01 volume 0.11314E-02 ppm1 0.955 ppm2 2.582 CV 1
OR { 959}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 102 and name HG3 ))
ASSI { 963}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 76 and name HH2 ))
3.800 1.800 1.800 peak 963 spectrum 1 weight 0.10000E+01 volume 0.14778E-02 ppm1 0.948 ppm2 6.900 CV 1
OR { 963}
( segid " " and resid 50 and name HG2%)
( segid " " and resid 21 and name HD% )
OR { 963}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 9 and name HZ2 ))
ASSI { 964}
( segid " " and resid 114 and name HG2%)
( segid " " and resid 88 and name HD% )
3.600 1.600 1.600 peak 964 spectrum 1 weight 0.10000E+01 volume 0.14498E-02 ppm1 0.948 ppm2 7.090 CV 1
OR { 964}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 76 and name HZ2 ))
ASSI { 967}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 118 and name H ))
3.300 1.400 1.400 peak 967 spectrum 1 weight 0.10000E+01 volume 0.13535E-02 ppm1 0.949 ppm2 8.367 CV 1
OR { 967}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 74 and name H ))
ASSI { 974}
(( segid " " and resid 114 and name HG13))
(( segid " " and resid 76 and name HZ2 ))
4.000 2.000 2.000 peak 974 spectrum 1 weight 0.10000E+01 volume 0.80127E-03 ppm1 1.854 ppm2 7.110 CV 1
OR { 974}
(( segid " " and resid 128 and name HB2 ))
( segid " " and resid 131 and name HD% )
OR { 974}
(( segid " " and resid 128 and name HB3 ))
( segid " " and resid 131 and name HD% )
ASSI { 975}
(( segid " " and resid 114 and name HB ))
(( segid " " and resid 113 and name H ))
4.500 2.500 1.500 peak 975 spectrum 1 weight 0.10000E+01 volume 0.43595E-03 ppm1 2.257 ppm2 7.556 CV 1
OR { 975}
(( segid " " and resid 114 and name HB ))
(( segid " " and resid 117 and name H ))
ASSI { 980}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 115 and name H ))
2.100 2.100 3.900 peak 980 spectrum 1 weight 0.10000E+01 volume 0.20244E-02 ppm1 0.954 ppm2 8.566 CV 1
OR { 980}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 102 and name H ))
ASSI { 981}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 110 and name H ))
2.400 2.400 3.600 peak 981 spectrum 1 weight 0.10000E+01 volume 0.81665E-03 ppm1 0.953 ppm2 8.377 CV 1
OR { 981}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 74 and name H ))
ASSI { 984}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 76 and name HE3 ))
2.800 2.800 3.200 peak 984 spectrum 1 weight 0.10000E+01 volume 0.36125E-03 ppm1 0.951 ppm2 7.355 CV 1
OR { 984}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 104 and name H ))
ASSI { 989}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 101 and name HA ))
2.800 2.800 3.200 peak 989 spectrum 1 weight 0.10000E+01 volume 0.37495E-03 ppm1 0.956 ppm2 3.646 CV 1
OR { 989}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 118 and name HA ))
ASSI { 990}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 115 and name HA ))
2.700 2.700 3.300 peak 990 spectrum 1 weight 0.10000E+01 volume 0.44170E-03 ppm1 0.955 ppm2 3.355 CV 1
OR { 990}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 113 and name HD3 ))
OR { 990}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 113 and name HD2 ))
ASSI { 993}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 102 and name HG3 ))
1.900 1.900 4.100 peak 993 spectrum 1 weight 0.10000E+01 volume 0.33249E-02 ppm1 0.953 ppm2 2.585 CV 1
OR { 993}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 104 and name HB2 ))
ASSI { 999}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 105 and name HG12))
2.000 2.000 4.000 peak 999 spectrum 1 weight 0.10000E+01 volume 0.25246E-02 ppm1 0.954 ppm2 1.579 CV 1
OR { 999}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 117 and name HB3 ))
OR { 999}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 118 and name HB3 ))
ASSI { 1000}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 109 and name HB3 ))
2.700 0.900 0.900 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.54778E-02 ppm1 0.954 ppm2 1.465 CV 1
OR { 1000}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 109 and name HG3 ))
OR { 1000}
( segid " " and resid 114 and name HD1%)
(( segid " " and resid 84 and name HG ))
ASSI { 1002}
( segid " " and resid 114 and name HD1%)
( segid " " and resid 118 and name HD2%)
1.900 1.900 4.100 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.32205E-02 ppm1 0.954 ppm2 0.761 CV 1
OR { 1002}
( segid " " and resid 114 and name HD1%)
( segid " " and resid 73 and name HD1%)
OR { 1002}
( segid " " and resid 114 and name HD1%)
( segid " " and resid 121 and name HD1%)
ASSI { 1005}
( segid " " and resid 114 and name HG2%)
( segid " " and resid 118 and name HD2%)
2.100 0.600 0.600 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.10968E-01 ppm1 0.945 ppm2 0.760 CV 1
OR { 1005}
( segid " " and resid 114 and name HG2%)
( segid " " and resid 123 and name HD1%)
ASSI { 1006}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 102 and name HG2 ))
3.900 1.900 1.900 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.84423E-03 ppm1 0.949 ppm2 2.780 CV 1
OR { 1006}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 109 and name HD2 ))
ASSI { 1008}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 116 and name H ))
3.100 1.200 1.200 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.18856E-02 ppm1 4.325 ppm2 8.104 CV 1
OR { 1008}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 114 and name H ))
ASSI { 1020}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 109 and name HD2 ))
4.200 2.200 1.800 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.56137E-03 ppm1 3.390 ppm2 2.808 CV 1
OR { 1020}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 109 and name HD2 ))
OR { 1020}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 116 and name HB2 ))
ASSI { 1025}
(( segid " " and resid 7 and name HG3 ))
( segid " " and resid 43 and name HG1%)
3.300 1.300 1.300 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.46446E-02 ppm1 1.938 ppm2 0.736 CV 1
OR { 1025}
(( segid " " and resid 44 and name HG3 ))
( segid " " and resid 43 and name HG1%)
OR { 1025}
(( segid " " and resid 7 and name HG2 ))
( segid " " and resid 43 and name HG1%)
OR { 1025}
(( segid " " and resid 44 and name HG3 ))
( segid " " and resid 43 and name HG2%)
ASSI { 1028}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 7 and name HB3 ))
2.200 0.600 0.600 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.91570E-02 ppm1 1.942 ppm2 2.234 CV 1
OR { 1028}
(( segid " " and resid 113 and name HG2 ))
(( segid " " and resid 113 and name HB3 ))
OR { 1028}
(( segid " " and resid 113 and name HG3 ))
(( segid " " and resid 113 and name HB2 ))
OR { 1028}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 7 and name HB3 ))
OR { 1028}
(( segid " " and resid 113 and name HG2 ))
(( segid " " and resid 113 and name HB2 ))
ASSI { 1037}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 110 and name H ))
4.600 2.600 1.400 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.37032E-03 ppm1 3.372 ppm2 8.358 CV 1
OR { 1037}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name H ))
OR { 1037}
(( segid " " and resid 113 and name HD2 ))
(( segid " " and resid 110 and name H ))
OR { 1037}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 75 and name H ))
OR { 1037}
(( segid " " and resid 113 and name HD3 ))
(( segid " " and resid 74 and name H ))
ASSI { 1038}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 112 and name H ))
3.700 1.700 1.700 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.60978E-03 ppm1 3.998 ppm2 8.535 CV 1
OR { 1038}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 115 and name H ))
ASSI { 1042}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 17 and name H ))
2.800 1.000 1.000 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.15362E-02 ppm1 3.983 ppm2 8.735 CV 1
OR { 1042}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name H ))
ASSI { 1043}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 15 and name H ))
3.200 1.300 1.300 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.17026E-02 ppm1 3.987 ppm2 8.280 CV 1
OR { 1043}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 18 and name H ))
ASSI { 1049}
(( segid " " and resid 110 and name HA ))
( segid " " and resid 114 and name HD1%)
4.400 2.400 1.600 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.46869E-03 ppm1 4.446 ppm2 0.944 CV 1
OR { 1049}
(( segid " " and resid 110 and name HA ))
( segid " " and resid 101 and name HG2%)
OR { 1049}
(( segid " " and resid 110 and name HA ))
( segid " " and resid 114 and name HG2%)
ASSI { 1050}
(( segid " " and resid 110 and name HA ))
( segid " " and resid 102 and name HE% )
3.300 1.300 1.300 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.15231E-02 ppm1 4.443 ppm2 2.162 CV 1
OR { 1050}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 113 and name HB2 ))
ASSI { 1055}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 59 and name H ))
3.700 1.700 1.700 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.88720E-03 ppm1 3.994 ppm2 7.686 CV 1
OR { 1055}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 65 and name H ))
ASSI { 1056}
(( segid " " and resid 94 and name HB2 ))
(( segid " " and resid 94 and name H ))
2.900 1.100 1.100 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.25139E-02 ppm1 3.997 ppm2 7.864 CV 1
OR { 1056}
(( segid " " and resid 94 and name HB2 ))
(( segid " " and resid 96 and name H ))
OR { 1056}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 35 and name H ))
OR { 1056}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name H ))
ASSI { 1058}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 63 and name H ))
3.300 1.400 1.400 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.26203E-02 ppm1 4.001 ppm2 8.659 CV 1
OR { 1058}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 61 and name H ))
ASSI { 1060}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HA ))
3.100 1.200 1.200 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.23065E-02 ppm1 4.000 ppm2 4.580 CV 1
OR { 1060}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 62 and name HA ))
ASSI { 1063}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 61 and name HB2 ))
3.700 1.700 1.700 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.92122E-03 ppm1 4.001 ppm2 2.702 CV 1
OR { 1063}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 31 and name HB2 ))
OR { 1063}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 61 and name HB3 ))
OR { 1063}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 61 and name HB2 ))
OR { 1063}
(( segid " " and resid 94 and name HB2 ))
(( segid " " and resid 91 and name HB3 ))
ASSI { 1064}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 64 and name HB2 ))
3.000 1.100 1.100 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.13113E-02 ppm1 4.000 ppm2 1.829 CV 1
OR { 1064}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 30 and name HB3 ))
OR { 1064}
(( segid " " and resid 110 and name HB3 ))
(( segid " " and resid 111 and name HB3 ))
OR { 1064}
(( segid " " and resid 110 and name HB3 ))
(( segid " " and resid 109 and name HB2 ))
ASSI { 1065}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 64 and name HD2 ))
3.700 1.700 1.700 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.17617E-02 ppm1 3.997 ppm2 1.702 CV 1
OR { 1065}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 64 and name HD3 ))
OR { 1065}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 64 and name HB3 ))
OR { 1065}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HB2 ))
OR { 1065}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 54 and name HG ))
ASSI { 1069}
(( segid " " and resid 109 and name HA ))
( segid " " and resid 114 and name HD1%)
3.800 1.800 1.800 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.15168E-02 ppm1 4.608 ppm2 0.938 CV 1
OR { 1069}
(( segid " " and resid 109 and name HA ))
( segid " " and resid 74 and name HG2%)
ASSI { 1077}
(( segid " " and resid 84 and name HG ))
(( segid " " and resid 76 and name HZ3 ))
3.700 1.800 1.800 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.10231E-02 ppm1 1.470 ppm2 7.064 CV 1
OR { 1077}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 76 and name HZ2 ))
OR { 1077}
(( segid " " and resid 59 and name HG ))
(( segid " " and resid 60 and name H ))
OR { 1077}
(( segid " " and resid 84 and name HG ))
(( segid " " and resid 76 and name HZ2 ))
ASSI { 1078}
(( segid " " and resid 84 and name HG ))
(( segid " " and resid 76 and name HH2 ))
3.700 1.700 1.700 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.89790E-03 ppm1 1.475 ppm2 6.879 CV 1
OR { 1078}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 76 and name HH2 ))
OR { 1078}
(( segid " " and resid 59 and name HG ))
( segid " " and resid 21 and name HD% )
OR { 1078}
(( segid " " and resid 17 and name HG ))
( segid " " and resid 21 and name HD% )
OR { 1078}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 9 and name HZ2 ))
ASSI { 1079}
(( segid " " and resid 59 and name HG ))
(( segid " " and resid 59 and name H ))
3.000 1.100 1.100 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.20825E-02 ppm1 1.465 ppm2 7.648 CV 1
OR { 1079}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 109 and name H ))
ASSI { 1080}
(( segid " " and resid 84 and name HG ))
(( segid " " and resid 84 and name H ))
4.800 2.900 1.200 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.43858E-03 ppm1 1.470 ppm2 8.052 CV 1
OR { 1080}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 114 and name H ))
ASSI { 1081}
(( segid " " and resid 59 and name HG ))
(( segid " " and resid 57 and name H ))
4.400 2.500 1.600 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.65818E-03 ppm1 1.487 ppm2 7.874 CV 1
OR { 1081}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 57 and name H ))
OR { 1081}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 40 and name H ))
ASSI { 1082}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 110 and name H ))
3.700 1.700 1.700 peak 1082 spectrum 1 weight 0.10000E+01 volume 0.93009E-03 ppm1 1.477 ppm2 8.326 CV 1
OR { 1082}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 18 and name H ))
OR { 1082}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 54 and name H ))
ASSI { 1083}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 73 and name H ))
3.000 1.100 1.100 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.15161E-02 ppm1 1.386 ppm2 8.163 CV 1
OR { 1083}
(( segid " " and resid 123 and name HG ))
(( segid " " and resid 121 and name H ))
ASSI { 1091}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 73 and name HA ))
3.400 1.400 1.400 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.20820E-02 ppm1 1.387 ppm2 4.143 CV 1
OR { 1091}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 71 and name HB ))
OR { 1091}
(( segid " " and resid 123 and name HG ))
(( segid " " and resid 121 and name HA ))
ASSI { 1096}
(( segid " " and resid 109 and name HB3 ))
( segid " " and resid 102 and name HE% )
4.200 2.200 1.800 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.42634E-03 ppm1 1.479 ppm2 2.168 CV 1
OR { 1096}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 113 and name HB3 ))
OR { 1096}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 113 and name HB2 ))
ASSI { 1097}
(( segid " " and resid 109 and name HB3 ))
( segid " " and resid 114 and name HD1%)
3.300 1.400 1.400 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.14293E-02 ppm1 1.482 ppm2 0.955 CV 1
OR { 1097}
(( segid " " and resid 109 and name HB3 ))
( segid " " and resid 74 and name HG2%)
ASSI { 1102}
(( segid " " and resid 73 and name HG13))
( segid " " and resid 73 and name HD1%)
1.900 0.400 0.400 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.20845E-01 ppm1 1.387 ppm2 0.821 CV 1
OR { 1102}
(( segid " " and resid 123 and name HG ))
( segid " " and resid 123 and name HD1%)
OR { 1102}
(( segid " " and resid 73 and name HG13))
( segid " " and resid 73 and name HG2%)
ASSI { 1104}
(( segid " " and resid 84 and name HG ))
( segid " " and resid 84 and name HD1%)
2.200 0.600 0.600 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.66110E-02 ppm1 1.474 ppm2 1.067 CV 1
OR { 1104}
(( segid " " and resid 17 and name HG ))
( segid " " and resid 17 and name HD1%)
ASSI { 1105}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 73 and name HB ))
2.200 0.600 0.600 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.73276E-02 ppm1 1.386 ppm2 1.777 CV 1
OR { 1105}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 109 and name HB2 ))
ASSI { 1106}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 17 and name HB2 ))
2.400 0.700 0.700 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.58503E-02 ppm1 1.472 ppm2 1.779 CV 1
OR { 1106}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 109 and name HB2 ))
ASSI { 1107}
(( segid " " and resid 59 and name HG ))
( segid " " and resid 57 and name HE% )
2.400 0.700 0.700 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.33077E-02 ppm1 1.473 ppm2 1.986 CV 1
OR { 1107}
(( segid " " and resid 84 and name HG ))
(( segid " " and resid 84 and name HB3 ))
OR { 1107}
(( segid " " and resid 17 and name HG ))
( segid " " and resid 57 and name HE% )
ASSI { 1109}
(( segid " " and resid 109 and name HG2 ))
( segid " " and resid 102 and name HE% )
3.800 1.800 1.800 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.71796E-03 ppm1 1.388 ppm2 2.165 CV 1
OR { 1109}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 113 and name HB3 ))
OR { 1109}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 113 and name HB2 ))
ASSI { 1110}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 17 and name HB3 ))
2.800 1.000 1.000 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.26154E-02 ppm1 1.472 ppm2 2.168 CV 1
OR { 1110}
(( segid " " and resid 59 and name HG ))
(( segid " " and resid 57 and name HG3 ))
OR { 1110}
(( segid " " and resid 59 and name HG ))
(( segid " " and resid 57 and name HB2 ))
OR { 1110}
(( segid " " and resid 109 and name HG3 ))
( segid " " and resid 102 and name HE% )
OR { 1110}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 53 and name HB2 ))
OR { 1110}
(( segid " " and resid 84 and name HG ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 1116}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 17 and name HA ))
3.300 1.300 1.300 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.17264E-02 ppm1 1.481 ppm2 3.969 CV 1
OR { 1116}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 14 and name HA ))
OR { 1116}
(( segid " " and resid 84 and name HG ))
(( segid " " and resid 81 and name HA ))
OR { 1116}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 110 and name HB3 ))
OR { 1116}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 37 and name HA ))
ASSI { 1117}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 18 and name HA ))
3.700 1.700 1.700 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.93299E-03 ppm1 1.480 ppm2 3.801 CV 1
OR { 1117}
(( segid " " and resid 59 and name HG ))
(( segid " " and resid 18 and name HA ))
OR { 1117}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 50 and name HA ))
ASSI { 1118}
(( segid " " and resid 59 and name HG ))
(( segid " " and resid 54 and name HA ))
4.200 2.200 1.800 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.88145E-03 ppm1 1.474 ppm2 3.693 CV 1
OR { 1118}
(( segid " " and resid 17 and name HG ))
(( segid " " and resid 54 and name HA ))
ASSI { 1121}
(( segid " " and resid 109 and name HD2 ))
( segid " " and resid 105 and name HD1%)
3.400 1.400 1.400 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.11013E-02 ppm1 2.788 ppm2 1.048 CV 1
OR { 1121}
(( segid " " and resid 109 and name HD2 ))
( segid " " and resid 84 and name HD1%)
ASSI { 1122}
(( segid " " and resid 109 and name HD2 ))
( segid " " and resid 74 and name HG2%)
3.100 1.200 1.200 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.18535E-02 ppm1 2.788 ppm2 0.947 CV 1
OR { 1122}
(( segid " " and resid 109 and name HD2 ))
( segid " " and resid 114 and name HD1%)
ASSI { 1125}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 109 and name HG2 ))
2.900 1.000 1.000 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.16630E-02 ppm1 2.791 ppm2 1.375 CV 1
OR { 1125}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 45 and name HG3 ))
ASSI { 1131}
(( segid " " and resid 109 and name HD3 ))
( segid " " and resid 105 and name HD1%)
3.300 1.300 1.300 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.14903E-02 ppm1 2.425 ppm2 1.046 CV 1
OR { 1131}
(( segid " " and resid 109 and name HD3 ))
( segid " " and resid 84 and name HD1%)
ASSI { 1132}
(( segid " " and resid 109 and name HD3 ))
( segid " " and resid 74 and name HG2%)
3.000 1.100 1.100 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.22247E-02 ppm1 2.423 ppm2 0.951 CV 1
OR { 1132}
(( segid " " and resid 109 and name HD3 ))
( segid " " and resid 114 and name HD1%)
ASSI { 1140}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name H ))
2.700 0.900 0.900 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.29121E-02 ppm1 1.732 ppm2 8.180 CV 1
OR { 1140}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name H ))
OR { 1140}
(( segid " " and resid 108 and name HB3 ))
(( segid " " and resid 108 and name H ))
ASSI { 1150}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HD2 ))
3.400 1.500 1.500 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.17184E-02 ppm1 1.720 ppm2 3.809 CV 1
OR { 1150}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 62 and name HB3 ))
ASSI { 1154}
(( segid " " and resid 133 and name HG3 ))
(( segid " " and resid 135 and name HG3 ))
3.200 1.300 1.300 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.26517E-02 ppm1 1.462 ppm2 2.397 CV 1
OR { 1154}
(( segid " " and resid 133 and name HG3 ))
(( segid " " and resid 135 and name HG2 ))
OR { 1154}
(( segid " " and resid 133 and name HG2 ))
(( segid " " and resid 135 and name HG3 ))
OR { 1154}
(( segid " " and resid 133 and name HG2 ))
(( segid " " and resid 135 and name HG2 ))
OR { 1154}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 65 and name HB3 ))
OR { 1154}
(( segid " " and resid 64 and name HG3 ))
(( segid " " and resid 65 and name HB3 ))
ASSI { 1156}
(( segid " " and resid 105 and name HG12))
( segid " " and resid 105 and name HD1%)
2.100 0.500 0.500 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.96163E-02 ppm1 1.591 ppm2 1.035 CV 1
OR { 1156}
(( segid " " and resid 105 and name HG12))
( segid " " and resid 105 and name HG2%)
OR { 1156}
(( segid " " and resid 105 and name HG12))
( segid " " and resid 101 and name HG2%)
ASSI { 1157}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 50 and name HB ))
2.800 1.000 1.000 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.35626E-02 ppm1 1.615 ppm2 2.170 CV 1
OR { 1157}
(( segid " " and resid 111 and name HG3 ))
( segid " " and resid 102 and name HE% )
OR { 1157}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 53 and name HB2 ))
OR { 1157}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 17 and name HB3 ))
OR { 1157}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 49 and name HB3 ))
ASSI { 1158}
(( segid " " and resid 111 and name HG3 ))
(( segid " " and resid 111 and name HB3 ))
2.700 0.900 0.900 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.60976E-02 ppm1 1.624 ppm2 1.845 CV 1
OR { 1158}
(( segid " " and resid 111 and name HG3 ))
(( segid " " and resid 98 and name HB3 ))
OR { 1158}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 37 and name HB3 ))
ASSI { 1161}
(( segid " " and resid 111 and name HG3 ))
(( segid " " and resid 111 and name HA ))
3.300 1.400 1.400 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.24146E-02 ppm1 1.612 ppm2 3.977 CV 1
OR { 1161}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 37 and name HA ))
OR { 1161}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 17 and name HA ))
ASSI { 1162}
(( segid " " and resid 108 and name HD3 ))
(( segid " " and resid 108 and name HA ))
3.100 1.200 1.200 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.43804E-02 ppm1 1.596 ppm2 4.076 CV 1
OR { 1162}
(( segid " " and resid 108 and name HD2 ))
(( segid " " and resid 108 and name HA ))
OR { 1162}
(( segid " " and resid 105 and name HG12))
(( segid " " and resid 106 and name HA ))
ASSI { 1166}
(( segid " " and resid 105 and name HG12))
(( segid " " and resid 105 and name H ))
4.300 2.300 1.700 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.76930E-03 ppm1 1.568 ppm2 8.113 CV 1
OR { 1166}
(( segid " " and resid 127 and name HG3 ))
(( segid " " and resid 116 and name H ))
OR { 1166}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 36 and name H ))
ASSI { 1168}
(( segid " " and resid 111 and name HG3 ))
(( segid " " and resid 112 and name H ))
4.600 2.600 1.400 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.62975E-03 ppm1 1.617 ppm2 8.545 CV 1
OR { 1168}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 37 and name H ))
OR { 1168}
(( segid " " and resid 111 and name HG3 ))
(( segid " " and resid 98 and name H ))
ASSI { 1169}
(( segid " " and resid 107 and name HA ))
( segid " " and resid 74 and name HG1%)
4.400 2.400 1.600 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.52559E-03 ppm1 4.467 ppm2 0.822 CV 1
OR { 1169}
(( segid " " and resid 107 and name HA ))
( segid " " and resid 73 and name HG2%)
ASSI { 1172}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 105 and name HG12))
4.400 2.400 1.600 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.73206E-03 ppm1 4.455 ppm2 1.598 CV 1
OR { 1172}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 108 and name HD2 ))
ASSI { 1173}
( segid " " and resid 107 and name HB% )
( segid " " and resid 74 and name HG1%)
2.900 1.000 1.000 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.46146E-02 ppm1 1.157 ppm2 0.832 CV 1
OR { 1173}
( segid " " and resid 107 and name HB% )
( segid " " and resid 73 and name HG2%)
ASSI { 1176}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 80 and name HG3 ))
3.600 1.600 1.600 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.62206E-03 ppm1 1.158 ppm2 2.779 CV 1
OR { 1176}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 109 and name HD2 ))
ASSI { 1178}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 80 and name HB3 ))
2.700 2.700 3.300 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.72699E-03 ppm1 1.154 ppm2 2.553 CV 1
OR { 1178}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 102 and name HG3 ))
ASSI { 1182}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 105 and name HB ))
2.500 2.500 3.500 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.81387E-03 ppm1 1.154 ppm2 1.967 CV 1
OR { 1182}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 111 and name HB2 ))
ASSI { 1183}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 84 and name HB2 ))
3.200 1.300 1.300 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.27432E-02 ppm1 1.157 ppm2 1.744 CV 1
OR { 1183}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 109 and name HB2 ))
OR { 1183}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 108 and name HB2 ))
ASSI { 1185}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 105 and name HG13))
3.000 1.100 1.100 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.63349E-02 ppm1 1.157 ppm2 1.433 CV 1
OR { 1185}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 109 and name HG3 ))
ASSI { 1186}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 108 and name HA ))
4.000 2.000 2.000 peak 1186 spectrum 1 weight 0.10000E+01 volume 0.78851E-03 ppm1 4.466 ppm2 4.076 CV 1
OR { 1186}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 106 and name HA ))
ASSI { 1187}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 84 and name HA ))
2.800 2.800 3.200 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.89873E-03 ppm1 1.161 ppm2 4.157 CV 1
OR { 1187}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 73 and name HA ))
ASSI { 1221}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 84 and name H ))
2.500 2.500 3.500 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.82731E-03 ppm1 1.310 ppm2 8.069 CV 1
OR { 1221}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 83 and name H ))
OR { 1221}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 114 and name H ))
ASSI { 1237}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 105 and name H ))
3.600 1.700 1.700 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.23932E-02 ppm1 1.047 ppm2 8.078 CV 1
OR { 1237}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 105 and name H ))
ASSI { 1238}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 76 and name HE3 ))
4.100 2.100 1.900 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.65570E-03 ppm1 1.044 ppm2 7.362 CV 1
OR { 1238}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 104 and name H ))
ASSI { 1244}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 87 and name HD2%)
3.000 1.100 1.100 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.39078E-02 ppm1 4.222 ppm2 1.041 CV 1
OR { 1244}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 105 and name HG2%)
OR { 1244}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 105 and name HD1%)
ASSI { 1245}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HG13))
3.100 1.200 1.200 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.86896E-03 ppm1 4.235 ppm2 1.355 CV 1
OR { 1245}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 106 and name HG2%)
ASSI { 1249}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 87 and name HB2 ))
4.100 2.100 1.900 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.42413E-03 ppm1 4.230 ppm2 2.232 CV 1
OR { 1249}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 83 and name HB3 ))
ASSI { 1250}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 104 and name HB3 ))
4.000 2.000 2.000 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.87677E-03 ppm1 4.240 ppm2 2.895 CV 1
OR { 1250}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HB3 ))
OR { 1250}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 1255}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 102 and name HA ))
4.800 2.900 1.200 peak 1255 spectrum 1 weight 0.10000E+01 volume 0.24241E-03 ppm1 1.955 ppm2 4.065 CV 1
OR { 1255}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 106 and name HA ))
ASSI { 1258}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 105 and name HG13))
2.200 0.600 0.600 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.73262E-02 ppm1 1.049 ppm2 1.419 CV 1
OR { 1258}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 84 and name HG ))
OR { 1258}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 98 and name HB2 ))
ASSI { 1259}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 105 and name HB ))
2.500 0.800 0.800 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.48922E-02 ppm1 1.048 ppm2 1.970 CV 1
OR { 1259}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 105 and name HB ))
ASSI { 1261}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 108 and name HB3 ))
3.500 1.500 1.500 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.24666E-02 ppm1 1.035 ppm2 1.713 CV 1
OR { 1261}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 108 and name HB2 ))
OR { 1261}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 111 and name HG2 ))
ASSI { 1264}
( segid " " and resid 105 and name HG2%)
( segid " " and resid 102 and name HE% )
2.900 1.000 1.000 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.33466E-02 ppm1 1.032 ppm2 2.159 CV 1
OR { 1264}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 87 and name HG ))
ASSI { 1267}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 102 and name HG2 ))
4.200 2.200 1.800 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.79525E-03 ppm1 1.031 ppm2 2.756 CV 1
OR { 1267}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 109 and name HD2 ))
ASSI { 1271}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 102 and name HA ))
2.500 0.800 0.800 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.49791E-02 ppm1 1.031 ppm2 4.061 CV 1
OR { 1271}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 106 and name HA ))
ASSI { 1276}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 67 and name H ))
3.400 1.400 1.400 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.10806E-02 ppm1 2.888 ppm2 7.759 CV 1
OR { 1276}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 30 and name HE22))
ASSI { 1280}
(( segid " " and resid 31 and name HB3 ))
( segid " " and resid 66 and name HE% )
4.200 2.200 1.800 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.50524E-03 ppm1 2.891 ppm2 7.076 CV 1
OR { 1280}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 30 and name HE21))
ASSI { 1281}
(( segid " " and resid 103 and name HE3 ))
(( segid " " and resid 100 and name HA ))
3.500 1.600 1.600 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.15946E-02 ppm1 2.889 ppm2 3.933 CV 1
OR { 1281}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 100 and name HA ))
OR { 1281}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 34 and name HA ))
ASSI { 1290}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 102 and name HB2 ))
3.200 1.300 1.300 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.10941E-02 ppm1 2.887 ppm2 2.097 CV 1
OR { 1290}
(( segid " " and resid 103 and name HE3 ))
(( segid " " and resid 102 and name HB2 ))
OR { 1290}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 30 and name HG2 ))
ASSI { 1303}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 114 and name H ))
4.100 2.100 1.900 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.87807E-03 ppm1 2.158 ppm2 8.093 CV 1
OR { 1303}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 105 and name H ))
ASSI { 1309}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 30 and name H ))
4.300 2.300 1.700 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.95329E-03 ppm1 2.109 ppm2 7.479 CV 1
OR { 1309}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 24 and name HD22))
ASSI { 1312}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 103 and name H ))
3.400 1.500 1.500 peak 1312 spectrum 1 weight 0.10000E+01 volume 0.12983E-02 ppm1 4.048 ppm2 7.437 CV 1
OR { 1312}
(( segid " " and resid 128 and name HA ))
(( segid " " and resid 131 and name H ))
ASSI { 1314}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 110 and name HB2 ))
4.300 2.300 1.700 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.75341E-03 ppm1 2.159 ppm2 4.283 CV 1
OR { 1314}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 113 and name HA ))
ASSI { 1315}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 102 and name HA ))
2.400 0.700 0.700 peak 1315 spectrum 1 weight 0.10000E+01 volume 0.62451E-02 ppm1 2.159 ppm2 4.021 CV 1
OR { 1315}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 111 and name HA ))
ASSI { 1316}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 101 and name HA ))
4.200 2.200 1.800 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.10513E-02 ppm1 2.160 ppm2 3.624 CV 1
OR { 1316}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 99 and name HA3 ))
ASSI { 1319}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 103 and name HE2 ))
4.100 2.100 1.900 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.79666E-03 ppm1 2.159 ppm2 2.891 CV 1
OR { 1319}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 104 and name HB3 ))
ASSI { 1323}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 111 and name HG2 ))
2.400 0.700 0.700 peak 1323 spectrum 1 weight 0.10000E+01 volume 0.62366E-02 ppm1 2.159 ppm2 1.745 CV 1
OR { 1323}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 98 and name HG ))
ASSI { 1325}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 109 and name HB3 ))
3.200 1.200 1.200 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.41833E-02 ppm1 2.159 ppm2 1.444 CV 1
OR { 1325}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 109 and name HG3 ))
OR { 1325}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 98 and name HB2 ))
OR { 1325}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 105 and name HG13))
OR { 1325}
( segid " " and resid 102 and name HE% )
(( segid " " and resid 84 and name HG ))
ASSI { 1327}
( segid " " and resid 102 and name HE% )
( segid " " and resid 114 and name HD1%)
2.100 0.600 0.600 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.11530E-01 ppm1 2.159 ppm2 0.956 CV 1
OR { 1327}
( segid " " and resid 102 and name HE% )
( segid " " and resid 101 and name HG2%)
ASSI { 1328}
(( segid " " and resid 102 and name HG2 ))
( segid " " and resid 101 and name HG2%)
3.300 1.400 1.400 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.30192E-02 ppm1 2.737 ppm2 0.959 CV 1
OR { 1328}
(( segid " " and resid 102 and name HG2 ))
( segid " " and resid 114 and name HD1%)
ASSI { 1329}
(( segid " " and resid 102 and name HG3 ))
( segid " " and resid 101 and name HG2%)
3.900 1.900 1.900 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.32351E-02 ppm1 2.583 ppm2 0.957 CV 1
OR { 1329}
(( segid " " and resid 102 and name HG3 ))
( segid " " and resid 114 and name HD1%)
ASSI { 1335}
(( segid " " and resid 102 and name HA ))
( segid " " and resid 105 and name HG2%)
2.400 0.700 0.700 peak 1335 spectrum 1 weight 0.10000E+01 volume 0.63802E-02 ppm1 4.046 ppm2 1.021 CV 1
OR { 1335}
(( segid " " and resid 102 and name HA ))
( segid " " and resid 101 and name HG2%)
OR { 1335}
(( segid " " and resid 102 and name HA ))
( segid " " and resid 105 and name HD1%)
ASSI { 1336}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 23 and name HB% )
3.400 1.400 1.400 peak 1336 spectrum 1 weight 0.10000E+01 volume 0.30277E-02 ppm1 4.025 ppm2 1.449 CV 1
OR { 1336}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 22 and name HB3 ))
OR { 1336}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 35 and name HB% )
OR { 1336}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 17 and name HG ))
OR { 1336}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 51 and name HG12))
ASSI { 1339}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HB3 ))
2.400 0.700 0.700 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.10170E-01 ppm1 4.022 ppm2 2.239 CV 1
OR { 1339}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HB3 ))
OR { 1339}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB2 ))
OR { 1339}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB2 ))
OR { 1339}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HG3 ))
ASSI { 1341}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HG2 ))
3.300 1.400 1.400 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.12461E-02 ppm1 4.045 ppm2 2.738 CV 1
OR { 1341}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HG3 ))
OR { 1341}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HG2 ))
ASSI { 1342}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HB3 ))
3.400 1.500 1.500 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.14251E-02 ppm1 4.044 ppm2 2.583 CV 1
OR { 1342}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HG3 ))
ASSI { 1348}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 98 and name H ))
3.800 1.800 1.800 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.19196E-02 ppm1 1.019 ppm2 8.585 CV 1
OR { 1348}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 37 and name H ))
OR { 1348}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 102 and name H ))
OR { 1348}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 22 and name H ))
ASSI { 1349}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 37 and name H ))
3.700 1.800 1.800 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.61268E-03 ppm1 3.591 ppm2 8.587 CV 1
OR { 1349}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 102 and name H ))
ASSI { 1351}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 88 and name H ))
3.000 3.000 3.000 peak 1351 spectrum 1 weight 0.10000E+01 volume 0.45715E-03 ppm1 0.972 ppm2 8.899 CV 1
OR { 1351}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 125 and name H ))
ASSI { 1352}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 88 and name H ))
3.400 1.400 1.400 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.12285E-02 ppm1 1.019 ppm2 8.907 CV 1
OR { 1352}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 21 and name H ))
ASSI { 1355}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 103 and name H ))
4.200 2.200 1.800 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.75779E-03 ppm1 0.987 ppm2 7.500 CV 1
OR { 1355}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 80 and name HE21))
ASSI { 1356}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 104 and name H ))
4.300 2.300 1.700 peak 1356 spectrum 1 weight 0.10000E+01 volume 0.55095E-03 ppm1 0.970 ppm2 7.327 CV 1
OR { 1356}
( segid " " and resid 101 and name HG2%)
( segid " " and resid 91 and name HE% )
ASSI { 1357}
( segid " " and resid 114 and name HG2%)
( segid " " and resid 88 and name HD% )
3.700 1.700 1.700 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.12998E-02 ppm1 0.972 ppm2 7.060 CV 1
OR { 1357}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 76 and name HZ2 ))
OR { 1357}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 76 and name HZ2 ))
OR { 1357}
( segid " " and resid 101 and name HG2%)
( segid " " and resid 88 and name HD% )
ASSI { 1358}
( segid " " and resid 101 and name HD1%)
( segid " " and resid 88 and name HD% )
2.900 1.100 1.100 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.33893E-02 ppm1 1.024 ppm2 7.047 CV 1
OR { 1358}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 76 and name HZ3 ))
OR { 1358}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 66 and name HE% )
ASSI { 1360}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 35 and name H ))
4.200 2.200 1.800 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.79745E-03 ppm1 1.016 ppm2 7.862 CV 1
OR { 1360}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 99 and name H ))
ASSI { 1361}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 100 and name H ))
2.800 2.800 3.200 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.79028E-03 ppm1 1.023 ppm2 7.753 CV 1
OR { 1361}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 91 and name H ))
OR { 1361}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 130 and name H ))
OR { 1361}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 49 and name H ))
ASSI { 1364}
( segid " " and resid 101 and name HD1%)
( segid " " and resid 118 and name HD2%)
3.100 1.200 1.200 peak 1364 spectrum 1 weight 0.10000E+01 volume 0.54297E-02 ppm1 1.020 ppm2 0.769 CV 1
OR { 1364}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 17 and name HD2%)
OR { 1364}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 54 and name HB2 ))
OR { 1364}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 51 and name HD1%)
OR { 1364}
( segid " " and resid 101 and name HD1%)
( segid " " and resid 123 and name HD1%)
ASSI { 1365}
( segid " " and resid 101 and name HD1%)
( segid " " and resid 84 and name HD2%)
3.000 3.000 3.000 peak 1365 spectrum 1 weight 0.10000E+01 volume 0.35774E-02 ppm1 1.018 ppm2 0.620 CV 1
OR { 1365}
( segid " " and resid 105 and name HD1%)
( segid " " and resid 84 and name HD2%)
OR { 1365}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 20 and name HD1%)
OR { 1365}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 20 and name HD2%)
ASSI { 1367}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 84 and name HB2 ))
2.700 0.900 0.900 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.33634E-02 ppm1 1.046 ppm2 1.831 CV 1
OR { 1367}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 98 and name HB3 ))
OR { 1367}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 114 and name HG13))
OR { 1367}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 114 and name HG13))
ASSI { 1368}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 84 and name HB2 ))
2.700 0.900 0.900 peak 1368 spectrum 1 weight 0.10000E+01 volume 0.24408E-02 ppm1 1.030 ppm2 1.762 CV 1
OR { 1368}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 54 and name HG ))
OR { 1368}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 109 and name HB2 ))
OR { 1368}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 111 and name HG2 ))
ASSI { 1370}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 109 and name HD2 ))
3.900 1.900 1.900 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.93948E-03 ppm1 1.044 ppm2 2.767 CV 1
OR { 1370}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 80 and name HG3 ))
OR { 1370}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 102 and name HG2 ))
ASSI { 1371}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 102 and name HG3 ))
3.800 1.800 1.800 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.84829E-03 ppm1 1.026 ppm2 2.572 CV 1
OR { 1371}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 102 and name HG3 ))
ASSI { 1372}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 109 and name HD3 ))
3.400 1.400 1.400 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.15506E-02 ppm1 1.047 ppm2 2.424 CV 1
OR { 1372}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 89 and name HG2 ))
ASSI { 1374}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 98 and name HA ))
2.200 0.600 0.600 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.45024E-02 ppm1 1.018 ppm2 3.981 CV 1
OR { 1374}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 21 and name HA ))
OR { 1374}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 88 and name HA ))
ASSI { 1375}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 33 and name HA ))
2.200 0.600 0.600 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.33977E-02 ppm1 1.016 ppm2 3.624 CV 1
OR { 1375}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 101 and name HA ))
OR { 1375}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HA ))
ASSI { 1376}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 91 and name HB2 ))
4.000 2.000 2.000 peak 1376 spectrum 1 weight 0.10000E+01 volume 0.60898E-03 ppm1 1.014 ppm2 3.364 CV 1
OR { 1376}
( segid " " and resid 101 and name HD1%)
(( segid " " and resid 115 and name HA ))
OR { 1376}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 66 and name HB3 ))
ASSI { 1378}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 102 and name HA ))
3.200 1.300 1.300 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.27373E-02 ppm1 0.984 ppm2 4.014 CV 1
OR { 1378}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 98 and name HA ))
ASSI { 1379}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 102 and name HG2 ))
3.700 1.800 1.800 peak 1379 spectrum 1 weight 0.10000E+01 volume 0.10971E-02 ppm1 0.977 ppm2 2.738 CV 1
OR { 1379}
( segid " " and resid 101 and name HG2%)
(( segid " " and resid 109 and name HD2 ))
ASSI { 1382}
(( segid " " and resid 36 and name HB ))
( segid " " and resid 36 and name HG2%)
2.300 0.700 0.700 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.47906E-02 ppm1 2.050 ppm2 1.002 CV 1
OR { 1382}
(( segid " " and resid 101 and name HB ))
( segid " " and resid 101 and name HG2%)
OR { 1382}
(( segid " " and resid 36 and name HB ))
( segid " " and resid 36 and name HD1%)
OR { 1382}
(( segid " " and resid 101 and name HB ))
( segid " " and resid 101 and name HD1%)
ASSI { 1383}
(( segid " " and resid 36 and name HB ))
( segid " " and resid 36 and name HG2%)
2.200 0.600 0.600 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.62305E-02 ppm1 2.102 ppm2 0.984 CV 1
OR { 1383}
(( segid " " and resid 36 and name HB ))
( segid " " and resid 36 and name HD1%)
OR { 1383}
(( segid " " and resid 36 and name HB ))
( segid " " and resid 33 and name HG2%)
ASSI { 1385}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 98 and name HA ))
4.600 2.700 1.400 peak 1385 spectrum 1 weight 0.10000E+01 volume 0.56991E-03 ppm1 3.581 ppm2 3.967 CV 1
OR { 1385}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 100 and name HA ))
OR { 1385}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 21 and name HA ))
OR { 1385}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 88 and name HA ))
OR { 1385}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 37 and name HA ))
ASSI { 1386}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 36 and name HG12))
4.000 2.000 2.000 peak 1386 spectrum 1 weight 0.10000E+01 volume 0.13429E-02 ppm1 3.623 ppm2 2.228 CV 1
OR { 1386}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 87 and name HB2 ))
OR { 1386}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 50 and name HB ))
ASSI { 1391}
(( segid " " and resid 100 and name HB2 ))
( segid " " and resid 91 and name HD% )
3.600 1.600 1.600 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.63103E-03 ppm1 2.293 ppm2 7.074 CV 1
OR { 1391}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 100 and name HD2 ))
ASSI { 1394}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 99 and name H ))
4.100 2.100 1.900 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.43963E-03 ppm1 7.074 ppm2 7.858 CV 1
OR { 1394}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 96 and name H ))
ASSI { 1403}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 11 and name HD2 ))
3.000 1.100 1.100 peak 1403 spectrum 1 weight 0.10000E+01 volume 0.20226E-02 ppm1 2.291 ppm2 3.984 CV 1
OR { 1403}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 11 and name HD3 ))
OR { 1403}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 100 and name HA ))
ASSI { 1404}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 11 and name HA ))
3.600 1.600 1.600 peak 1404 spectrum 1 weight 0.10000E+01 volume 0.54691E-03 ppm1 2.292 ppm2 4.518 CV 1
OR { 1404}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 1406}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 11 and name HB2 ))
2.900 1.100 1.100 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.43415E-02 ppm1 2.276 ppm2 2.493 CV 1
OR { 1406}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HG2 ))
ASSI { 1408}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 86 and name HG2 ))
4.300 2.300 1.700 peak 1408 spectrum 1 weight 0.10000E+01 volume 0.11523E-02 ppm1 2.276 ppm2 1.815 CV 1
OR { 1408}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 84 and name HB2 ))
OR { 1408}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 82 and name HG ))
OR { 1408}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 103 and name HB2 ))
ASSI { 1409}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 57 and name HB3 ))
4.600 2.600 1.400 peak 1409 spectrum 1 weight 0.10000E+01 volume 0.27797E-03 ppm1 2.281 ppm2 1.695 CV 1
OR { 1409}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 18 and name HG3 ))
ASSI { 1411}
(( segid " " and resid 100 and name HB3 ))
( segid " " and resid 91 and name HD% )
3.900 1.900 1.900 peak 1411 spectrum 1 weight 0.10000E+01 volume 0.52649E-03 ppm1 0.996 ppm2 7.097 CV 1
OR { 1411}
(( segid " " and resid 100 and name HB3 ))
(( segid " " and resid 100 and name HD2 ))
ASSI { 1412}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HD2 ))
3.900 1.900 1.900 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.93164E-03 ppm1 3.940 ppm2 7.069 CV 1
OR { 1412}
(( segid " " and resid 100 and name HA ))
( segid " " and resid 91 and name HD% )
ASSI { 1417}
(( segid " " and resid 98 and name HA ))
( segid " " and resid 101 and name HD1%)
2.200 0.600 0.600 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.61473E-02 ppm1 3.983 ppm2 0.991 CV 1
OR { 1417}
(( segid " " and resid 98 and name HA ))
( segid " " and resid 97 and name HG2%)
OR { 1417}
(( segid " " and resid 98 and name HA ))
( segid " " and resid 101 and name HG2%)
OR { 1417}
(( segid " " and resid 98 and name HA ))
( segid " " and resid 114 and name HG2%)
ASSI { 1420}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 23 and name HB% )
2.400 0.800 0.800 peak 1420 spectrum 1 weight 0.10000E+01 volume 0.52079E-02 ppm1 3.964 ppm2 1.438 CV 1
OR { 1420}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HB2 ))
ASSI { 1421}
(( segid " " and resid 117 and name HA ))
( segid " " and resid 120 and name HB% )
2.700 0.900 0.900 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.43216E-02 ppm1 4.004 ppm2 1.451 CV 1
OR { 1421}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 59 and name HG ))
ASSI { 1429}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 98 and name HA ))
2.900 1.000 1.000 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.18839E-02 ppm1 1.434 ppm2 3.995 CV 1
OR { 1429}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 111 and name HA ))
ASSI { 1430}
(( segid " " and resid 98 and name HB3 ))
(( segid " " and resid 98 and name HA ))
2.600 0.900 0.900 peak 1430 spectrum 1 weight 0.10000E+01 volume 0.26202E-02 ppm1 1.824 ppm2 3.988 CV 1
OR { 1430}
(( segid " " and resid 98 and name HB3 ))
(( segid " " and resid 111 and name HA ))
ASSI { 1432}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 36 and name HA ))
4.300 2.300 1.700 peak 1432 spectrum 1 weight 0.10000E+01 volume 0.53340E-03 ppm1 1.852 ppm2 3.692 CV 1
OR { 1432}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 54 and name HA ))
ASSI { 1436}
(( segid " " and resid 84 and name HB2 ))
( segid " " and resid 84 and name HD1%)
2.500 0.800 0.800 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.40713E-02 ppm1 1.814 ppm2 1.040 CV 1
OR { 1436}
(( segid " " and resid 84 and name HB2 ))
( segid " " and resid 105 and name HD1%)
OR { 1436}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 17 and name HD1%)
OR { 1436}
(( segid " " and resid 98 and name HB3 ))
( segid " " and resid 101 and name HD1%)
OR { 1436}
(( segid " " and resid 98 and name HB3 ))
( segid " " and resid 97 and name HG1%)
ASSI { 1438}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HA ))
2.700 0.900 0.900 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.54932E-02 ppm1 1.702 ppm2 4.351 CV 1
OR { 1438}
(( segid " " and resid 4 and name HG3 ))
(( segid " " and resid 4 and name HA ))
OR { 1438}
(( segid " " and resid 134 and name HG3 ))
(( segid " " and resid 134 and name HA ))
OR { 1438}
(( segid " " and resid 134 and name HG2 ))
(( segid " " and resid 134 and name HA ))
ASSI { 1439}
( segid " " and resid 98 and name HD2%)
( segid " " and resid 118 and name HD1%)
3.100 1.200 1.200 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.49545E-02 ppm1 0.852 ppm2 0.522 CV 1
OR { 1439}
( segid " " and resid 98 and name HD2%)
( segid " " and resid 124 and name HG1%)
ASSI { 1440}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 31 and name HB3 ))
4.800 2.800 1.200 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.10309E-02 ppm1 0.853 ppm2 2.852 CV 1
OR { 1440}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 39 and name HB3 ))
OR { 1440}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 66 and name HB2 ))
ASSI { 1442}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 102 and name HG3 ))
4.200 2.200 1.800 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.10926E-02 ppm1 0.851 ppm2 2.583 CV 1
OR { 1442}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 96 and name HB2 ))
OR { 1442}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 96 and name HB3 ))
ASSI { 1443}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 114 and name HB ))
2.900 1.000 1.000 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.63384E-02 ppm1 0.852 ppm2 2.209 CV 1
OR { 1443}
( segid " " and resid 98 and name HD2%)
( segid " " and resid 102 and name HE% )
OR { 1443}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 34 and name HG3 ))
OR { 1443}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 50 and name HB ))
ASSI { 1444}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 101 and name HB ))
3.100 1.200 1.200 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.41085E-02 ppm1 0.852 ppm2 2.046 CV 1
OR { 1444}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 118 and name HB2 ))
ASSI { 1445}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 98 and name HB3 ))
2.400 0.700 0.700 peak 1445 spectrum 1 weight 0.10000E+01 volume 0.14018E-01 ppm1 0.852 ppm2 1.854 CV 1
OR { 1445}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HB3 ))
OR { 1445}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 47 and name HB2 ))
OR { 1445}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 47 and name HB3 ))
ASSI { 1446}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 98 and name HG ))
1.700 0.400 0.500 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.24348E-01 ppm1 0.852 ppm2 1.682 CV 1
OR { 1446}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HG ))
ASSI { 1447}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HB2 ))
1.900 0.400 0.400 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.18271E-01 ppm1 0.852 ppm2 1.566 CV 1
OR { 1447}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 47 and name HG2 ))
OR { 1447}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 50 and name HG12))
ASSI { 1448}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 98 and name HB2 ))
2.200 0.600 0.600 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.11385E-01 ppm1 0.851 ppm2 1.440 CV 1
OR { 1448}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 130 and name HB2 ))
ASSI { 1449}
( segid " " and resid 98 and name HD2%)
( segid " " and resid 115 and name HG1%)
2.100 0.500 0.500 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.18710E-01 ppm1 0.851 ppm2 1.118 CV 1
OR { 1449}
( segid " " and resid 98 and name HD2%)
( segid " " and resid 84 and name HD1%)
ASSI { 1450}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 130 and name HA ))
3.800 1.800 1.800 peak 1450 spectrum 1 weight 0.10000E+01 volume 0.16265E-02 ppm1 0.854 ppm2 4.298 CV 1
OR { 1450}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 116 and name HA ))
ASSI { 1451}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 34 and name HA ))
1.900 0.400 0.400 peak 1451 spectrum 1 weight 0.10000E+01 volume 0.12956E-01 ppm1 0.852 ppm2 3.944 CV 1
OR { 1451}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 98 and name HA ))
ASSI { 1453}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 115 and name HA ))
3.200 1.200 1.200 peak 1453 spectrum 1 weight 0.10000E+01 volume 0.21954E-02 ppm1 0.851 ppm2 3.337 CV 1
OR { 1453}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 111 and name HD2 ))
ASSI { 1454}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 47 and name HD3 ))
3.000 1.200 1.200 peak 1454 spectrum 1 weight 0.10000E+01 volume 0.24796E-02 ppm1 0.852 ppm2 3.249 CV 1
OR { 1454}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 47 and name HD2 ))
OR { 1454}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 111 and name HD2 ))
OR { 1454}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 111 and name HD3 ))
ASSI { 1456}
( segid " " and resid 98 and name HD1%)
( segid " " and resid 118 and name HD1%)
3.400 1.400 1.400 peak 1456 spectrum 1 weight 0.10000E+01 volume 0.29686E-02 ppm1 0.895 ppm2 0.536 CV 1
OR { 1456}
( segid " " and resid 98 and name HD1%)
( segid " " and resid 124 and name HG1%)
ASSI { 1457}
( segid " " and resid 98 and name HD1%)
( segid " " and resid 115 and name HG1%)
2.100 0.600 0.600 peak 1457 spectrum 1 weight 0.10000E+01 volume 0.16528E-01 ppm1 0.894 ppm2 1.120 CV 1
OR { 1457}
( segid " " and resid 98 and name HD1%)
( segid " " and resid 84 and name HD1%)
ASSI { 1458}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 98 and name HB2 ))
2.500 0.800 0.800 peak 1458 spectrum 1 weight 0.10000E+01 volume 0.84837E-02 ppm1 0.893 ppm2 1.432 CV 1
OR { 1458}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 130 and name HB2 ))
OR { 1458}
( segid " " and resid 138 and name HD2%)
( segid " " and resid 139 and name HB% )
ASSI { 1460}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 102 and name HG3 ))
4.000 2.000 2.000 peak 1460 spectrum 1 weight 0.10000E+01 volume 0.12090E-02 ppm1 0.893 ppm2 2.581 CV 1
OR { 1460}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 96 and name HB3 ))
ASSI { 1461}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 67 and name HE22))
5.000 3.100 1.000 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.44365E-03 ppm1 0.852 ppm2 6.910 CV 1
OR { 1461}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 76 and name HH2 ))
OR { 1461}
( segid " " and resid 37 and name HD1%)
( segid " " and resid 21 and name HD% )
ASSI { 1462}
( segid " " and resid 98 and name HD2%)
( segid " " and resid 131 and name HD% )
4.000 2.000 2.000 peak 1462 spectrum 1 weight 0.10000E+01 volume 0.15223E-02 ppm1 0.853 ppm2 7.102 CV 1
OR { 1462}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 88 and name HZ ))
OR { 1462}
( segid " " and resid 98 and name HD2%)
( segid " " and resid 91 and name HD% )
OR { 1462}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 76 and name HZ2 ))
OR { 1462}
( segid " " and resid 37 and name HD1%)
( segid " " and resid 66 and name HE% )
OR { 1462}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 76 and name HZ3 ))
ASSI { 1464}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 35 and name H ))
3.800 1.800 1.800 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.18406E-02 ppm1 0.852 ppm2 7.859 CV 1
OR { 1464}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 99 and name H ))
OR { 1464}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 40 and name H ))
ASSI { 1465}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 100 and name H ))
4.000 2.000 2.000 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.13326E-02 ppm1 0.851 ppm2 7.761 CV 1
OR { 1465}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 130 and name H ))
OR { 1465}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 49 and name H ))
ASSI { 1466}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name H ))
2.500 0.800 0.800 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.67094E-02 ppm1 0.851 ppm2 8.577 CV 1
OR { 1466}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 98 and name H ))
OR { 1466}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 115 and name H ))
ASSI { 1468}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 50 and name H ))
4.500 2.500 1.500 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.13920E-02 ppm1 0.853 ppm2 8.200 CV 1
OR { 1468}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 51 and name H ))
OR { 1468}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 89 and name H ))
ASSI { 1469}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 36 and name H ))
3.300 1.300 1.300 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.27081E-02 ppm1 0.852 ppm2 8.102 CV 1
OR { 1469}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 114 and name H ))
ASSI { 1470}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 47 and name H ))
4.900 3.000 1.100 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.45173E-03 ppm1 0.848 ppm2 9.005 CV 1
OR { 1470}
( segid " " and resid 98 and name HD2%)
(( segid " " and resid 111 and name H ))
ASSI { 1471}
(( segid " " and resid 54 and name HG ))
( segid " " and resid 66 and name HE% )
4.700 2.700 1.300 peak 1471 spectrum 1 weight 0.10000E+01 volume 0.50789E-03 ppm1 1.723 ppm2 7.089 CV 1
OR { 1471}
(( segid " " and resid 98 and name HG ))
( segid " " and resid 88 and name HD% )
OR { 1471}
(( segid " " and resid 54 and name HG ))
(( segid " " and resid 60 and name H ))
ASSI { 1472}
(( segid " " and resid 98 and name HG ))
(( segid " " and resid 100 and name H ))
4.600 2.700 1.400 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.66786E-03 ppm1 1.724 ppm2 7.766 CV 1
OR { 1472}
(( segid " " and resid 98 and name HG ))
(( segid " " and resid 130 and name H ))
ASSI { 1473}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 98 and name H ))
2.400 0.700 0.700 peak 1473 spectrum 1 weight 0.10000E+01 volume 0.24496E-02 ppm1 1.432 ppm2 8.570 CV 1
OR { 1473}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name H ))
ASSI { 1477}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name H ))
2.800 1.000 1.000 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.20691E-02 ppm1 3.991 ppm2 8.593 CV 1
OR { 1477}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 102 and name H ))
OR { 1477}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 97 and name H ))
ASSI { 1481}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 92 and name HA ))
2.500 0.800 0.800 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.20560E-02 ppm1 2.190 ppm2 3.554 CV 1
OR { 1481}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 44 and name HD2 ))
ASSI { 1482}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 97 and name HA ))
2.800 1.000 1.000 peak 1482 spectrum 1 weight 0.10000E+01 volume 0.22717E-02 ppm1 2.193 ppm2 3.705 CV 1
OR { 1482}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 44 and name HD3 ))
ASSI { 1485}
( segid " " and resid 97 and name HG1%)
( segid " " and resid 124 and name HG1%)
3.800 1.800 1.800 peak 1485 spectrum 1 weight 0.10000E+01 volume 0.17339E-02 ppm1 1.052 ppm2 0.519 CV 1
OR { 1485}
( segid " " and resid 97 and name HG1%)
( segid " " and resid 118 and name HD1%)
ASSI { 1487}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 101 and name HB ))
4.000 2.000 2.000 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.15175E-02 ppm1 1.050 ppm2 2.030 CV 1
OR { 1487}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 118 and name HB2 ))
ASSI { 1488}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 98 and name HG ))
3.000 1.100 1.100 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.45749E-02 ppm1 1.053 ppm2 1.734 CV 1
OR { 1488}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 111 and name HG2 ))
ASSI { 1492}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 102 and name HG2 ))
4.800 2.900 1.200 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.43230E-03 ppm1 1.050 ppm2 2.763 CV 1
OR { 1492}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 95 and name HB3 ))
OR { 1492}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 95 and name HB2 ))
ASSI { 1494}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 96 and name HB2 ))
5.200 3.400 0.800 peak 1494 spectrum 1 weight 0.10000E+01 volume 0.74482E-03 ppm1 1.048 ppm2 2.547 CV 1
OR { 1494}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 96 and name HB3 ))
OR { 1494}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 89 and name HG3 ))
ASSI { 1496}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 98 and name HA ))
3.200 1.300 1.300 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.24365E-02 ppm1 1.050 ppm2 3.976 CV 1
OR { 1496}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 88 and name HA ))
ASSI { 1497}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 97 and name HA ))
3.300 1.400 1.400 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.36887E-02 ppm1 1.050 ppm2 3.628 CV 1
OR { 1497}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 92 and name HA ))
ASSI { 1498}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 91 and name HB2 ))
4.600 2.600 1.400 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.64572E-03 ppm1 1.051 ppm2 3.355 CV 1
OR { 1498}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 115 and name HA ))
ASSI { 1499}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 88 and name HB3 ))
5.100 3.300 0.900 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.54046E-03 ppm1 1.049 ppm2 3.235 CV 1
OR { 1499}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 111 and name HD3 ))
ASSI { 1500}
( segid " " and resid 97 and name HG2%)
( segid " " and resid 118 and name HD1%)
3.700 1.700 1.700 peak 1500 spectrum 1 weight 0.10000E+01 volume 0.22049E-02 ppm1 0.998 ppm2 0.516 CV 1
OR { 1500}
( segid " " and resid 97 and name HG2%)
( segid " " and resid 124 and name HG1%)
ASSI { 1503}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 37 and name HB3 ))
3.400 1.500 1.500 peak 1503 spectrum 1 weight 0.10000E+01 volume 0.27461E-02 ppm1 0.998 ppm2 1.834 CV 1
OR { 1503}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 98 and name HB3 ))
OR { 1503}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 47 and name HB3 ))
ASSI { 1506}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 35 and name HA ))
3.900 1.900 1.900 peak 1506 spectrum 1 weight 0.10000E+01 volume 0.12820E-02 ppm1 1.002 ppm2 4.198 CV 1
OR { 1506}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 59 and name HA ))
ASSI { 1508}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 97 and name HA ))
2.300 0.700 0.700 peak 1508 spectrum 1 weight 0.10000E+01 volume 0.70557E-02 ppm1 1.000 ppm2 3.620 CV 1
OR { 1508}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 92 and name HA ))
ASSI { 1511}
( segid " " and resid 97 and name HG2%)
( segid " " and resid 88 and name HD% )
2.500 0.800 0.800 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.44043E-02 ppm1 1.000 ppm2 7.061 CV 1
OR { 1511}
( segid " " and resid 97 and name HG2%)
( segid " " and resid 91 and name HD% )
ASSI { 1512}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 92 and name H ))
2.800 1.000 1.000 peak 1512 spectrum 1 weight 0.10000E+01 volume 0.31353E-02 ppm1 1.000 ppm2 7.836 CV 1
OR { 1512}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 99 and name H ))
ASSI { 1514}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 98 and name H ))
3.200 1.300 1.300 peak 1514 spectrum 1 weight 0.10000E+01 volume 0.39026E-02 ppm1 1.001 ppm2 8.615 CV 1
OR { 1514}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 97 and name H ))
ASSI { 1518}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 99 and name H ))
3.900 1.900 1.900 peak 1518 spectrum 1 weight 0.10000E+01 volume 0.19201E-02 ppm1 1.050 ppm2 7.834 CV 1
OR { 1518}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 96 and name H ))
ASSI { 1519}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 98 and name H ))
2.200 0.600 0.600 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.65696E-02 ppm1 1.050 ppm2 8.594 CV 1
OR { 1519}
( segid " " and resid 97 and name HG1%)
(( segid " " and resid 97 and name H ))
ASSI { 1522}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 100 and name HD2 ))
4.000 2.000 2.000 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.77690E-03 ppm1 3.668 ppm2 7.077 CV 1
OR { 1522}
(( segid " " and resid 97 and name HA ))
( segid " " and resid 91 and name HD% )
OR { 1522}
(( segid " " and resid 97 and name HA ))
( segid " " and resid 88 and name HD% )
ASSI { 1523}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 100 and name H ))
4.200 2.300 1.800 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.34734E-03 ppm1 3.660 ppm2 7.758 CV 1
OR { 1523}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 91 and name H ))
ASSI { 1524}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 94 and name H ))
3.900 1.900 1.900 peak 1524 spectrum 1 weight 0.10000E+01 volume 0.62128E-03 ppm1 3.661 ppm2 7.834 CV 1
OR { 1524}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 99 and name H ))
OR { 1524}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 92 and name H ))
ASSI { 1525}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name H ))
3.100 1.200 1.200 peak 1525 spectrum 1 weight 0.10000E+01 volume 0.12736E-02 ppm1 3.664 ppm2 8.598 CV 1
OR { 1525}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 98 and name H ))
ASSI { 1526}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 97 and name H ))
4.300 2.300 1.700 peak 1526 spectrum 1 weight 0.10000E+01 volume 0.83832E-03 ppm1 2.559 ppm2 8.604 CV 1
OR { 1526}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 97 and name H ))
OR { 1526}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 98 and name H ))
ASSI { 1527}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 96 and name H ))
3.800 1.800 1.800 peak 1527 spectrum 1 weight 0.10000E+01 volume 0.56472E-03 ppm1 2.569 ppm2 7.872 CV 1
OR { 1527}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 99 and name H ))
OR { 1527}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 99 and name H ))
OR { 1527}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 96 and name H ))
ASSI { 1537}
(( segid " " and resid 94 and name HB3 ))
(( segid " " and resid 100 and name HD2 ))
4.200 2.200 1.800 peak 1537 spectrum 1 weight 0.10000E+01 volume 0.32578E-03 ppm1 4.178 ppm2 7.089 CV 1
OR { 1537}
(( segid " " and resid 94 and name HB3 ))
( segid " " and resid 91 and name HD% )
ASSI { 1539}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name H ))
3.700 1.700 1.700 peak 1539 spectrum 1 weight 0.10000E+01 volume 0.82632E-03 ppm1 4.540 ppm2 7.827 CV 1
OR { 1539}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 96 and name H ))
ASSI { 1544}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 94 and name H ))
3.800 1.800 1.800 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.83933E-03 ppm1 4.934 ppm2 7.827 CV 1
OR { 1544}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 92 and name H ))
ASSI { 1545}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name H ))
3.100 1.200 1.200 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.17123E-02 ppm1 4.936 ppm2 7.279 CV 1
OR { 1545}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 27 and name H ))
ASSI { 1546}
(( segid " " and resid 26 and name HB2 ))
( segid " " and resid 27 and name HG1%)
4.500 2.500 1.500 peak 1546 spectrum 1 weight 0.10000E+01 volume 0.71952E-03 ppm1 2.861 ppm2 0.959 CV 1
OR { 1546}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 97 and name HG2%)
ASSI { 1550}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 27 and name HA ))
4.200 2.200 1.800 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.48700E-03 ppm1 2.487 ppm2 3.880 CV 1
OR { 1550}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 25 and name HA ))
ASSI { 1551}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 26 and name HB2 ))
1.900 0.500 0.500 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.11297E-01 ppm1 2.473 ppm2 2.860 CV 1
OR { 1551}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 93 and name HB2 ))
ASSI { 1552}
(( segid " " and resid 26 and name HB3 ))
( segid " " and resid 27 and name HG1%)
4.300 2.300 1.700 peak 1552 spectrum 1 weight 0.10000E+01 volume 0.13780E-02 ppm1 2.482 ppm2 0.980 CV 1
OR { 1552}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 33 and name HG1%)
OR { 1552}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 63 and name HG2%)
OR { 1552}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 63 and name HG1%)
ASSI { 1554}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 92 and name HG3 ))
3.900 1.900 1.900 peak 1554 spectrum 1 weight 0.10000E+01 volume 0.86767E-03 ppm1 2.467 ppm2 1.510 CV 1
OR { 1554}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 92 and name HB2 ))
OR { 1554}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 51 and name HG12))
ASSI { 1556}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 62 and name H ))
3.400 1.500 1.500 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.84277E-03 ppm1 2.470 ppm2 7.831 CV 1
OR { 1556}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 62 and name H ))
OR { 1556}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 94 and name H ))
ASSI { 1560}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 94 and name H ))
4.000 2.000 2.000 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.75791E-03 ppm1 2.835 ppm2 7.837 CV 1
OR { 1560}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 92 and name H ))
ASSI { 1565}
(( segid " " and resid 92 and name HD2 ))
( segid " " and resid 123 and name HD1%)
2.500 2.500 3.500 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.69114E-03 ppm1 2.905 ppm2 0.797 CV 1
OR { 1565}
(( segid " " and resid 92 and name HD2 ))
( segid " " and resid 118 and name HD2%)
ASSI { 1582}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 97 and name HB ))
4.600 2.600 1.400 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.46366E-03 ppm1 1.272 ppm2 2.200 CV 1
OR { 1582}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 89 and name HB3 ))
ASSI { 1587}
(( segid " " and resid 48 and name HG3 ))
( segid " " and resid 51 and name HD1%)
3.900 1.900 1.900 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.13086E-02 ppm1 1.518 ppm2 0.789 CV 1
OR { 1587}
(( segid " " and resid 48 and name HG3 ))
( segid " " and resid 37 and name HD2%)
ASSI { 1590}
(( segid " " and resid 132 and name HG3 ))
(( segid " " and resid 132 and name HD2 ))
1.600 0.300 0.600 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.68783E-01 ppm1 1.506 ppm2 1.715 CV 1
OR { 1590}
(( segid " " and resid 133 and name HG3 ))
(( segid " " and resid 133 and name HD2 ))
OR { 1590}
(( segid " " and resid 133 and name HG2 ))
(( segid " " and resid 133 and name HD3 ))
OR { 1590}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 64 and name HB3 ))
OR { 1590}
(( segid " " and resid 132 and name HG2 ))
(( segid " " and resid 132 and name HD3 ))
OR { 1590}
(( segid " " and resid 132 and name HG2 ))
(( segid " " and resid 132 and name HD2 ))
OR { 1590}
(( segid " " and resid 132 and name HG3 ))
(( segid " " and resid 132 and name HD3 ))
OR { 1590}
(( segid " " and resid 133 and name HG3 ))
(( segid " " and resid 133 and name HD3 ))
OR { 1590}
(( segid " " and resid 133 and name HG2 ))
(( segid " " and resid 133 and name HD2 ))
ASSI { 1596}
(( segid " " and resid 133 and name HG2 ))
(( segid " " and resid 133 and name HA ))
2.600 0.800 0.800 peak 1596 spectrum 1 weight 0.10000E+01 volume 0.50221E-02 ppm1 1.514 ppm2 4.380 CV 1
OR { 1596}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HA ))
OR { 1596}
(( segid " " and resid 133 and name HG3 ))
(( segid " " and resid 133 and name HA ))
OR { 1596}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HA ))
OR { 1596}
(( segid " " and resid 132 and name HG3 ))
(( segid " " and resid 132 and name HA ))
ASSI { 1613}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 88 and name HD% )
5.400 3.600 0.600 peak 1613 spectrum 1 weight 0.10000E+01 volume 0.22860E-03 ppm1 3.600 ppm2 7.054 CV 1
OR { 1613}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 88 and name HZ ))
OR { 1613}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 91 and name HD% )
ASSI { 1615}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name H ))
3.000 1.100 1.100 peak 1615 spectrum 1 weight 0.10000E+01 volume 0.13002E-02 ppm1 3.596 ppm2 7.835 CV 1
OR { 1615}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 94 and name H ))
ASSI { 1619}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 93 and name H ))
4.900 3.000 1.100 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.32184E-03 ppm1 1.524 ppm2 8.371 CV 1
OR { 1619}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 48 and name H ))
ASSI { 1625}
(( segid " " and resid 48 and name HG3 ))
(( segid " " and resid 52 and name HD2 ))
3.100 1.200 1.200 peak 1625 spectrum 1 weight 0.10000E+01 volume 0.13040E-02 ppm1 1.515 ppm2 7.067 CV 1
OR { 1625}
(( segid " " and resid 92 and name HG3 ))
( segid " " and resid 88 and name HD% )
ASSI { 1636}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 66 and name H ))
3.900 1.900 1.900 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.10797E-02 ppm1 7.089 ppm2 7.498 CV 1
OR { 1636}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 55 and name H ))
ASSI { 1638}
(( segid " " and resid 66 and name HB3 ))
( segid " " and resid 33 and name HG1%)
2.800 1.000 1.000 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.20195E-02 ppm1 3.367 ppm2 0.970 CV 1
OR { 1638}
(( segid " " and resid 91 and name HB2 ))
( segid " " and resid 97 and name HG2%)
OR { 1638}
(( segid " " and resid 66 and name HB3 ))
( segid " " and resid 33 and name HG2%)
ASSI { 1644}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 66 and name HZ ))
3.100 1.200 1.200 peak 1644 spectrum 1 weight 0.10000E+01 volume 0.29345E-02 ppm1 7.294 ppm2 6.953 CV 1
OR { 1644}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 67 and name HE22))
ASSI { 1651}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 51 and name HA ))
3.400 1.500 1.500 peak 1651 spectrum 1 weight 0.10000E+01 volume 0.93065E-03 ppm1 7.089 ppm2 2.928 CV 1
OR { 1651}
( segid " " and resid 91 and name HD% )
(( segid " " and resid 104 and name HB3 ))
ASSI { 1652}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 63 and name HA ))
3.100 1.200 1.200 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.12071E-02 ppm1 7.089 ppm2 3.961 CV 1
OR { 1652}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 55 and name HA ))
OR { 1652}
( segid " " and resid 91 and name HD% )
(( segid " " and resid 100 and name HA ))
ASSI { 1654}
( segid " " and resid 91 and name HD% )
(( segid " " and resid 87 and name HB2 ))
4.400 2.400 1.600 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.70165E-03 ppm1 7.086 ppm2 2.210 CV 1
OR { 1654}
( segid " " and resid 91 and name HD% )
(( segid " " and resid 97 and name HB ))
ASSI { 1655}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 55 and name HB ))
4.200 2.200 1.800 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.62843E-03 ppm1 7.081 ppm2 2.001 CV 1
OR { 1655}
( segid " " and resid 91 and name HD% )
(( segid " " and resid 101 and name HB ))
ASSI { 1658}
( segid " " and resid 91 and name HD% )
(( segid " " and resid 90 and name HB3 ))
3.600 1.600 1.600 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.96063E-03 ppm1 7.090 ppm2 1.475 CV 1
OR { 1658}
( segid " " and resid 91 and name HD% )
(( segid " " and resid 87 and name HB3 ))
ASSI { 1659}
( segid " " and resid 91 and name HD% )
(( segid " " and resid 100 and name HB3 ))
2.800 1.000 1.000 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.40375E-02 ppm1 7.090 ppm2 0.949 CV 1
OR { 1659}
( segid " " and resid 66 and name HE% )
( segid " " and resid 33 and name HG2%)
OR { 1659}
( segid " " and resid 66 and name HE% )
( segid " " and resid 33 and name HG1%)
ASSI { 1660}
( segid " " and resid 66 and name HE% )
( segid " " and resid 55 and name HG1%)
2.500 0.800 0.800 peak 1660 spectrum 1 weight 0.10000E+01 volume 0.38036E-02 ppm1 7.091 ppm2 0.786 CV 1
OR { 1660}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 54 and name HB2 ))
ASSI { 1664}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 51 and name HB ))
4.400 2.400 1.600 peak 1664 spectrum 1 weight 0.10000E+01 volume 0.62225E-03 ppm1 7.293 ppm2 1.655 CV 1
OR { 1664}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 64 and name HD3 ))
ASSI { 1668}
( segid " " and resid 66 and name HD% )
( segid " " and resid 51 and name HD1%)
3.300 1.400 1.400 peak 1668 spectrum 1 weight 0.10000E+01 volume 0.35489E-02 ppm1 7.294 ppm2 0.777 CV 1
OR { 1668}
( segid " " and resid 66 and name HD% )
( segid " " and resid 55 and name HG1%)
OR { 1668}
( segid " " and resid 66 and name HD% )
( segid " " and resid 37 and name HD2%)
ASSI { 1672}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 67 and name HG2 ))
3.400 1.400 1.400 peak 1672 spectrum 1 weight 0.10000E+01 volume 0.12572E-02 ppm1 7.293 ppm2 2.402 CV 1
OR { 1672}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 67 and name HG3 ))
OR { 1672}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 65 and name HB3 ))
ASSI { 1673}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 63 and name HB ))
4.200 2.200 1.800 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.80367E-03 ppm1 7.293 ppm2 2.208 CV 1
OR { 1673}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 67 and name HB3 ))
ASSI { 1681}
(( segid " " and resid 66 and name HZ ))
( segid " " and resid 33 and name HG2%)
2.300 2.300 3.700 peak 1681 spectrum 1 weight 0.10000E+01 volume 0.10783E-02 ppm1 6.931 ppm2 0.939 CV 1
OR { 1681}
(( segid " " and resid 66 and name HZ ))
( segid " " and resid 33 and name HG1%)
OR { 1681}
(( segid " " and resid 66 and name HZ ))
( segid " " and resid 50 and name HG2%)
ASSI { 1682}
(( segid " " and resid 66 and name HZ ))
(( segid " " and resid 54 and name HB2 ))
2.800 1.000 1.000 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.13201E-02 ppm1 6.935 ppm2 0.777 CV 1
OR { 1682}
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( segid " " and resid 55 and name HG1%)
ASSI { 1685}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 49 and name HE21))
3.200 1.300 1.300 peak 1685 spectrum 1 weight 0.10000E+01 volume 0.11417E-02 ppm1 1.688 ppm2 7.089 CV 1
OR { 1685}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 45 and name HE ))
OR { 1685}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HE ))
OR { 1685}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 49 and name HE21))
ASSI { 1687}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name H ))
2.800 1.000 1.000 peak 1687 spectrum 1 weight 0.10000E+01 volume 0.25788E-02 ppm1 1.688 ppm2 7.898 CV 1
OR { 1687}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 90 and name H ))
ASSI { 1699}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 45 and name HG2 ))
2.500 0.800 0.800 peak 1699 spectrum 1 weight 0.10000E+01 volume 0.68980E-02 ppm1 1.690 ppm2 1.479 CV 1
OR { 1699}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 90 and name HB3 ))
OR { 1699}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HG2 ))
ASSI { 1703}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 47 and name HD2 ))
3.800 1.800 1.800 peak 1703 spectrum 1 weight 0.10000E+01 volume 0.10290E-02 ppm1 1.687 ppm2 3.221 CV 1
OR { 1703}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 47 and name HD3 ))
OR { 1703}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 52 and name HB2 ))
OR { 1703}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 52 and name HB2 ))
OR { 1703}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 47 and name HD3 ))
ASSI { 1705}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 87 and name HA ))
4.300 2.400 1.700 peak 1705 spectrum 1 weight 0.10000E+01 volume 0.56135E-03 ppm1 1.688 ppm2 4.244 CV 1
OR { 1705}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 49 and name HA ))
OR { 1705}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 49 and name HA ))
ASSI { 1713}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 88 and name HD% )
3.500 1.500 1.500 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.70385E-03 ppm1 3.747 ppm2 7.038 CV 1
OR { 1713}
(( segid " " and resid 90 and name HA ))
( segid " " and resid 91 and name HD% )
ASSI { 1715}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HE21))
4.100 2.100 1.900 peak 1715 spectrum 1 weight 0.10000E+01 volume 0.80003E-03 ppm1 2.208 ppm2 7.047 CV 1
OR { 1715}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HE21))
OR { 1715}
(( segid " " and resid 89 and name HB3 ))
( segid " " and resid 88 and name HD% )
ASSI { 1716}
(( segid " " and resid 19 and name HG2 ))
( segid " " and resid 22 and name HD1%)
3.800 1.800 1.800 peak 1716 spectrum 1 weight 0.10000E+01 volume 0.13528E-02 ppm1 2.511 ppm2 0.937 CV 1
OR { 1716}
(( segid " " and resid 19 and name HG2 ))
( segid " " and resid 40 and name HD1%)
OR { 1716}
(( segid " " and resid 89 and name HG3 ))
( segid " " and resid 114 and name HG2%)
OR { 1716}
(( segid " " and resid 19 and name HG2 ))
( segid " " and resid 22 and name HD2%)
OR { 1716}
(( segid " " and resid 19 and name HG2 ))
( segid " " and resid 36 and name HG2%)
OR { 1716}
(( segid " " and resid 89 and name HG3 ))
( segid " " and resid 98 and name HD1%)
OR { 1716}
(( segid " " and resid 89 and name HG3 ))
( segid " " and resid 130 and name HD2%)
ASSI { 1718}
(( segid " " and resid 89 and name HG3 ))
( segid " " and resid 123 and name HD2%)
4.200 2.200 1.800 peak 1718 spectrum 1 weight 0.10000E+01 volume 0.54903E-03 ppm1 2.517 ppm2 0.634 CV 1
OR { 1718}
(( segid " " and resid 19 and name HG2 ))
( segid " " and resid 20 and name HD2%)
ASSI { 1719}
(( segid " " and resid 89 and name HG2 ))
( segid " " and resid 123 and name HD2%)
2.900 1.100 1.100 peak 1719 spectrum 1 weight 0.10000E+01 volume 0.13919E-02 ppm1 2.382 ppm2 0.643 CV 1
OR { 1719}
(( segid " " and resid 19 and name HG3 ))
( segid " " and resid 20 and name HD2%)
ASSI { 1720}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name HG2 ))
1.500 0.300 0.700 peak 1720 spectrum 1 weight 0.10000E+01 volume 0.27542E-01 ppm1 2.517 ppm2 2.398 CV 1
OR { 1720}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HG3 ))
ASSI { 1721}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB3 ))
2.300 0.700 0.700 peak 1721 spectrum 1 weight 0.10000E+01 volume 0.71117E-02 ppm1 2.511 ppm2 2.197 CV 1
OR { 1721}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name HB3 ))
ASSI { 1723}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 86 and name HG2 ))
4.100 2.100 1.900 peak 1723 spectrum 1 weight 0.10000E+01 volume 0.75216E-03 ppm1 2.519 ppm2 1.798 CV 1
OR { 1723}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 90 and name HB2 ))
ASSI { 1724}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 90 and name HG3 ))
4.100 2.100 1.900 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.79471E-03 ppm1 2.519 ppm2 1.662 CV 1
OR { 1724}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 121 and name HB2 ))
ASSI { 1725}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 47 and name HB2 ))
3.500 1.500 1.500 peak 1725 spectrum 1 weight 0.10000E+01 volume 0.17984E-02 ppm1 2.397 ppm2 1.831 CV 1
OR { 1725}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 37 and name HB3 ))
OR { 1725}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 47 and name HB3 ))
OR { 1725}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 86 and name HG2 ))
ASSI { 1726}
(( segid " " and resid 19 and name HG3 ))
( segid " " and resid 23 and name HB% )
3.400 1.400 1.400 peak 1726 spectrum 1 weight 0.10000E+01 volume 0.18729E-02 ppm1 2.372 ppm2 1.449 CV 1
OR { 1726}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 105 and name HG13))
OR { 1726}
(( segid " " and resid 34 and name HG2 ))
( segid " " and resid 35 and name HB% )
OR { 1726}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 51 and name HG12))
OR { 1726}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 121 and name HB3 ))
OR { 1726}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 90 and name HB3 ))
ASSI { 1727}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 89 and name HG3 ))
1.300 0.200 0.900 peak 1727 spectrum 1 weight 0.10000E+01 volume 0.68622E-01 ppm1 2.371 ppm2 2.468 CV 1
OR { 1727}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name HG2 ))
OR { 1727}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 83 and name HG3 ))
ASSI { 1729}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 88 and name HB3 ))
3.900 1.900 1.900 peak 1729 spectrum 1 weight 0.10000E+01 volume 0.90589E-03 ppm1 2.397 ppm2 3.210 CV 1
OR { 1729}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 86 and name HD3 ))
ASSI { 1734}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HA ))
2.500 0.800 0.800 peak 1734 spectrum 1 weight 0.10000E+01 volume 0.40251E-02 ppm1 2.374 ppm2 4.022 CV 1
OR { 1734}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 80 and name HA ))
OR { 1734}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 83 and name HA ))
ASSI { 1740}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 85 and name HE21))
5.000 3.100 1.000 peak 1740 spectrum 1 weight 0.10000E+01 volume 0.39454E-03 ppm1 2.397 ppm2 6.837 CV 1
OR { 1740}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 124 and name H ))
ASSI { 1743}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 86 and name H ))
4.700 2.800 1.300 peak 1743 spectrum 1 weight 0.10000E+01 volume 0.58437E-03 ppm1 2.396 ppm2 8.362 CV 1
OR { 1743}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 86 and name H ))
OR { 1743}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 18 and name H ))
ASSI { 1744}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 18 and name H ))
4.800 2.900 1.200 peak 1744 spectrum 1 weight 0.10000E+01 volume 0.77015E-03 ppm1 2.377 ppm2 8.316 CV 1
OR { 1744}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 16 and name HE1 ))
ASSI { 1746}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name H ))
3.300 1.300 1.300 peak 1746 spectrum 1 weight 0.10000E+01 volume 0.37846E-02 ppm1 2.373 ppm2 7.984 CV 1
OR { 1746}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 84 and name H ))
OR { 1746}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name H ))
ASSI { 1747}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 88 and name H ))
5.100 3.200 0.900 peak 1747 spectrum 1 weight 0.10000E+01 volume 0.58741E-03 ppm1 2.391 ppm2 8.896 CV 1
OR { 1747}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 31 and name H ))
ASSI { 1748}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 20 and name H ))
3.400 1.500 1.500 peak 1748 spectrum 1 weight 0.10000E+01 volume 0.13825E-02 ppm1 2.372 ppm2 8.664 CV 1
OR { 1748}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 87 and name H ))
ASSI { 1751}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 53 and name H ))
2.500 0.800 0.800 peak 1751 spectrum 1 weight 0.10000E+01 volume 0.32405E-02 ppm1 2.188 ppm2 8.160 CV 1
OR { 1751}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 50 and name H ))
OR { 1751}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 50 and name H ))
OR { 1751}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 89 and name H ))
ASSI { 1752}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 89 and name HA ))
2.700 0.900 0.900 peak 1752 spectrum 1 weight 0.10000E+01 volume 0.22938E-02 ppm1 2.182 ppm2 3.748 CV 1
OR { 1752}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 50 and name HA ))
ASSI { 1760}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 36 and name HG2%)
3.300 1.400 1.400 peak 1760 spectrum 1 weight 0.10000E+01 volume 0.36886E-02 ppm1 2.174 ppm2 0.957 CV 1
OR { 1760}
(( segid " " and resid 89 and name HB3 ))
( segid " " and resid 97 and name HG2%)
OR { 1760}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 33 and name HG2%)
OR { 1760}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 36 and name HD1%)
OR { 1760}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 40 and name HD2%)
OR { 1760}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 36 and name HG2%)
OR { 1760}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 40 and name HD1%)
OR { 1760}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 33 and name HG2%)
OR { 1760}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 33 and name HG2%)
OR { 1760}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 40 and name HD2%)
OR { 1760}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 36 and name HG2%)
OR { 1760}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 59 and name HD2%)
ASSI { 1772}
( segid " " and resid 88 and name HD% )
(( segid " " and resid 88 and name HA ))
3.800 1.800 1.800 peak 1772 spectrum 1 weight 0.10000E+01 volume 0.68208E-03 ppm1 7.039 ppm2 3.942 CV 1
OR { 1772}
( segid " " and resid 88 and name HD% )
(( segid " " and resid 123 and name HA ))
ASSI { 1777}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 92 and name HD2 ))
4.200 2.200 1.800 peak 1777 spectrum 1 weight 0.10000E+01 volume 0.39090E-03 ppm1 7.202 ppm2 2.922 CV 1
OR { 1777}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 88 and name HB2 ))
ASSI { 1783}
( segid " " and resid 88 and name HD% )
( segid " " and resid 97 and name HG2%)
2.600 0.800 0.800 peak 1783 spectrum 1 weight 0.10000E+01 volume 0.34426E-02 ppm1 7.043 ppm2 1.021 CV 1
OR { 1783}
( segid " " and resid 88 and name HD% )
( segid " " and resid 97 and name HG1%)
OR { 1783}
( segid " " and resid 88 and name HD% )
( segid " " and resid 101 and name HD1%)
ASSI { 1784}
( segid " " and resid 88 and name HD% )
( segid " " and resid 118 and name HD2%)
2.700 0.900 0.900 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.18876E-02 ppm1 7.042 ppm2 0.796 CV 1
OR { 1784}
( segid " " and resid 88 and name HD% )
( segid " " and resid 123 and name HD1%)
ASSI { 1785}
( segid " " and resid 88 and name HE% )
( segid " " and resid 97 and name HG1%)
3.000 1.100 1.100 peak 1785 spectrum 1 weight 0.10000E+01 volume 0.20075E-02 ppm1 7.200 ppm2 1.019 CV 1
OR { 1785}
( segid " " and resid 88 and name HE% )
( segid " " and resid 97 and name HG2%)
OR { 1785}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 123 and name HB2 ))
ASSI { 1786}
( segid " " and resid 88 and name HE% )
( segid " " and resid 123 and name HD1%)
3.200 1.300 1.300 peak 1786 spectrum 1 weight 0.10000E+01 volume 0.20289E-02 ppm1 7.206 ppm2 0.800 CV 1
OR { 1786}
( segid " " and resid 88 and name HE% )
( segid " " and resid 118 and name HD2%)
ASSI { 1788}
( segid " " and resid 88 and name HE% )
( segid " " and resid 124 and name HG1%)
4.100 2.100 1.900 peak 1788 spectrum 1 weight 0.10000E+01 volume 0.80689E-03 ppm1 7.205 ppm2 0.514 CV 1
OR { 1788}
( segid " " and resid 88 and name HE% )
( segid " " and resid 118 and name HD1%)
ASSI { 1789}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 92 and name HB2 ))
4.400 2.400 1.600 peak 1789 spectrum 1 weight 0.10000E+01 volume 0.42256E-03 ppm1 7.201 ppm2 1.508 CV 1
OR { 1789}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 118 and name HB3 ))
OR { 1789}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 92 and name HG3 ))
ASSI { 1790}
(( segid " " and resid 88 and name HB3 ))
( segid " " and resid 118 and name HD2%)
3.800 1.800 1.800 peak 1790 spectrum 1 weight 0.10000E+01 volume 0.35066E-03 ppm1 3.184 ppm2 0.780 CV 1
OR { 1790}
(( segid " " and resid 88 and name HB3 ))
( segid " " and resid 123 and name HD1%)
ASSI { 1794}
(( segid " " and resid 88 and name HB2 ))
( segid " " and resid 84 and name HD2%)
4.100 2.100 1.900 peak 1794 spectrum 1 weight 0.10000E+01 volume 0.63719E-03 ppm1 2.964 ppm2 0.640 CV 1
OR { 1794}
(( segid " " and resid 88 and name HB2 ))
( segid " " and resid 123 and name HD2%)
OR { 1794}
(( segid " " and resid 88 and name HB2 ))
(( segid " " and resid 123 and name HB3 ))
ASSI { 1795}
(( segid " " and resid 88 and name HB2 ))
( segid " " and resid 118 and name HD2%)
3.300 1.400 1.400 peak 1795 spectrum 1 weight 0.10000E+01 volume 0.90606E-03 ppm1 2.966 ppm2 0.774 CV 1
OR { 1795}
(( segid " " and resid 88 and name HB2 ))
( segid " " and resid 123 and name HD1%)
ASSI { 1796}
(( segid " " and resid 88 and name HB2 ))
( segid " " and resid 101 and name HD1%)
2.900 1.100 1.100 peak 1796 spectrum 1 weight 0.10000E+01 volume 0.14176E-02 ppm1 2.957 ppm2 0.982 CV 1
OR { 1796}
(( segid " " and resid 88 and name HB2 ))
( segid " " and resid 97 and name HG2%)
ASSI { 1797}
(( segid " " and resid 88 and name HB3 ))
( segid " " and resid 101 and name HD1%)
4.400 2.500 1.600 peak 1797 spectrum 1 weight 0.10000E+01 volume 0.77339E-03 ppm1 3.176 ppm2 1.007 CV 1
OR { 1797}
(( segid " " and resid 88 and name HB3 ))
( segid " " and resid 97 and name HG2%)
OR { 1797}
(( segid " " and resid 88 and name HB3 ))
( segid " " and resid 97 and name HG1%)
ASSI { 1802}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 97 and name HB ))
4.500 2.600 1.500 peak 1802 spectrum 1 weight 0.10000E+01 volume 0.83556E-03 ppm1 3.946 ppm2 2.217 CV 1
OR { 1802}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 1803}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 84 and name HD2%)
4.700 2.800 1.300 peak 1803 spectrum 1 weight 0.10000E+01 volume 0.57420E-03 ppm1 3.938 ppm2 0.635 CV 1
OR { 1803}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 123 and name HD2%)
OR { 1803}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 123 and name HB3 ))
ASSI { 1806}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB3 ))
2.800 1.000 1.000 peak 1806 spectrum 1 weight 0.10000E+01 volume 0.49255E-02 ppm1 3.967 ppm2 1.698 CV 1
OR { 1806}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HG ))
ASSI { 1813}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 36 and name HG2%)
3.200 1.300 1.300 peak 1813 spectrum 1 weight 0.10000E+01 volume 0.16163E-02 ppm1 2.061 ppm2 0.985 CV 1
OR { 1813}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 36 and name HD1%)
OR { 1813}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 32 and name HG2%)
ASSI { 1814}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name HA ))
3.400 1.400 1.400 peak 1814 spectrum 1 weight 0.10000E+01 volume 0.79107E-03 ppm1 2.048 ppm2 3.965 CV 1
OR { 1814}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 21 and name HA ))
ASSI { 1815}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HA ))
3.400 1.500 1.500 peak 1815 spectrum 1 weight 0.10000E+01 volume 0.61107E-03 ppm1 1.142 ppm2 3.963 CV 1
OR { 1815}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 21 and name HA ))
ASSI { 1820}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 19 and name HG3 ))
4.400 2.400 1.600 peak 1820 spectrum 1 weight 0.10000E+01 volume 0.65423E-03 ppm1 2.057 ppm2 2.395 CV 1
OR { 1820}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 32 and name HB ))
ASSI { 1821}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 64 and name H ))
3.500 1.500 1.500 peak 1821 spectrum 1 weight 0.10000E+01 volume 0.17772E-02 ppm1 1.691 ppm2 8.326 CV 1
OR { 1821}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 64 and name H ))
OR { 1821}
(( segid " " and resid 48 and name HD3 ))
(( segid " " and resid 48 and name H ))
OR { 1821}
(( segid " " and resid 48 and name HD2 ))
(( segid " " and resid 48 and name H ))
ASSI { 1827}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 20 and name HB3 ))
2.500 0.800 0.800 peak 1827 spectrum 1 weight 0.10000E+01 volume 0.42458E-02 ppm1 0.668 ppm2 2.058 CV 1
OR { 1827}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 36 and name HG13))
ASSI { 1829}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 23 and name HB% )
2.600 0.800 0.800 peak 1829 spectrum 1 weight 0.10000E+01 volume 0.58389E-02 ppm1 0.668 ppm2 1.433 CV 1
OR { 1829}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 35 and name HB% )
ASSI { 1833}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 19 and name HG3 ))
3.700 1.700 1.700 peak 1833 spectrum 1 weight 0.10000E+01 volume 0.15602E-02 ppm1 0.667 ppm2 2.356 CV 1
OR { 1833}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 32 and name HB ))
ASSI { 1837}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 16 and name HE1 ))
4.700 2.800 1.300 peak 1837 spectrum 1 weight 0.10000E+01 volume 0.62996E-03 ppm1 0.668 ppm2 8.313 CV 1
OR { 1837}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 18 and name H ))
ASSI { 1839}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 19 and name H ))
4.300 2.300 1.700 peak 1839 spectrum 1 weight 0.10000E+01 volume 0.10376E-02 ppm1 0.668 ppm2 7.992 CV 1
OR { 1839}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 33 and name H ))
OR { 1839}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 34 and name H ))
ASSI { 1844}
(( segid " " and resid 82 and name HG ))
(( segid " " and resid 82 and name H ))
3.800 1.800 1.800 peak 1844 spectrum 1 weight 0.10000E+01 volume 0.35141E-02 ppm1 1.808 ppm2 8.137 CV 1
OR { 1844}
(( segid " " and resid 82 and name HG ))
(( segid " " and resid 83 and name H ))
ASSI { 1845}
(( segid " " and resid 111 and name HD3 ))
( segid " " and resid 131 and name HD% )
4.100 2.100 1.900 peak 1845 spectrum 1 weight 0.10000E+01 volume 0.79739E-03 ppm1 3.209 ppm2 7.113 CV 1
OR { 1845}
(( segid " " and resid 127 and name HD2 ))
( segid " " and resid 131 and name HD% )
OR { 1845}
(( segid " " and resid 127 and name HD3 ))
( segid " " and resid 131 and name HD% )
OR { 1845}
(( segid " " and resid 128 and name HD3 ))
( segid " " and resid 131 and name HD% )
ASSI { 1846}
(( segid " " and resid 127 and name HD2 ))
(( segid " " and resid 116 and name H ))
4.600 2.700 1.400 peak 1846 spectrum 1 weight 0.10000E+01 volume 0.35017E-03 ppm1 3.203 ppm2 8.137 CV 1
OR { 1846}
(( segid " " and resid 4 and name HD3 ))
(( segid " " and resid 5 and name H ))
OR { 1846}
(( segid " " and resid 4 and name HD2 ))
(( segid " " and resid 5 and name H ))
OR { 1846}
(( segid " " and resid 5 and name HD3 ))
(( segid " " and resid 5 and name H ))
ASSI { 1849}
(( segid " " and resid 130 and name HG ))
( segid " " and resid 131 and name HD% )
4.300 2.300 1.700 peak 1849 spectrum 1 weight 0.10000E+01 volume 0.63457E-03 ppm1 1.663 ppm2 7.103 CV 1
OR { 1849}
(( segid " " and resid 98 and name HG ))
( segid " " and resid 131 and name HD% )
OR { 1849}
(( segid " " and resid 37 and name HG ))
( segid " " and resid 66 and name HE% )
OR { 1849}
(( segid " " and resid 37 and name HG ))
(( segid " " and resid 45 and name HE ))
OR { 1849}
(( segid " " and resid 98 and name HG ))
(( segid " " and resid 76 and name HZ2 ))
ASSI { 1851}
(( segid " " and resid 37 and name HG ))
(( segid " " and resid 38 and name H ))
3.800 1.800 1.800 peak 1851 spectrum 1 weight 0.10000E+01 volume 0.75093E-03 ppm1 1.667 ppm2 7.585 CV 1
OR { 1851}
(( segid " " and resid 37 and name HG ))
(( segid " " and resid 39 and name H ))
ASSI { 1852}
(( segid " " and resid 98 and name HG ))
(( segid " " and resid 114 and name H ))
3.500 1.500 1.500 peak 1852 spectrum 1 weight 0.10000E+01 volume 0.14737E-02 ppm1 1.666 ppm2 8.116 CV 1
OR { 1852}
(( segid " " and resid 86 and name HG3 ))
(( segid " " and resid 85 and name H ))
ASSI { 1855}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name H ))
3.700 1.700 1.700 peak 1855 spectrum 1 weight 0.10000E+01 volume 0.10563E-02 ppm1 4.140 ppm2 8.019 CV 1
OR { 1855}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 16 and name H ))
ASSI { 1857}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 89 and name H ))
3.400 1.400 1.400 peak 1857 spectrum 1 weight 0.10000E+01 volume 0.11878E-02 ppm1 4.131 ppm2 8.170 CV 1
OR { 1857}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 85 and name H ))
ASSI { 1865}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HG3 ))
3.000 1.200 1.200 peak 1865 spectrum 1 weight 0.10000E+01 volume 0.21383E-02 ppm1 4.133 ppm2 1.669 CV 1
OR { 1865}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 90 and name HG3 ))
ASSI { 1867}
(( segid " " and resid 86 and name HB3 ))
(( segid " " and resid 86 and name HG3 ))
2.300 0.700 0.700 peak 1867 spectrum 1 weight 0.10000E+01 volume 0.68724E-02 ppm1 2.009 ppm2 1.668 CV 1
OR { 1867}
(( segid " " and resid 86 and name HB2 ))
(( segid " " and resid 86 and name HG3 ))
OR { 1867}
(( segid " " and resid 86 and name HB3 ))
(( segid " " and resid 90 and name HG3 ))
ASSI { 1873}
(( segid " " and resid 86 and name HG2 ))
(( segid " " and resid 85 and name HB3 ))
3.400 1.500 1.500 peak 1873 spectrum 1 weight 0.10000E+01 volume 0.31393E-02 ppm1 1.804 ppm2 2.207 CV 1
OR { 1873}
(( segid " " and resid 86 and name HG2 ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 1875}
(( segid " " and resid 82 and name HG ))
(( segid " " and resid 85 and name HG2 ))
4.300 2.300 1.700 peak 1875 spectrum 1 weight 0.10000E+01 volume 0.10422E-02 ppm1 1.812 ppm2 2.480 CV 1
OR { 1875}
(( segid " " and resid 82 and name HG ))
(( segid " " and resid 83 and name HG3 ))
ASSI { 1878}
(( segid " " and resid 98 and name HG ))
( segid " " and resid 98 and name HD1%)
1.800 0.400 0.400 peak 1878 spectrum 1 weight 0.10000E+01 volume 0.21607E-01 ppm1 1.669 ppm2 0.851 CV 1
OR { 1878}
(( segid " " and resid 98 and name HG ))
( segid " " and resid 98 and name HD2%)
OR { 1878}
(( segid " " and resid 37 and name HG ))
( segid " " and resid 37 and name HD1%)
OR { 1878}
(( segid " " and resid 37 and name HG ))
( segid " " and resid 37 and name HD2%)
ASSI { 1879}
(( segid " " and resid 130 and name HG ))
( segid " " and resid 119 and name HD1%)
3.100 1.200 1.200 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.68053E-02 ppm1 1.688 ppm2 0.640 CV 1
OR { 1879}
(( segid " " and resid 98 and name HG ))
( segid " " and resid 84 and name HD2%)
OR { 1879}
(( segid " " and resid 54 and name HG ))
( segid " " and resid 51 and name HG2%)
OR { 1879}
(( segid " " and resid 37 and name HG ))
( segid " " and resid 51 and name HG2%)
ASSI { 1880}
(( segid " " and resid 86 and name HG2 ))
(( segid " " and resid 86 and name HG3 ))
1.400 0.200 0.800 peak 1880 spectrum 1 weight 0.10000E+01 volume 0.41166E-01 ppm1 1.802 ppm2 1.670 CV 1
OR { 1880}
(( segid " " and resid 82 and name HG ))
(( segid " " and resid 82 and name HB3 ))
ASSI { 1889}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name H ))
3.100 1.200 1.200 peak 1889 spectrum 1 weight 0.10000E+01 volume 0.12072E-02 ppm1 2.222 ppm2 7.715 CV 1
OR { 1889}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 46 and name H ))
OR { 1889}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name H ))
ASSI { 1897}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HE22))
3.600 1.600 1.600 peak 1897 spectrum 1 weight 0.10000E+01 volume 0.19470E-02 ppm1 2.310 ppm2 7.230 CV 1
OR { 1897}
(( segid " " and resid 85 and name HG3 ))
( segid " " and resid 88 and name HE% )
ASSI { 1898}
(( segid " " and resid 85 and name HA ))
( segid " " and resid 123 and name HD2%)
3.200 1.300 1.300 peak 1898 spectrum 1 weight 0.10000E+01 volume 0.32422E-02 ppm1 3.846 ppm2 0.637 CV 1
OR { 1898}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 51 and name HG2%)
OR { 1898}
(( segid " " and resid 85 and name HA ))
( segid " " and resid 84 and name HD2%)
ASSI { 1899}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HG2 ))
3.400 1.400 1.400 peak 1899 spectrum 1 weight 0.10000E+01 volume 0.21612E-02 ppm1 3.843 ppm2 2.490 CV 1
OR { 1899}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 89 and name HG3 ))
ASSI { 1901}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 88 and name HB2 ))
4.200 2.200 1.800 peak 1901 spectrum 1 weight 0.10000E+01 volume 0.11882E-02 ppm1 3.855 ppm2 2.985 CV 1
OR { 1901}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 51 and name HA ))
OR { 1901}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HE2 ))
ASSI { 1902}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 52 and name HB2 ))
4.100 2.100 1.900 peak 1902 spectrum 1 weight 0.10000E+01 volume 0.60749E-03 ppm1 3.849 ppm2 3.268 CV 1
OR { 1902}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 86 and name HD2 ))
ASSI { 1903}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name H ))
2.500 0.800 0.800 peak 1903 spectrum 1 weight 0.10000E+01 volume 0.46453E-02 ppm1 3.824 ppm2 8.067 CV 1
OR { 1903}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name H ))
ASSI { 1904}
(( segid " " and resid 85 and name HA ))
( segid " " and resid 88 and name HD% )
4.000 2.000 2.000 peak 1904 spectrum 1 weight 0.10000E+01 volume 0.62643E-03 ppm1 3.853 ppm2 7.056 CV 1
OR { 1904}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 52 and name HD2 ))
ASSI { 1913}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 86 and name HG2 ))
4.100 2.100 1.900 peak 1913 spectrum 1 weight 0.10000E+01 volume 0.74510E-03 ppm1 2.483 ppm2 1.787 CV 1
OR { 1913}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 82 and name HG ))
ASSI { 1914}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 86 and name HG3 ))
3.700 1.700 1.700 peak 1914 spectrum 1 weight 0.10000E+01 volume 0.82281E-03 ppm1 2.479 ppm2 1.691 CV 1
OR { 1914}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 82 and name HB3 ))
ASSI { 1915}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 121 and name HB3 ))
4.700 2.800 1.300 peak 1915 spectrum 1 weight 0.10000E+01 volume 0.63291E-03 ppm1 2.487 ppm2 1.451 CV 1
OR { 1915}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 84 and name HG ))
ASSI { 1916}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 89 and name HB2 ))
3.400 1.400 1.400 peak 1916 spectrum 1 weight 0.10000E+01 volume 0.27154E-02 ppm1 2.315 ppm2 2.023 CV 1
OR { 1916}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 86 and name HB2 ))
OR { 1916}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 86 and name HB3 ))
ASSI { 1918}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 86 and name HG2 ))
4.300 2.300 1.700 peak 1918 spectrum 1 weight 0.10000E+01 volume 0.10779E-02 ppm1 2.309 ppm2 1.814 CV 1
OR { 1918}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 82 and name HG ))
OR { 1918}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 84 and name HB2 ))
ASSI { 1919}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 86 and name HG3 ))
4.300 2.300 1.700 peak 1919 spectrum 1 weight 0.10000E+01 volume 0.82296E-03 ppm1 2.312 ppm2 1.681 CV 1
OR { 1919}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 82 and name HB3 ))
ASSI { 1920}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 121 and name HB3 ))
4.700 2.700 1.300 peak 1920 spectrum 1 weight 0.10000E+01 volume 0.49579E-03 ppm1 2.313 ppm2 1.454 CV 1
OR { 1920}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 84 and name HG ))
ASSI { 1924}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 88 and name HB3 ))
4.900 3.000 1.100 peak 1924 spectrum 1 weight 0.10000E+01 volume 0.50132E-03 ppm1 2.489 ppm2 3.189 CV 1
OR { 1924}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 86 and name HD2 ))
ASSI { 1929}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 86 and name HA ))
4.000 2.000 2.000 peak 1929 spectrum 1 weight 0.10000E+01 volume 0.71449E-03 ppm1 2.306 ppm2 4.135 CV 1
OR { 1929}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 71 and name HB ))
OR { 1929}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 121 and name HA ))
ASSI { 1935}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 86 and name HG2 ))
3.700 1.700 1.700 peak 1935 spectrum 1 weight 0.10000E+01 volume 0.26001E-02 ppm1 2.221 ppm2 1.841 CV 1
OR { 1935}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 82 and name HG ))
ASSI { 1939}
(( segid " " and resid 85 and name HB2 ))
( segid " " and resid 73 and name HD1%)
3.100 1.200 1.200 peak 1939 spectrum 1 weight 0.10000E+01 volume 0.22748E-02 ppm1 2.226 ppm2 0.778 CV 1
OR { 1939}
(( segid " " and resid 85 and name HB2 ))
( segid " " and resid 123 and name HD1%)
OR { 1939}
(( segid " " and resid 85 and name HB3 ))
( segid " " and resid 123 and name HD1%)
ASSI { 1940}
(( segid " " and resid 85 and name HB2 ))
( segid " " and resid 123 and name HD2%)
3.600 1.700 1.700 peak 1940 spectrum 1 weight 0.10000E+01 volume 0.20314E-02 ppm1 2.241 ppm2 0.628 CV 1
OR { 1940}
(( segid " " and resid 85 and name HB3 ))
( segid " " and resid 123 and name HD2%)
OR { 1940}
(( segid " " and resid 85 and name HB2 ))
( segid " " and resid 121 and name HD2%)
OR { 1940}
(( segid " " and resid 85 and name HB2 ))
( segid " " and resid 84 and name HD2%)
OR { 1940}
(( segid " " and resid 85 and name HB3 ))
( segid " " and resid 84 and name HD2%)
OR { 1940}
(( segid " " and resid 85 and name HB3 ))
( segid " " and resid 121 and name HD2%)
ASSI { 1942}
( segid " " and resid 84 and name HD1%)
( segid " " and resid 118 and name HD1%)
2.500 0.800 0.800 peak 1942 spectrum 1 weight 0.10000E+01 volume 0.79194E-02 ppm1 1.088 ppm2 0.537 CV 1
OR { 1942}
( segid " " and resid 115 and name HG1%)
( segid " " and resid 124 and name HG1%)
ASSI { 1945}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 19 and name H ))
4.700 2.700 1.300 peak 1945 spectrum 1 weight 0.10000E+01 volume 0.74112E-03 ppm1 1.069 ppm2 7.983 CV 1
OR { 1945}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 16 and name H ))
OR { 1945}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 43 and name H ))
OR { 1945}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 33 and name H ))
ASSI { 1946}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 74 and name H ))
3.900 1.900 1.900 peak 1946 spectrum 1 weight 0.10000E+01 volume 0.12859E-02 ppm1 1.094 ppm2 8.383 CV 1
OR { 1946}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 118 and name H ))
OR { 1946}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 86 and name H ))
OR { 1946}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 118 and name H ))
ASSI { 1947}
(( segid " " and resid 118 and name HB2 ))
( segid " " and resid 118 and name HD1%)
3.300 1.400 1.400 peak 1947 spectrum 1 weight 0.10000E+01 volume 0.12114E-02 ppm1 2.031 ppm2 0.515 CV 1
OR { 1947}
(( segid " " and resid 118 and name HB2 ))
( segid " " and resid 124 and name HG1%)
ASSI { 1948}
(( segid " " and resid 84 and name HB3 ))
( segid " " and resid 84 and name HD2%)
3.300 1.400 1.400 peak 1948 spectrum 1 weight 0.10000E+01 volume 0.14953E-02 ppm1 2.038 ppm2 0.607 CV 1
OR { 1948}
(( segid " " and resid 118 and name HB2 ))
( segid " " and resid 119 and name HD1%)
OR { 1948}
(( segid " " and resid 118 and name HB2 ))
(( segid " " and resid 123 and name HB3 ))
ASSI { 1949}
(( segid " " and resid 118 and name HB2 ))
( segid " " and resid 130 and name HD1%)
3.500 1.500 1.500 peak 1949 spectrum 1 weight 0.10000E+01 volume 0.20609E-02 ppm1 2.034 ppm2 0.980 CV 1
OR { 1949}
(( segid " " and resid 118 and name HB2 ))
( segid " " and resid 114 and name HG2%)
OR { 1949}
(( segid " " and resid 84 and name HB3 ))
( segid " " and resid 114 and name HG2%)
OR { 1949}
(( segid " " and resid 118 and name HB2 ))
( segid " " and resid 115 and name HG2%)
OR { 1949}
(( segid " " and resid 84 and name HB3 ))
( segid " " and resid 114 and name HD1%)
OR { 1949}
(( segid " " and resid 84 and name HB3 ))
( segid " " and resid 101 and name HG2%)
ASSI { 1954}
(( segid " " and resid 84 and name HB3 ))
(( segid " " and resid 84 and name HA ))
4.300 2.300 1.700 peak 1954 spectrum 1 weight 0.10000E+01 volume 0.31195E-03 ppm1 2.037 ppm2 4.138 CV 1
OR { 1954}
(( segid " " and resid 118 and name HB2 ))
(( segid " " and resid 119 and name HA ))
ASSI { 1955}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 14 and name HA ))
2.600 0.800 0.800 peak 1955 spectrum 1 weight 0.10000E+01 volume 0.21071E-02 ppm1 1.787 ppm2 3.974 CV 1
OR { 1955}
(( segid " " and resid 98 and name HB3 ))
(( segid " " and resid 98 and name HA ))
OR { 1955}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HA ))
ASSI { 1956}
(( segid " " and resid 84 and name HB3 ))
(( segid " " and resid 81 and name HA ))
4.200 2.200 1.800 peak 1956 spectrum 1 weight 0.10000E+01 volume 0.31721E-03 ppm1 2.041 ppm2 3.963 CV 1
OR { 1956}
(( segid " " and resid 118 and name HB2 ))
(( segid " " and resid 117 and name HA ))
OR { 1956}
(( segid " " and resid 84 and name HB3 ))
(( segid " " and resid 80 and name HA ))
OR { 1956}
(( segid " " and resid 118 and name HB2 ))
(( segid " " and resid 123 and name HA ))
ASSI { 1958}
(( segid " " and resid 84 and name HB3 ))
(( segid " " and resid 85 and name H ))
3.200 1.300 1.300 peak 1958 spectrum 1 weight 0.10000E+01 volume 0.67011E-03 ppm1 2.028 ppm2 8.121 CV 1
OR { 1958}
(( segid " " and resid 84 and name HB3 ))
(( segid " " and resid 83 and name H ))
ASSI { 1959}
(( segid " " and resid 84 and name HB2 ))
(( segid " " and resid 84 and name H ))
3.500 1.600 1.600 peak 1959 spectrum 1 weight 0.10000E+01 volume 0.72880E-03 ppm1 1.788 ppm2 8.014 CV 1
OR { 1959}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 16 and name H ))
ASSI { 1960}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 18 and name H ))
4.100 2.100 1.900 peak 1960 spectrum 1 weight 0.10000E+01 volume 0.75467E-03 ppm1 1.783 ppm2 8.301 CV 1
OR { 1960}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 15 and name H ))
ASSI { 1961}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 76 and name HZ3 ))
4.600 2.600 1.400 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.53568E-03 ppm1 4.136 ppm2 7.081 CV 1
OR { 1961}
(( segid " " and resid 129 and name HA ))
( segid " " and resid 131 and name HD% )
OR { 1961}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 66 and name HE% )
OR { 1961}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 76 and name HZ2 ))
ASSI { 1962}
(( segid " " and resid 83 and name HA ))
( segid " " and resid 82 and name HD1%)
2.500 0.800 0.800 peak 1962 spectrum 1 weight 0.10000E+01 volume 0.80044E-02 ppm1 4.023 ppm2 0.949 CV 1
OR { 1962}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 22 and name HD1%)
OR { 1962}
(( segid " " and resid 83 and name HA ))
( segid " " and resid 82 and name HD2%)
ASSI { 1963}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 76 and name HE1 ))
4.400 2.400 1.600 peak 1963 spectrum 1 weight 0.10000E+01 volume 0.71197E-03 ppm1 4.044 ppm2 0.640 CV 1
OR { 1963}
(( segid " " and resid 102 and name HA ))
( segid " " and resid 84 and name HD2%)
OR { 1963}
(( segid " " and resid 80 and name HA ))
( segid " " and resid 84 and name HD2%)
ASSI { 1964}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 57 and name HE% )
3.200 1.300 1.300 peak 1964 spectrum 1 weight 0.10000E+01 volume 0.49433E-02 ppm1 4.024 ppm2 2.010 CV 1
OR { 1964}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HB3 ))
OR { 1964}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 55 and name HB ))
OR { 1964}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 57 and name HE% )
ASSI { 1966}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 56 and name HB2 ))
2.100 0.600 0.600 peak 1966 spectrum 1 weight 0.10000E+01 volume 0.52027E-02 ppm1 4.018 ppm2 1.710 CV 1
OR { 1966}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 18 and name HG3 ))
ASSI { 1967}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HG2 ))
2.500 0.800 0.800 peak 1967 spectrum 1 weight 0.10000E+01 volume 0.36724E-02 ppm1 4.026 ppm2 2.462 CV 1
OR { 1967}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HG3 ))
OR { 1967}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HG2 ))
ASSI { 1969}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name H ))
2.500 0.800 0.800 peak 1969 spectrum 1 weight 0.10000E+01 volume 0.48191E-02 ppm1 4.023 ppm2 8.102 CV 1
OR { 1969}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name H ))
OR { 1969}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 56 and name H ))
ASSI { 1970}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name H ))
3.200 1.300 1.300 peak 1970 spectrum 1 weight 0.10000E+01 volume 0.15588E-02 ppm1 4.018 ppm2 7.859 CV 1
OR { 1970}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 57 and name H ))
OR { 1970}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 23 and name H ))
ASSI { 1971}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name H ))
2.500 0.800 0.800 peak 1971 spectrum 1 weight 0.10000E+01 volume 0.41249E-02 ppm1 4.021 ppm2 7.990 CV 1
OR { 1971}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name H ))
OR { 1971}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 84 and name H ))
ASSI { 1972}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name H ))
3.300 1.300 1.300 peak 1972 spectrum 1 weight 0.10000E+01 volume 0.14729E-02 ppm1 4.027 ppm2 8.666 CV 1
OR { 1972}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 87 and name H ))
ASSI { 1976}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 37 and name HB3 ))
4.500 2.500 1.500 peak 1976 spectrum 1 weight 0.10000E+01 volume 0.93887E-03 ppm1 2.373 ppm2 1.857 CV 1
OR { 1976}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 47 and name HB2 ))
OR { 1976}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 82 and name HG ))
OR { 1976}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 47 and name HB3 ))
ASSI { 1981}
(( segid " " and resid 19 and name HG2 ))
( segid " " and resid 23 and name HB% )
3.800 1.800 1.800 peak 1981 spectrum 1 weight 0.10000E+01 volume 0.16647E-02 ppm1 2.461 ppm2 1.440 CV 1
OR { 1981}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 105 and name HG13))
OR { 1981}
(( segid " " and resid 34 and name HG2 ))
( segid " " and resid 35 and name HB% )
ASSI { 1983}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 37 and name HG ))
3.700 1.700 1.700 peak 1983 spectrum 1 weight 0.10000E+01 volume 0.16039E-02 ppm1 2.463 ppm2 1.655 CV 1
OR { 1983}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 18 and name HG2 ))
OR { 1983}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 82 and name HB3 ))
OR { 1983}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 86 and name HG3 ))
ASSI { 1984}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 47 and name HG2 ))
3.700 1.700 1.700 peak 1984 spectrum 1 weight 0.10000E+01 volume 0.20905E-02 ppm1 2.463 ppm2 1.595 CV 1
OR { 1984}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 18 and name HG2 ))
OR { 1984}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 37 and name HB2 ))
OR { 1984}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 105 and name HG12))
ASSI { 1985}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 47 and name HG2 ))
3.800 1.800 1.800 peak 1985 spectrum 1 weight 0.10000E+01 volume 0.21741E-02 ppm1 2.379 ppm2 1.582 CV 1
OR { 1985}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 18 and name HG2 ))
OR { 1985}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 37 and name HB2 ))
OR { 1985}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 105 and name HG12))
OR { 1985}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 121 and name HB2 ))
OR { 1985}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 118 and name HB3 ))
ASSI { 1987}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HA ))
2.500 0.800 0.800 peak 1987 spectrum 1 weight 0.10000E+01 volume 0.43461E-02 ppm1 2.464 ppm2 4.022 CV 1
OR { 1987}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 83 and name HA ))
OR { 1987}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 80 and name HA ))
ASSI { 1988}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name H ))
3.200 1.200 1.200 peak 1988 spectrum 1 weight 0.10000E+01 volume 0.43717E-02 ppm1 2.465 ppm2 7.986 CV 1
OR { 1988}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name H ))
OR { 1988}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 84 and name H ))
ASSI { 1990}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 18 and name H ))
5.100 3.300 0.900 peak 1990 spectrum 1 weight 0.10000E+01 volume 0.53926E-03 ppm1 2.463 ppm2 8.318 CV 1
OR { 1990}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 16 and name HE1 ))
ASSI { 1992}
(( segid " " and resid 82 and name HB3 ))
(( segid " " and resid 82 and name H ))
2.600 0.900 0.900 peak 1992 spectrum 1 weight 0.10000E+01 volume 0.27575E-02 ppm1 1.695 ppm2 8.135 CV 1
OR { 1992}
(( segid " " and resid 82 and name HB3 ))
(( segid " " and resid 83 and name H ))
ASSI { 1993}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name H ))
2.800 1.000 1.000 peak 1993 spectrum 1 weight 0.10000E+01 volume 0.28006E-02 ppm1 4.217 ppm2 8.134 CV 1
OR { 1993}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 85 and name H ))
OR { 1993}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 83 and name H ))
ASSI { 1995}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 82 and name H ))
2.800 1.000 1.000 peak 1995 spectrum 1 weight 0.10000E+01 volume 0.28255E-02 ppm1 1.917 ppm2 8.134 CV 1
OR { 1995}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 83 and name H ))
ASSI { 1996}
(( segid " " and resid 130 and name HB3 ))
(( segid " " and resid 98 and name H ))
3.900 1.900 1.900 peak 1996 spectrum 1 weight 0.10000E+01 volume 0.49807E-03 ppm1 1.691 ppm2 8.615 CV 1
OR { 1996}
(( segid " " and resid 82 and name HB3 ))
(( segid " " and resid 81 and name H ))
ASSI { 1998}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 42 and name H ))
2.900 1.000 1.000 peak 1998 spectrum 1 weight 0.10000E+01 volume 0.47624E-02 ppm1 0.979 ppm2 8.135 CV 1
OR { 1998}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 83 and name H ))
OR { 1998}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 82 and name H ))
ASSI { 1999}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 75 and name H ))
4.000 2.000 2.000 peak 1999 spectrum 1 weight 0.10000E+01 volume 0.12072E-02 ppm1 0.979 ppm2 8.363 CV 1
OR { 1999}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 86 and name H ))
OR { 1999}
( segid " " and resid 138 and name HD2%)
(( segid " " and resid 139 and name H ))
ASSI { 2000}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 87 and name H ))
3.800 1.800 1.800 peak 2000 spectrum 1 weight 0.10000E+01 volume 0.10607E-02 ppm1 0.971 ppm2 8.655 CV 1
OR { 2000}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 81 and name H ))
ASSI { 2004}
( segid " " and resid 138 and name HD2%)
(( segid " " and resid 138 and name HG ))
2.100 0.500 0.500 peak 2004 spectrum 1 weight 0.10000E+01 volume 0.12942E-01 ppm1 0.978 ppm2 1.694 CV 1
OR { 2004}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 75 and name HB3 ))
OR { 2004}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 86 and name HG3 ))
OR { 2004}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 82 and name HB3 ))
ASSI { 2005}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 86 and name HG2 ))
2.000 0.500 0.500 peak 2005 spectrum 1 weight 0.10000E+01 volume 0.18753E-01 ppm1 0.978 ppm2 1.813 CV 1
OR { 2005}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 82 and name HG ))
ASSI { 2006}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 85 and name HB3 ))
3.100 1.200 1.200 peak 2006 spectrum 1 weight 0.10000E+01 volume 0.47544E-02 ppm1 0.977 ppm2 2.245 CV 1
OR { 2006}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 17 and name HB3 ))
OR { 2006}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 83 and name HB3 ))
OR { 2006}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 85 and name HB2 ))
ASSI { 2007}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 79 and name HB3 ))
2.700 2.700 3.300 peak 2007 spectrum 1 weight 0.10000E+01 volume 0.10796E-02 ppm1 0.978 ppm2 2.709 CV 1
OR { 2007}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 80 and name HG2 ))
ASSI { 2008}
(( segid " " and resid 130 and name HB3 ))
( segid " " and resid 130 and name HD1%)
2.100 0.600 0.600 peak 2008 spectrum 1 weight 0.10000E+01 volume 0.12513E-01 ppm1 1.690 ppm2 0.959 CV 1
OR { 2008}
(( segid " " and resid 82 and name HB3 ))
( segid " " and resid 82 and name HD2%)
OR { 2008}
(( segid " " and resid 130 and name HB3 ))
( segid " " and resid 130 and name HD2%)
OR { 2008}
(( segid " " and resid 82 and name HB3 ))
( segid " " and resid 82 and name HD1%)
ASSI { 2011}
(( segid " " and resid 54 and name HB3 ))
( segid " " and resid 60 and name HB% )
2.900 1.100 1.100 peak 2011 spectrum 1 weight 0.10000E+01 volume 0.11817E-02 ppm1 1.925 ppm2 1.245 CV 1
OR { 2011}
(( segid " " and resid 54 and name HB3 ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 2013}
(( segid " " and resid 54 and name HB3 ))
( segid " " and resid 59 and name HD1%)
3.500 1.500 1.500 peak 2013 spectrum 1 weight 0.10000E+01 volume 0.27792E-02 ppm1 1.930 ppm2 0.802 CV 1
OR { 2013}
(( segid " " and resid 54 and name HB3 ))
( segid " " and resid 55 and name HG1%)
OR { 2013}
(( segid " " and resid 54 and name HB3 ))
( segid " " and resid 55 and name HG2%)
ASSI { 2018}
(( segid " " and resid 54 and name HB3 ))
(( segid " " and resid 60 and name H ))
4.200 2.200 1.800 peak 2018 spectrum 1 weight 0.10000E+01 volume 0.30816E-03 ppm1 1.933 ppm2 7.071 CV 1
OR { 2018}
(( segid " " and resid 54 and name HB3 ))
( segid " " and resid 66 and name HE% )
ASSI { 2026}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 82 and name HG ))
3.900 1.900 1.900 peak 2026 spectrum 1 weight 0.10000E+01 volume 0.14214E-02 ppm1 4.537 ppm2 1.816 CV 1
OR { 2026}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 64 and name HB2 ))
OR { 2026}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 81 and name HB2 ))
ASSI { 2027}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 82 and name HB3 ))
3.100 1.200 1.200 peak 2027 spectrum 1 weight 0.10000E+01 volume 0.13499E-02 ppm1 4.541 ppm2 1.702 CV 1
OR { 2027}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 64 and name HB3 ))
ASSI { 2031}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 82 and name H ))
3.800 1.800 1.800 peak 2031 spectrum 1 weight 0.10000E+01 volume 0.66578E-03 ppm1 4.538 ppm2 8.141 CV 1
OR { 2031}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 83 and name H ))
ASSI { 2032}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 76 and name H ))
4.100 2.100 1.900 peak 2032 spectrum 1 weight 0.10000E+01 volume 0.52823E-03 ppm1 7.360 ppm2 8.655 CV 1
OR { 2032}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 77 and name H ))
ASSI { 2035}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HE1 ))
4.400 2.500 1.600 peak 2035 spectrum 1 weight 0.10000E+01 volume 0.63692E-03 ppm1 3.152 ppm2 0.671 CV 1
OR { 2035}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 51 and name HG2%)
ASSI { 2040}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 63 and name H ))
4.800 2.900 1.200 peak 2040 spectrum 1 weight 0.10000E+01 volume 0.20524E-03 ppm1 7.087 ppm2 8.644 CV 1
OR { 2040}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 61 and name H ))
ASSI { 2045}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 73 and name H ))
4.500 2.600 1.500 peak 2045 spectrum 1 weight 0.10000E+01 volume 0.10932E-02 ppm1 3.065 ppm2 8.165 CV 1
OR { 2045}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 120 and name H ))
ASSI { 2047}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 74 and name HG2%)
3.400 1.400 1.400 peak 2047 spectrum 1 weight 0.10000E+01 volume 0.15784E-02 ppm1 3.148 ppm2 0.927 CV 1
OR { 2047}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 50 and name HG2%)
OR { 2047}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 63 and name HG2%)
OR { 2047}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 63 and name HG1%)
OR { 2047}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 114 and name HD1%)
OR { 2047}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 33 and name HG2%)
ASSI { 2048}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 55 and name HG2%)
3.600 1.700 1.700 peak 2048 spectrum 1 weight 0.10000E+01 volume 0.14365E-02 ppm1 3.150 ppm2 0.823 CV 1
OR { 2048}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 74 and name HG1%)
OR { 2048}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 73 and name HG2%)
OR { 2048}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 73 and name HD1%)
OR { 2048}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 55 and name HG1%)
ASSI { 2049}
(( segid " " and resid 76 and name HB3 ))
( segid " " and resid 74 and name HG1%)
3.500 1.500 1.500 peak 2049 spectrum 1 weight 0.10000E+01 volume 0.12311E-02 ppm1 3.060 ppm2 0.910 CV 1
OR { 2049}
(( segid " " and resid 76 and name HB3 ))
( segid " " and resid 74 and name HG2%)
OR { 2049}
(( segid " " and resid 72 and name HB2 ))
( segid " " and resid 74 and name HG1%)
ASSI { 2051}
(( segid " " and resid 76 and name HZ2 ))
( segid " " and resid 105 and name HD1%)
3.900 1.900 1.900 peak 2051 spectrum 1 weight 0.10000E+01 volume 0.59728E-03 ppm1 7.105 ppm2 1.059 CV 1
OR { 2051}
(( segid " " and resid 76 and name HZ2 ))
( segid " " and resid 84 and name HD1%)
ASSI { 2052}
(( segid " " and resid 76 and name HZ2 ))
( segid " " and resid 74 and name HG2%)
3.600 1.600 1.600 peak 2052 spectrum 1 weight 0.10000E+01 volume 0.11090E-02 ppm1 7.107 ppm2 0.951 CV 1
OR { 2052}
(( segid " " and resid 76 and name HZ2 ))
( segid " " and resid 114 and name HD1%)
OR { 2052}
(( segid " " and resid 76 and name HZ2 ))
( segid " " and resid 114 and name HG2%)
ASSI { 2053}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 107 and name HB% )
4.500 2.500 1.500 peak 2053 spectrum 1 weight 0.10000E+01 volume 0.45178E-03 ppm1 3.136 ppm2 1.162 CV 1
OR { 2053}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 73 and name HG12))
OR { 2053}
(( segid " " and resid 72 and name HB3 ))
( segid " " and resid 71 and name HG2%)
ASSI { 2054}
(( segid " " and resid 76 and name HB3 ))
( segid " " and resid 107 and name HB% )
4.300 2.300 1.700 peak 2054 spectrum 1 weight 0.10000E+01 volume 0.54233E-03 ppm1 3.059 ppm2 1.148 CV 1
OR { 2054}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 73 and name HG12))
OR { 2054}
(( segid " " and resid 72 and name HB2 ))
( segid " " and resid 71 and name HG2%)
ASSI { 2055}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 56 and name HB2 ))
4.000 2.000 2.000 peak 2055 spectrum 1 weight 0.10000E+01 volume 0.90998E-03 ppm1 3.151 ppm2 1.704 CV 1
OR { 2055}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 54 and name HG ))
OR { 2055}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 119 and name HB2 ))
ASSI { 2056}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 48 and name HG3 ))
4.300 2.300 1.700 peak 2056 spectrum 1 weight 0.10000E+01 volume 0.54810E-03 ppm1 3.151 ppm2 1.525 CV 1
OR { 2056}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 121 and name HG ))
OR { 2056}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 117 and name HB3 ))
OR { 2056}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 51 and name HG12))
OR { 2056}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 119 and name HB3 ))
ASSI { 2057}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 48 and name HG2 ))
4.300 2.400 1.700 peak 2057 spectrum 1 weight 0.10000E+01 volume 0.57848E-03 ppm1 3.151 ppm2 1.369 CV 1
OR { 2057}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 73 and name HG13))
OR { 2057}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 117 and name HB2 ))
OR { 2057}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 73 and name HG13))
ASSI { 2058}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 56 and name HG2 ))
4.700 2.800 1.300 peak 2058 spectrum 1 weight 0.10000E+01 volume 0.67222E-03 ppm1 3.149 ppm2 2.217 CV 1
OR { 2058}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 53 and name HB2 ))
ASSI { 2060}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 81 and name HB3 ))
4.000 2.000 2.000 peak 2060 spectrum 1 weight 0.10000E+01 volume 0.65119E-03 ppm1 3.153 ppm2 1.993 CV 1
OR { 2060}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 84 and name HB3 ))
OR { 2060}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 55 and name HB ))
OR { 2060}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 74 and name HB ))
ASSI { 2061}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 121 and name HG ))
4.800 2.800 1.200 peak 2061 spectrum 1 weight 0.10000E+01 volume 0.45513E-03 ppm1 3.048 ppm2 1.546 CV 1
OR { 2061}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 117 and name HB3 ))
OR { 2061}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 105 and name HG12))
ASSI { 2063}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 117 and name HB2 ))
5.000 3.200 1.000 peak 2063 spectrum 1 weight 0.10000E+01 volume 0.41524E-03 ppm1 3.056 ppm2 1.373 CV 1
OR { 2063}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 73 and name HG13))
OR { 2063}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 73 and name HG13))
ASSI { 2064}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 83 and name HB3 ))
5.600 4.000 0.400 peak 2064 spectrum 1 weight 0.10000E+01 volume 0.17921E-03 ppm1 3.061 ppm2 2.247 CV 1
OR { 2064}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 85 and name HB2 ))
OR { 2064}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 85 and name HB2 ))
OR { 2064}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 87 and name HB2 ))
OR { 2064}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 85 and name HB3 ))
ASSI { 2065}
(( segid " " and resid 76 and name HD1 ))
( segid " " and resid 107 and name HB% )
5.400 3.600 0.600 peak 2065 spectrum 1 weight 0.10000E+01 volume 0.15149E-03 ppm1 7.351 ppm2 1.169 CV 1
OR { 2065}
(( segid " " and resid 76 and name HD1 ))
( segid " " and resid 77 and name HG2%)
ASSI { 2066}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 73 and name HB ))
4.800 2.800 1.200 peak 2066 spectrum 1 weight 0.10000E+01 volume 0.26483E-03 ppm1 7.358 ppm2 1.808 CV 1
OR { 2066}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 81 and name HB2 ))
OR { 2066}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 109 and name HB2 ))
OR { 2066}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 84 and name HB2 ))
ASSI { 2067}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 75 and name HB2 ))
2.900 2.900 3.100 peak 2067 spectrum 1 weight 0.10000E+01 volume 0.82704E-03 ppm1 7.359 ppm2 1.576 CV 1
OR { 2067}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 75 and name HG ))
OR { 2067}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 105 and name HG12))
OR { 2067}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 117 and name HB3 ))
ASSI { 2068}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 74 and name HB ))
5.300 3.500 0.700 peak 2068 spectrum 1 weight 0.10000E+01 volume 0.17210E-03 ppm1 7.350 ppm2 2.023 CV 1
OR { 2068}
(( segid " " and resid 76 and name HD1 ))
(( segid " " and resid 84 and name HB3 ))
ASSI { 2070}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 105 and name HG12))
4.600 2.600 1.400 peak 2070 spectrum 1 weight 0.10000E+01 volume 0.40925E-03 ppm1 7.110 ppm2 1.579 CV 1
OR { 2070}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 117 and name HB3 ))
ASSI { 2071}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 109 and name HB3 ))
4.000 2.000 2.000 peak 2071 spectrum 1 weight 0.10000E+01 volume 0.55574E-03 ppm1 7.105 ppm2 1.458 CV 1
OR { 2071}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 109 and name HG3 ))
OR { 2071}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 84 and name HG ))
ASSI { 2076}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 114 and name HB ))
5.400 3.600 0.600 peak 2076 spectrum 1 weight 0.10000E+01 volume 0.23074E-03 ppm1 7.106 ppm2 2.238 CV 1
OR { 2076}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 113 and name HB3 ))
OR { 2076}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 113 and name HB2 ))
OR { 2076}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 87 and name HB2 ))
ASSI { 2082}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 111 and name HA ))
5.400 3.700 0.600 peak 2082 spectrum 1 weight 0.10000E+01 volume 0.20180E-03 ppm1 7.105 ppm2 4.002 CV 1
OR { 2082}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 80 and name HA ))
OR { 2082}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 102 and name HA ))
OR { 2082}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 110 and name HB3 ))
OR { 2082}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 117 and name HA ))
ASSI { 2084}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 50 and name HA ))
5.300 3.500 0.700 peak 2084 spectrum 1 weight 0.10000E+01 volume 0.31811E-03 ppm1 3.149 ppm2 3.791 CV 1
OR { 2084}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 56 and name HA ))
ASSI { 2086}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 49 and name HA ))
4.200 2.200 1.800 peak 2086 spectrum 1 weight 0.10000E+01 volume 0.10340E-02 ppm1 3.149 ppm2 4.195 CV 1
OR { 2086}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 121 and name HA ))
ASSI { 2087}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 52 and name HA ))
2.800 1.000 1.000 peak 2087 spectrum 1 weight 0.10000E+01 volume 0.27809E-02 ppm1 3.150 ppm2 4.021 CV 1
OR { 2087}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 53 and name HA ))
OR { 2087}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 120 and name HA ))
ASSI { 2088}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 117 and name HA ))
5.100 3.200 0.900 peak 2088 spectrum 1 weight 0.10000E+01 volume 0.24832E-03 ppm1 3.058 ppm2 4.002 CV 1
OR { 2088}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 80 and name HA ))
OR { 2088}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 78 and name HA2 ))
ASSI { 2089}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 73 and name HA ))
5.100 3.200 0.900 peak 2089 spectrum 1 weight 0.10000E+01 volume 0.41473E-03 ppm1 3.063 ppm2 4.152 CV 1
OR { 2089}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 121 and name HA ))
OR { 2089}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 71 and name HB ))
ASSI { 2091}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 72 and name HD2 ))
3.000 1.100 1.100 peak 2091 spectrum 1 weight 0.10000E+01 volume 0.18160E-02 ppm1 3.146 ppm2 7.017 CV 1
OR { 2091}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HZ3 ))
ASSI { 2092}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HD2 ))
3.800 1.800 1.800 peak 2092 spectrum 1 weight 0.10000E+01 volume 0.13012E-02 ppm1 3.062 ppm2 7.005 CV 1
OR { 2092}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 76 and name HZ3 ))
ASSI { 2094}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 80 and name HE21))
5.000 3.100 1.000 peak 2094 spectrum 1 weight 0.10000E+01 volume 0.17941E-03 ppm1 3.152 ppm2 7.481 CV 1
OR { 2094}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 55 and name H ))
ASSI { 2095}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 52 and name H ))
3.300 1.300 1.300 peak 2095 spectrum 1 weight 0.10000E+01 volume 0.41735E-02 ppm1 3.150 ppm2 8.209 CV 1
OR { 2095}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 73 and name H ))
ASSI { 2096}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name H ))
4.900 3.000 1.100 peak 2096 spectrum 1 weight 0.10000E+01 volume 0.10982E-03 ppm1 3.147 ppm2 8.640 CV 1
OR { 2096}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 77 and name H ))
ASSI { 2097}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 77 and name H ))
4.400 2.400 1.600 peak 2097 spectrum 1 weight 0.10000E+01 volume 0.24068E-03 ppm1 3.074 ppm2 8.646 CV 1
OR { 2097}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 76 and name H ))
ASSI { 2098}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 74 and name H ))
5.200 3.400 0.800 peak 2098 spectrum 1 weight 0.10000E+01 volume 0.14287E-03 ppm1 3.062 ppm2 8.379 CV 1
OR { 2098}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 74 and name H ))
OR { 2098}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 118 and name H ))
ASSI { 2099}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 77 and name H ))
3.200 1.300 1.300 peak 2099 spectrum 1 weight 0.10000E+01 volume 0.88656E-03 ppm1 4.945 ppm2 8.658 CV 1
OR { 2099}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name H ))
ASSI { 2102}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name H ))
2.900 1.000 1.000 peak 2102 spectrum 1 weight 0.10000E+01 volume 0.15631E-02 ppm1 4.455 ppm2 8.398 CV 1
OR { 2102}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name H ))
ASSI { 2108}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 45 and name HD3 ))
3.200 1.300 1.300 peak 2108 spectrum 1 weight 0.10000E+01 volume 0.16807E-02 ppm1 0.944 ppm2 2.830 CV 1
OR { 2108}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 41 and name HB2 ))
OR { 2108}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 41 and name HB3 ))
ASSI { 2109}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 25 and name HE3 ))
3.900 1.900 1.900 peak 2109 spectrum 1 weight 0.10000E+01 volume 0.22748E-02 ppm1 0.944 ppm2 3.021 CV 1
OR { 2109}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 21 and name HB2 ))
OR { 2109}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 21 and name HB3 ))
ASSI { 2112}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 39 and name HB3 ))
4.100 2.100 1.900 peak 2112 spectrum 1 weight 0.10000E+01 volume 0.10656E-02 ppm1 4.463 ppm2 2.822 CV 1
OR { 2112}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HB2 ))
OR { 2112}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HB3 ))
ASSI { 2115}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HB3 ))
2.500 0.800 0.800 peak 2115 spectrum 1 weight 0.10000E+01 volume 0.63749E-02 ppm1 4.455 ppm2 1.558 CV 1
OR { 2115}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HB2 ))
ASSI { 2117}
(( segid " " and resid 75 and name HA ))
( segid " " and resid 75 and name HD1%)
2.500 0.800 0.800 peak 2117 spectrum 1 weight 0.10000E+01 volume 0.13122E-01 ppm1 4.457 ppm2 0.913 CV 1
OR { 2117}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 40 and name HD2%)
OR { 2117}
(( segid " " and resid 75 and name HA ))
( segid " " and resid 75 and name HD2%)
ASSI { 2118}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 75 and name H ))
2.300 0.700 0.700 peak 2118 spectrum 1 weight 0.10000E+01 volume 0.53176E-02 ppm1 4.094 ppm2 8.389 CV 1
OR { 2118}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name H ))
ASSI { 2119}
(( segid " " and resid 74 and name HB ))
(( segid " " and resid 74 and name H ))
2.800 1.000 1.000 peak 2119 spectrum 1 weight 0.10000E+01 volume 0.36039E-02 ppm1 2.027 ppm2 8.388 CV 1
OR { 2119}
(( segid " " and resid 74 and name HB ))
(( segid " " and resid 75 and name H ))
ASSI { 2120}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 74 and name H ))
2.400 0.700 0.700 peak 2120 spectrum 1 weight 0.10000E+01 volume 0.69165E-02 ppm1 0.916 ppm2 8.388 CV 1
OR { 2120}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 75 and name H ))
ASSI { 2122}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 76 and name HE1 ))
2.500 0.800 0.800 peak 2122 spectrum 1 weight 0.10000E+01 volume 0.98389E-02 ppm1 0.873 ppm2 0.687 CV 1
OR { 2122}
( segid " " and resid 74 and name HG1%)
( segid " " and resid 121 and name HD1%)
ASSI { 2124}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 109 and name HB2 ))
3.400 1.400 1.400 peak 2124 spectrum 1 weight 0.10000E+01 volume 0.26957E-02 ppm1 0.887 ppm2 1.761 CV 1
OR { 2124}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 73 and name HB ))
ASSI { 2126}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 74 and name HB ))
1.800 0.400 0.400 peak 2126 spectrum 1 weight 0.10000E+01 volume 0.27217E-01 ppm1 0.877 ppm2 2.036 CV 1
OR { 2126}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 30 and name HB2 ))
ASSI { 2129}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 75 and name HG ))
3.500 1.500 1.500 peak 2129 spectrum 1 weight 0.10000E+01 volume 0.33708E-02 ppm1 0.872 ppm2 1.586 CV 1
OR { 2129}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 117 and name HB3 ))
ASSI { 2130}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 109 and name HB3 ))
2.900 1.000 1.000 peak 2130 spectrum 1 weight 0.10000E+01 volume 0.38727E-02 ppm1 0.879 ppm2 1.435 CV 1
OR { 2130}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 109 and name HG3 ))
OR { 2130}
( segid " " and resid 27 and name HG2%)
( segid " " and resid 35 and name HB% )
ASSI { 2131}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 117 and name HD2 ))
2.700 0.900 0.900 peak 2131 spectrum 1 weight 0.10000E+01 volume 0.79941E-02 ppm1 0.875 ppm2 1.126 CV 1
OR { 2131}
( segid " " and resid 74 and name HG1%)
( segid " " and resid 84 and name HD1%)
OR { 2131}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 73 and name HG12))
ASSI { 2133}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 74 and name HA ))
2.700 0.900 0.900 peak 2133 spectrum 1 weight 0.10000E+01 volume 0.94820E-02 ppm1 0.873 ppm2 4.096 CV 1
OR { 2133}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 73 and name HA ))
ASSI { 2135}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 30 and name HE21))
3.100 1.200 1.200 peak 2135 spectrum 1 weight 0.10000E+01 volume 0.23876E-02 ppm1 0.885 ppm2 7.031 CV 1
OR { 2135}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 76 and name HZ3 ))
ASSI { 2139}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 114 and name H ))
4.000 2.000 2.000 peak 2139 spectrum 1 weight 0.10000E+01 volume 0.88547E-03 ppm1 0.879 ppm2 8.118 CV 1
OR { 2139}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 24 and name HD21))
OR { 2139}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 73 and name H ))
OR { 2139}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 116 and name H ))
ASSI { 2141}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 76 and name HZ3 ))
3.600 1.600 1.600 peak 2141 spectrum 1 weight 0.10000E+01 volume 0.16291E-02 ppm1 0.917 ppm2 7.006 CV 1
OR { 2141}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 72 and name HD2 ))
ASSI { 2151}
(( segid " " and resid 74 and name HB ))
(( segid " " and resid 75 and name HG ))
3.900 1.900 1.900 peak 2151 spectrum 1 weight 0.10000E+01 volume 0.16333E-02 ppm1 2.025 ppm2 1.590 CV 1
OR { 2151}
(( segid " " and resid 74 and name HB ))
(( segid " " and resid 117 and name HB3 ))
OR { 2151}
(( segid " " and resid 74 and name HB ))
(( segid " " and resid 75 and name HB2 ))
ASSI { 2153}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 109 and name HB2 ))
3.100 1.200 1.200 peak 2153 spectrum 1 weight 0.10000E+01 volume 0.34622E-02 ppm1 0.916 ppm2 1.786 CV 1
OR { 2153}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 73 and name HB ))
ASSI { 2156}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 109 and name HG2 ))
3.200 1.300 1.300 peak 2156 spectrum 1 weight 0.10000E+01 volume 0.33120E-02 ppm1 0.917 ppm2 1.328 CV 1
OR { 2156}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 117 and name HB2 ))
ASSI { 2158}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 117 and name HD2 ))
2.900 1.000 1.000 peak 2158 spectrum 1 weight 0.10000E+01 volume 0.67789E-02 ppm1 0.915 ppm2 1.164 CV 1
OR { 2158}
( segid " " and resid 74 and name HG2%)
( segid " " and resid 107 and name HB% )
ASSI { 2159}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 80 and name HB2 ))
4.600 2.700 1.400 peak 2159 spectrum 1 weight 0.10000E+01 volume 0.54588E-03 ppm1 0.813 ppm2 2.431 CV 1
OR { 2159}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 83 and name HB2 ))
OR { 2159}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 109 and name HD3 ))
OR { 2159}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 89 and name HG2 ))
ASSI { 2161}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 84 and name HB3 ))
3.200 1.300 1.300 peak 2161 spectrum 1 weight 0.10000E+01 volume 0.10040E-02 ppm1 0.809 ppm2 2.021 CV 1
OR { 2161}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 74 and name HB ))
ASSI { 2162}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HB ))
2.400 0.700 0.700 peak 2162 spectrum 1 weight 0.10000E+01 volume 0.93642E-02 ppm1 0.809 ppm2 1.778 CV 1
OR { 2162}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 81 and name HB2 ))
ASSI { 2165}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 109 and name HD3 ))
4.200 2.200 1.800 peak 2165 spectrum 1 weight 0.10000E+01 volume 0.99988E-03 ppm1 0.828 ppm2 2.417 CV 1
OR { 2165}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 80 and name HB2 ))
OR { 2165}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 83 and name HB2 ))
ASSI { 2166}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 85 and name HB2 ))
3.800 1.800 1.800 peak 2166 spectrum 1 weight 0.10000E+01 volume 0.14889E-02 ppm1 0.831 ppm2 2.262 CV 1
OR { 2166}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 114 and name HB ))
OR { 2166}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 85 and name HB3 ))
OR { 2166}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 113 and name HB3 ))
OR { 2166}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 85 and name HG3 ))
ASSI { 2167}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 84 and name HB3 ))
3.000 1.100 1.100 peak 2167 spectrum 1 weight 0.10000E+01 volume 0.22892E-02 ppm1 0.832 ppm2 2.016 CV 1
OR { 2167}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HB ))
ASSI { 2169}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 117 and name HB3 ))
2.900 1.100 1.100 peak 2169 spectrum 1 weight 0.10000E+01 volume 0.42843E-02 ppm1 0.830 ppm2 1.582 CV 1
OR { 2169}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 121 and name HG ))
ASSI { 2172}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HG12))
2.100 0.500 0.500 peak 2172 spectrum 1 weight 0.10000E+01 volume 0.15298E-01 ppm1 0.830 ppm2 1.141 CV 1
OR { 2172}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 117 and name HD2 ))
ASSI { 2175}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 73 and name HG12))
2.500 0.800 0.800 peak 2175 spectrum 1 weight 0.10000E+01 volume 0.23686E-02 ppm1 4.142 ppm2 1.139 CV 1
OR { 2175}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 117 and name HD2 ))
ASSI { 2176}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 73 and name HG2%)
2.200 0.600 0.600 peak 2176 spectrum 1 weight 0.10000E+01 volume 0.11184E-01 ppm1 4.142 ppm2 0.829 CV 1
OR { 2176}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 74 and name HG1%)
ASSI { 2178}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 73 and name HA ))
2.700 0.900 0.900 peak 2178 spectrum 1 weight 0.10000E+01 volume 0.21875E-02 ppm1 1.136 ppm2 4.144 CV 1
OR { 2178}
(( segid " " and resid 117 and name HD2 ))
(( segid " " and resid 73 and name HA ))
OR { 2178}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 71 and name HB ))
ASSI { 2179}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 71 and name HB ))
3.000 1.100 1.100 peak 2179 spectrum 1 weight 0.10000E+01 volume 0.47532E-02 ppm1 0.809 ppm2 4.145 CV 1
OR { 2179}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HA ))
ASSI { 2180}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HA ))
2.200 0.600 0.600 peak 2180 spectrum 1 weight 0.10000E+01 volume 0.84038E-02 ppm1 0.830 ppm2 4.141 CV 1
OR { 2180}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HA ))
ASSI { 2182}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 85 and name H ))
3.500 1.500 1.500 peak 2182 spectrum 1 weight 0.10000E+01 volume 0.16666E-02 ppm1 0.808 ppm2 8.165 CV 1
OR { 2182}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 82 and name H ))
OR { 2182}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name H ))
ASSI { 2184}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name H ))
3.500 1.600 1.600 peak 2184 spectrum 1 weight 0.10000E+01 volume 0.21409E-02 ppm1 0.829 ppm2 8.162 CV 1
OR { 2184}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 85 and name H ))
OR { 2184}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 121 and name H ))
ASSI { 2185}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 73 and name H ))
3.300 1.400 1.400 peak 2185 spectrum 1 weight 0.10000E+01 volume 0.14227E-02 ppm1 1.134 ppm2 8.160 CV 1
OR { 2185}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 121 and name H ))
ASSI { 2191}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 76 and name H ))
4.200 2.200 1.800 peak 2191 spectrum 1 weight 0.10000E+01 volume 0.46504E-03 ppm1 1.771 ppm2 8.645 CV 1
OR { 2191}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 81 and name H ))
ASSI { 2192}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 81 and name H ))
5.000 3.100 1.000 peak 2192 spectrum 1 weight 0.10000E+01 volume 0.31436E-03 ppm1 0.825 ppm2 8.659 CV 1
OR { 2192}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 76 and name H ))
ASSI { 2201}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 76 and name HZ3 ))
4.900 3.000 1.100 peak 2201 spectrum 1 weight 0.10000E+01 volume 0.27534E-03 ppm1 0.812 ppm2 7.010 CV 1
OR { 2201}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 72 and name HD2 ))
ASSI { 2208}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 88 and name HB3 ))
4.300 2.300 1.700 peak 2208 spectrum 1 weight 0.10000E+01 volume 0.50910E-03 ppm1 0.810 ppm2 3.210 CV 1
OR { 2208}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 86 and name HD2 ))
ASSI { 2209}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 76 and name HB3 ))
4.900 3.000 1.100 peak 2209 spectrum 1 weight 0.10000E+01 volume 0.48902E-03 ppm1 0.809 ppm2 3.018 CV 1
OR { 2209}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 72 and name HB2 ))
ASSI { 2211}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 80 and name HG2 ))
5.300 3.600 0.700 peak 2211 spectrum 1 weight 0.10000E+01 volume 0.30297E-03 ppm1 0.808 ppm2 2.693 CV 1
OR { 2211}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 79 and name HB3 ))
ASSI { 2216}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 109 and name HD2 ))
4.700 2.700 1.300 peak 2216 spectrum 1 weight 0.10000E+01 volume 0.41380E-03 ppm1 0.826 ppm2 2.783 CV 1
OR { 2216}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 80 and name HG3 ))
ASSI { 2218}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 88 and name HB3 ))
4.400 2.500 1.600 peak 2218 spectrum 1 weight 0.10000E+01 volume 0.47268E-03 ppm1 0.830 ppm2 3.225 CV 1
OR { 2218}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 127 and name HD3 ))
OR { 2218}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 127 and name HD2 ))
ASSI { 2219}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 76 and name HB2 ))
4.100 2.100 1.900 peak 2219 spectrum 1 weight 0.10000E+01 volume 0.56933E-03 ppm1 0.828 ppm2 3.164 CV 1
OR { 2219}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 72 and name HB3 ))
ASSI { 2220}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 76 and name HB3 ))
4.600 2.700 1.400 peak 2220 spectrum 1 weight 0.10000E+01 volume 0.50833E-03 ppm1 0.824 ppm2 3.045 CV 1
OR { 2220}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 72 and name HB2 ))
ASSI { 2222}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 76 and name HB2 ))
4.500 2.500 1.500 peak 2222 spectrum 1 weight 0.10000E+01 volume 0.20097E-03 ppm1 1.773 ppm2 3.144 CV 1
OR { 2222}
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(( segid " " and resid 72 and name HB3 ))
ASSI { 2223}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 73 and name HB ))
2.800 1.000 1.000 peak 2223 spectrum 1 weight 0.10000E+01 volume 0.44255E-02 ppm1 1.136 ppm2 1.778 CV 1
OR { 2223}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 81 and name HB2 ))
ASSI { 2225}
(( segid " " and resid 73 and name HG12))
( segid " " and resid 73 and name HD1%)
2.000 0.500 0.500 peak 2225 spectrum 1 weight 0.10000E+01 volume 0.17037E-01 ppm1 1.135 ppm2 0.822 CV 1
OR { 2225}
(( segid " " and resid 73 and name HG12))
( segid " " and resid 73 and name HG2%)
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ASSI { 2226}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 72 and name HB3 ))
4.500 2.500 1.500 peak 2226 spectrum 1 weight 0.10000E+01 volume 0.23052E-03 ppm1 1.132 ppm2 3.114 CV 1
OR { 2226}
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(( segid " " and resid 76 and name HB2 ))
ASSI { 2227}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 72 and name HB3 ))
4.800 2.900 1.200 peak 2227 spectrum 1 weight 0.10000E+01 volume 0.33944E-03 ppm1 1.392 ppm2 3.158 CV 1
OR { 2227}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 76 and name HB2 ))
ASSI { 2233}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 73 and name H ))
4.400 2.400 1.600 peak 2233 spectrum 1 weight 0.10000E+01 volume 0.31169E-03 ppm1 7.007 ppm2 8.168 CV 1
OR { 2233}
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ASSI { 2234}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 74 and name H ))
5.300 3.500 0.700 peak 2234 spectrum 1 weight 0.10000E+01 volume 0.17369E-03 ppm1 7.003 ppm2 8.400 CV 1
OR { 2234}
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(( segid " " and resid 118 and name H ))
ASSI { 2237}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 71 and name HA ))
5.500 3.800 0.500 peak 2237 spectrum 1 weight 0.10000E+01 volume 0.18656E-03 ppm1 7.006 ppm2 4.330 CV 1
OR { 2237}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 113 and name HA ))
ASSI { 2238}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 73 and name HA ))
4.000 2.000 2.000 peak 2238 spectrum 1 weight 0.10000E+01 volume 0.43691E-03 ppm1 7.007 ppm2 4.143 CV 1
OR { 2238}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 74 and name HA ))
ASSI { 2245}
(( segid " " and resid 72 and name HE1 ))
( segid " " and resid 75 and name HD1%)
4.300 2.300 1.700 peak 2245 spectrum 1 weight 0.10000E+01 volume 0.49846E-03 ppm1 7.993 ppm2 0.912 CV 1
OR { 2245}
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( segid " " and resid 75 and name HD2%)
OR { 2245}
(( segid " " and resid 72 and name HE1 ))
( segid " " and resid 74 and name HG2%)
OR { 2245}
(( segid " " and resid 72 and name HE1 ))
( segid " " and resid 74 and name HG1%)
ASSI { 2246}
(( segid " " and resid 72 and name HE1 ))
( segid " " and resid 75 and name HD2%)
4.700 2.800 1.300 peak 2246 spectrum 1 weight 0.10000E+01 volume 0.31811E-03 ppm1 7.994 ppm2 0.842 CV 1
OR { 2246}
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( segid " " and resid 74 and name HG1%)
OR { 2246}
(( segid " " and resid 72 and name HE1 ))
( segid " " and resid 73 and name HG2%)
ASSI { 2247}
(( segid " " and resid 72 and name HD2 ))
( segid " " and resid 74 and name HG2%)
3.700 1.700 1.700 peak 2247 spectrum 1 weight 0.10000E+01 volume 0.20811E-02 ppm1 7.006 ppm2 0.909 CV 1
OR { 2247}
(( segid " " and resid 72 and name HD2 ))
( segid " " and resid 74 and name HG1%)
OR { 2247}
(( segid " " and resid 72 and name HD2 ))
( segid " " and resid 75 and name HD2%)
ASSI { 2250}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 73 and name HB ))
4.300 2.300 1.700 peak 2250 spectrum 1 weight 0.10000E+01 volume 0.62149E-03 ppm1 7.006 ppm2 1.736 CV 1
OR { 2250}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 119 and name HB2 ))
ASSI { 2254}
(( segid " " and resid 71 and name HA ))
( segid " " and resid 82 and name HD2%)
3.900 1.900 1.900 peak 2254 spectrum 1 weight 0.10000E+01 volume 0.71699E-03 ppm1 4.322 ppm2 0.903 CV 1
OR { 2254}
(( segid " " and resid 71 and name HA ))
( segid " " and resid 114 and name HG2%)
OR { 2254}
(( segid " " and resid 71 and name HA ))
( segid " " and resid 74 and name HG1%)
OR { 2254}
(( segid " " and resid 71 and name HA ))
( segid " " and resid 130 and name HD2%)
ASSI { 2255}
(( segid " " and resid 71 and name HA ))
( segid " " and resid 73 and name HD1%)
4.700 2.700 1.300 peak 2255 spectrum 1 weight 0.10000E+01 volume 0.63520E-03 ppm1 4.317 ppm2 0.836 CV 1
OR { 2255}
(( segid " " and resid 71 and name HA ))
( segid " " and resid 73 and name HG2%)
OR { 2255}
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( segid " " and resid 123 and name HD1%)
ASSI { 2256}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 82 and name HD2%)
4.000 2.000 2.000 peak 2256 spectrum 1 weight 0.10000E+01 volume 0.64681E-03 ppm1 4.169 ppm2 0.901 CV 1
OR { 2256}
(( segid " " and resid 71 and name HB ))
( segid " " and resid 74 and name HG1%)
ASSI { 2260}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 121 and name HB3 ))
3.400 1.500 1.500 peak 2260 spectrum 1 weight 0.10000E+01 volume 0.90404E-03 ppm1 4.174 ppm2 1.428 CV 1
OR { 2260}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 73 and name HG13))
ASSI { 2261}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 73 and name HG13))
3.900 1.900 1.900 peak 2261 spectrum 1 weight 0.10000E+01 volume 0.83636E-03 ppm1 4.169 ppm2 1.374 CV 1
OR { 2261}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 123 and name HG ))
ASSI { 2262}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 73 and name HB ))
3.000 3.000 3.000 peak 2262 spectrum 1 weight 0.10000E+01 volume 0.75211E-02 ppm1 4.308 ppm2 1.760 CV 1
OR { 2262}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 81 and name HB2 ))
ASSI { 2264}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 68 and name HD3 ))
3.100 3.100 2.900 peak 2264 spectrum 1 weight 0.10000E+01 volume 0.51789E-03 ppm1 4.312 ppm2 3.189 CV 1
OR { 2264}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 68 and name HD2 ))
OR { 2264}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 88 and name HB3 ))
ASSI { 2266}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 121 and name HA ))
2.100 0.500 0.500 peak 2266 spectrum 1 weight 0.10000E+01 volume 0.96327E-02 ppm1 4.320 ppm2 4.174 CV 1
OR { 2266}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HB ))
ASSI { 2268}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 7 and name HB2 ))
4.400 2.400 1.600 peak 2268 spectrum 1 weight 0.10000E+01 volume 0.46694E-03 ppm1 4.178 ppm2 1.707 CV 1
OR { 2268}
(( segid " " and resid 71 and name HB ))
(( segid " " and resid 82 and name HB3 ))
ASSI { 2271}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 70 and name HA2 ))
3.700 1.700 1.700 peak 2271 spectrum 1 weight 0.10000E+01 volume 0.19669E-02 ppm1 1.165 ppm2 4.037 CV 1
OR { 2271}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 70 and name HA3 ))
OR { 2271}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 80 and name HA ))
OR { 2271}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 78 and name HA3 ))
ASSI { 2272}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 47 and name HD3 ))
3.400 1.500 1.500 peak 2272 spectrum 1 weight 0.10000E+01 volume 0.12753E-02 ppm1 1.166 ppm2 3.206 CV 1
OR { 2272}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 52 and name HB2 ))
ASSI { 2274}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name H ))
3.500 1.500 1.500 peak 2274 spectrum 1 weight 0.10000E+01 volume 0.68459E-03 ppm1 4.321 ppm2 8.100 CV 1
OR { 2274}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 121 and name H ))
ASSI { 2276}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 49 and name HE21))
4.100 2.100 1.900 peak 2276 spectrum 1 weight 0.10000E+01 volume 0.65910E-03 ppm1 1.168 ppm2 7.021 CV 1
OR { 2276}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 52 and name HD2 ))
ASSI { 2278}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 53 and name HE1 ))
4.700 2.800 1.300 peak 2278 spectrum 1 weight 0.10000E+01 volume 0.39367E-03 ppm1 1.169 ppm2 7.989 CV 1
OR { 2278}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 84 and name H ))
OR { 2278}
( segid " " and resid 71 and name HG2%)
(( segid " " and resid 84 and name H ))
ASSI { 2281}
(( segid " " and resid 122 and name HA2 ))
( segid " " and resid 123 and name HD1%)
3.900 1.900 1.900 peak 2281 spectrum 1 weight 0.10000E+01 volume 0.13452E-02 ppm1 4.020 ppm2 0.823 CV 1
OR { 2281}
(( segid " " and resid 122 and name HA2 ))
( segid " " and resid 124 and name HG2%)
OR { 2281}
(( segid " " and resid 122 and name HA2 ))
( segid " " and resid 119 and name HD2%)
OR { 2281}
(( segid " " and resid 70 and name HA2 ))
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ASSI { 2283}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 69 and name HB3 ))
3.000 1.200 1.200 peak 2283 spectrum 1 weight 0.10000E+01 volume 0.13350E-02 ppm1 4.018 ppm2 1.869 CV 1
OR { 2283}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 118 and name HG ))
OR { 2283}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 124 and name HB ))
ASSI { 2284}
(( segid " " and resid 70 and name HA3 ))
(( segid " " and resid 64 and name HD2 ))
3.000 1.100 1.100 peak 2284 spectrum 1 weight 0.10000E+01 volume 0.90623E-03 ppm1 4.018 ppm2 1.707 CV 1
OR { 2284}
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(( segid " " and resid 64 and name HD3 ))
OR { 2284}
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(( segid " " and resid 119 and name HB2 ))
OR { 2284}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 127 and name HG2 ))
ASSI { 2285}
(( segid " " and resid 70 and name HA3 ))
(( segid " " and resid 64 and name HG2 ))
3.700 1.700 1.700 peak 2285 spectrum 1 weight 0.10000E+01 volume 0.93815E-03 ppm1 4.018 ppm2 1.472 CV 1
OR { 2285}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 64 and name HG2 ))
OR { 2285}
(( segid " " and resid 70 and name HA3 ))
( segid " " and resid 120 and name HB% )
OR { 2285}
(( segid " " and resid 122 and name HA2 ))
( segid " " and resid 125 and name HB% )
OR { 2285}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 121 and name HB3 ))
OR { 2285}
(( segid " " and resid 70 and name HA2 ))
( segid " " and resid 120 and name HB% )
ASSI { 2286}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 69 and name HB3 ))
3.000 1.100 1.100 peak 2286 spectrum 1 weight 0.10000E+01 volume 0.10898E-02 ppm1 4.019 ppm2 1.800 CV 1
OR { 2286}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 69 and name HB2 ))
OR { 2286}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 119 and name HB2 ))
ASSI { 2288}
(( segid " " and resid 70 and name HA3 ))
(( segid " " and resid 63 and name HB ))
3.200 3.200 2.800 peak 2288 spectrum 1 weight 0.10000E+01 volume 0.64805E-03 ppm1 4.021 ppm2 2.229 CV 1
OR { 2288}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 63 and name HB ))
OR { 2288}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 85 and name HB2 ))
OR { 2288}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 126 and name HG3 ))
OR { 2288}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 115 and name HB ))
OR { 2288}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 126 and name HB2 ))
OR { 2288}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 85 and name HB2 ))
OR { 2288}
(( segid " " and resid 70 and name HA3 ))
(( segid " " and resid 85 and name HB2 ))
OR { 2288}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 85 and name HB3 ))
ASSI { 2289}
(( segid " " and resid 122 and name HA2 ))
(( segid " " and resid 118 and name HB2 ))
4.500 2.600 1.500 peak 2289 spectrum 1 weight 0.10000E+01 volume 0.58425E-03 ppm1 4.020 ppm2 1.989 CV 1
OR { 2289}
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(( segid " " and resid 126 and name HB3 ))
ASSI { 2294}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HB3 ))
2.400 0.700 0.700 peak 2294 spectrum 1 weight 0.10000E+01 volume 0.13344E-01 ppm1 4.405 ppm2 2.413 CV 1
OR { 2294}
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(( segid " " and resid 67 and name HG3 ))
OR { 2294}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 2297}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 55 and name HG1%)
4.200 2.200 1.800 peak 2297 spectrum 1 weight 0.10000E+01 volume 0.12937E-02 ppm1 4.405 ppm2 0.789 CV 1
OR { 2297}
(( segid " " and resid 67 and name HA ))
( segid " " and resid 51 and name HD1%)
OR { 2297}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 54 and name HB2 ))
ASSI { 2299}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 90 and name HB3 ))
4.100 2.100 1.900 peak 2299 spectrum 1 weight 0.10000E+01 volume 0.21531E-02 ppm1 2.173 ppm2 1.435 CV 1
OR { 2299}
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(( segid " " and resid 64 and name HG3 ))
OR { 2299}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 64 and name HG2 ))
ASSI { 2301}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 90 and name HG3 ))
2.800 1.000 1.000 peak 2301 spectrum 1 weight 0.10000E+01 volume 0.54487E-02 ppm1 2.050 ppm2 1.704 CV 1
OR { 2301}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 68 and name HG3 ))
OR { 2301}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 2304}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 92 and name HD3 ))
3.600 1.600 1.600 peak 2304 spectrum 1 weight 0.10000E+01 volume 0.75614E-03 ppm1 2.171 ppm2 3.006 CV 1
OR { 2304}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 48 and name HE3 ))
ASSI { 2306}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 66 and name HD% )
4.900 2.900 1.100 peak 2306 spectrum 1 weight 0.10000E+01 volume 0.60053E-03 ppm1 4.406 ppm2 7.299 CV 1
OR { 2306}
(( segid " " and resid 67 and name HA ))
( segid " " and resid 66 and name HD% )
ASSI { 2308}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 67 and name HE21))
4.400 2.400 1.600 peak 2308 spectrum 1 weight 0.10000E+01 volume 0.67052E-03 ppm1 2.170 ppm2 7.532 CV 1
OR { 2308}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 66 and name H ))
ASSI { 2309}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HE21))
4.200 2.200 1.800 peak 2309 spectrum 1 weight 0.10000E+01 volume 0.75031E-03 ppm1 2.054 ppm2 7.539 CV 1
OR { 2309}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 66 and name H ))
ASSI { 2310}
(( segid " " and resid 67 and name HB2 ))
( segid " " and resid 66 and name HE% )
2.600 2.600 3.400 peak 2310 spectrum 1 weight 0.10000E+01 volume 0.53018E-03 ppm1 2.046 ppm2 7.063 CV 1
OR { 2310}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 52 and name HD2 ))
ASSI { 2312}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 67 and name HE22))
4.200 2.200 1.800 peak 2312 spectrum 1 weight 0.10000E+01 volume 0.55321E-03 ppm1 2.175 ppm2 6.948 CV 1
OR { 2312}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 9 and name HZ2 ))
OR { 2312}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 9 and name HZ2 ))
ASSI { 2321}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 9 and name HE3 ))
3.700 1.700 1.700 peak 2321 spectrum 1 weight 0.10000E+01 volume 0.12360E-02 ppm1 2.884 ppm2 7.090 CV 1
OR { 2321}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 66 and name HE% )
ASSI { 2327}
(( segid " " and resid 66 and name HB3 ))
( segid " " and resid 32 and name HG1%)
4.700 2.700 1.300 peak 2327 spectrum 1 weight 0.10000E+01 volume 0.38036E-03 ppm1 3.365 ppm2 1.280 CV 1
OR { 2327}
(( segid " " and resid 66 and name HB3 ))
( segid " " and resid 60 and name HB% )
ASSI { 2331}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 32 and name HG1%)
4.800 2.900 1.200 peak 2331 spectrum 1 weight 0.10000E+01 volume 0.54800E-03 ppm1 2.908 ppm2 1.283 CV 1
OR { 2331}
(( segid " " and resid 88 and name HB2 ))
(( segid " " and resid 114 and name HG12))
ASSI { 2333}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 17 and name HD2%)
3.000 1.100 1.100 peak 2333 spectrum 1 weight 0.10000E+01 volume 0.19871E-02 ppm1 2.891 ppm2 0.762 CV 1
OR { 2333}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 51 and name HD1%)
ASSI { 2339}
(( segid " " and resid 79 and name HA ))
( segid " " and resid 82 and name HD1%)
3.400 1.400 1.400 peak 2339 spectrum 1 weight 0.10000E+01 volume 0.46103E-02 ppm1 4.577 ppm2 0.954 CV 1
OR { 2339}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 63 and name HG1%)
ASSI { 2343}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB2 ))
2.900 1.100 1.100 peak 2343 spectrum 1 weight 0.10000E+01 volume 0.36163E-02 ppm1 4.586 ppm2 3.997 CV 1
OR { 2343}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 63 and name HA ))
OR { 2343}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 55 and name HA ))
OR { 2343}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 78 and name HA3 ))
ASSI { 2348}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 63 and name HG1%)
4.400 2.400 1.600 peak 2348 spectrum 1 weight 0.10000E+01 volume 0.89365E-03 ppm1 2.417 ppm2 0.952 CV 1
OR { 2348}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 33 and name HG1%)
OR { 2348}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 33 and name HG2%)
ASSI { 2354}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 63 and name HA ))
4.700 2.800 1.300 peak 2354 spectrum 1 weight 0.10000E+01 volume 0.22950E-03 ppm1 2.408 ppm2 3.978 CV 1
OR { 2354}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 55 and name HA ))
ASSI { 2361}
(( segid " " and resid 48 and name HE2 ))
(( segid " " and resid 49 and name H ))
4.100 2.100 1.900 peak 2361 spectrum 1 weight 0.10000E+01 volume 0.49250E-03 ppm1 2.978 ppm2 7.691 CV 1
OR { 2361}
(( segid " " and resid 48 and name HE3 ))
(( segid " " and resid 49 and name H ))
OR { 2361}
(( segid " " and resid 48 and name HE2 ))
(( segid " " and resid 46 and name H ))
ASSI { 2362}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 63 and name HG1%)
2.800 1.000 1.000 peak 2362 spectrum 1 weight 0.10000E+01 volume 0.56068E-02 ppm1 4.107 ppm2 0.960 CV 1
OR { 2362}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 63 and name HG2%)
OR { 2362}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 101 and name HG2%)
OR { 2362}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 114 and name HG2%)
OR { 2362}
(( segid " " and resid 129 and name HA ))
( segid " " and resid 130 and name HD1%)
ASSI { 2363}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HG3 ))
2.300 0.700 0.700 peak 2363 spectrum 1 weight 0.10000E+01 volume 0.97907E-02 ppm1 4.109 ppm2 1.440 CV 1
OR { 2363}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HG3 ))
OR { 2363}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HG2 ))
OR { 2363}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HG2 ))
ASSI { 2364}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HB2 ))
2.200 0.600 0.600 peak 2364 spectrum 1 weight 0.10000E+01 volume 0.11254E-01 ppm1 4.111 ppm2 1.819 CV 1
OR { 2364}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HB2 ))
OR { 2364}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HB2 ))
OR { 2364}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HB3 ))
ASSI { 2373}
(( segid " " and resid 64 and name HG3 ))
( segid " " and resid 63 and name HG1%)
2.600 0.800 0.800 peak 2373 spectrum 1 weight 0.10000E+01 volume 0.55358E-02 ppm1 1.460 ppm2 0.964 CV 1
OR { 2373}
(( segid " " and resid 64 and name HG2 ))
( segid " " and resid 63 and name HG1%)
OR { 2373}
(( segid " " and resid 64 and name HG3 ))
( segid " " and resid 63 and name HG2%)
OR { 2373}
(( segid " " and resid 136 and name HG3 ))
( segid " " and resid 138 and name HD2%)
OR { 2373}
(( segid " " and resid 64 and name HG2 ))
( segid " " and resid 63 and name HG2%)
ASSI { 2378}
(( segid " " and resid 48 and name HE2 ))
(( segid " " and resid 48 and name HA ))
4.300 2.300 1.700 peak 2378 spectrum 1 weight 0.10000E+01 volume 0.17159E-02 ppm1 2.973 ppm2 3.861 CV 1
OR { 2378}
(( segid " " and resid 48 and name HE3 ))
(( segid " " and resid 48 and name HA ))
OR { 2378}
(( segid " " and resid 25 and name HE2 ))
(( segid " " and resid 25 and name HA ))
OR { 2378}
(( segid " " and resid 25 and name HE3 ))
(( segid " " and resid 25 and name HA ))
ASSI { 2379}
(( segid " " and resid 48 and name HE3 ))
(( segid " " and resid 52 and name HD2 ))
4.200 2.200 1.800 peak 2379 spectrum 1 weight 0.10000E+01 volume 0.54664E-03 ppm1 2.973 ppm2 7.064 CV 1
OR { 2379}
(( segid " " and resid 48 and name HE2 ))
(( segid " " and resid 52 and name HD2 ))
OR { 2379}
(( segid " " and resid 48 and name HE2 ))
(( segid " " and resid 49 and name HE21))
ASSI { 2381}
(( segid " " and resid 48 and name HD3 ))
(( segid " " and resid 49 and name H ))
4.300 2.400 1.700 peak 2381 spectrum 1 weight 0.10000E+01 volume 0.79754E-03 ppm1 1.693 ppm2 7.711 CV 1
OR { 2381}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 65 and name H ))
OR { 2381}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 65 and name H ))
OR { 2381}
(( segid " " and resid 48 and name HD2 ))
(( segid " " and resid 49 and name H ))
ASSI { 2394}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 35 and name HB% )
2.500 0.800 0.800 peak 2394 spectrum 1 weight 0.10000E+01 volume 0.53669E-02 ppm1 3.964 ppm2 1.418 CV 1
OR { 2394}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 64 and name HG2 ))
OR { 2394}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 64 and name HG3 ))
ASSI { 2399}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name HD2 ))
2.800 1.000 1.000 peak 2399 spectrum 1 weight 0.10000E+01 volume 0.47464E-02 ppm1 0.963 ppm2 1.674 CV 1
OR { 2399}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 68 and name HG3 ))
OR { 2399}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name HD3 ))
OR { 2399}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 68 and name HG2 ))
ASSI { 2400}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 63 and name HB ))
2.000 0.500 0.500 peak 2400 spectrum 1 weight 0.10000E+01 volume 0.19459E-01 ppm1 0.963 ppm2 2.212 CV 1
OR { 2400}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 67 and name HB3 ))
ASSI { 2402}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 51 and name HA ))
3.700 1.700 1.700 peak 2402 spectrum 1 weight 0.10000E+01 volume 0.21923E-02 ppm1 0.964 ppm2 2.978 CV 1
OR { 2402}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name HE3 ))
OR { 2402}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name HE2 ))
ASSI { 2408}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 62 and name HA ))
4.700 2.800 1.300 peak 2408 spectrum 1 weight 0.10000E+01 volume 0.96100E-03 ppm1 0.965 ppm2 4.577 CV 1
OR { 2408}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 66 and name HA ))
ASSI { 2409}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 67 and name HE22))
4.300 2.300 1.700 peak 2409 spectrum 1 weight 0.10000E+01 volume 0.80205E-03 ppm1 0.964 ppm2 6.949 CV 1
OR { 2409}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 66 and name HZ ))
ASSI { 2410}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 52 and name HD2 ))
3.900 1.900 1.900 peak 2410 spectrum 1 weight 0.10000E+01 volume 0.18301E-02 ppm1 0.964 ppm2 7.071 CV 1
OR { 2410}
( segid " " and resid 63 and name HG2%)
( segid " " and resid 66 and name HE% )
ASSI { 2417}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 60 and name H ))
2.700 0.900 0.900 peak 2417 spectrum 1 weight 0.10000E+01 volume 0.29508E-02 ppm1 3.966 ppm2 7.066 CV 1
OR { 2417}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 30 and name HE21))
ASSI { 2419}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 65 and name H ))
3.700 1.700 1.700 peak 2419 spectrum 1 weight 0.10000E+01 volume 0.10028E-02 ppm1 3.964 ppm2 7.748 CV 1
OR { 2419}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 30 and name HE22))
ASSI { 2420}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name H ))
3.200 1.300 1.300 peak 2420 spectrum 1 weight 0.10000E+01 volume 0.16410E-02 ppm1 3.965 ppm2 8.086 CV 1
OR { 2420}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 36 and name H ))
OR { 2420}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 24 and name HD21))
ASSI { 2421}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name H ))
3.200 1.300 1.300 peak 2421 spectrum 1 weight 0.10000E+01 volume 0.16672E-02 ppm1 3.963 ppm2 7.978 CV 1
OR { 2421}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 34 and name H ))
ASSI { 2425}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 63 and name HB ))
4.300 2.400 1.700 peak 2425 spectrum 1 weight 0.10000E+01 volume 0.83827E-03 ppm1 4.581 ppm2 2.196 CV 1
OR { 2425}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 83 and name HB3 ))
ASSI { 2429}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 64 and name HE2 ))
4.400 2.400 1.600 peak 2429 spectrum 1 weight 0.10000E+01 volume 0.50718E-03 ppm1 3.999 ppm2 2.970 CV 1
OR { 2429}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 64 and name HE3 ))
OR { 2429}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 51 and name HA ))
ASSI { 2441}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 55 and name HG1%)
4.600 2.600 1.400 peak 2441 spectrum 1 weight 0.10000E+01 volume 0.90129E-03 ppm1 2.692 ppm2 0.808 CV 1
OR { 2441}
(( segid " " and resid 61 and name HB3 ))
( segid " " and resid 55 and name HG1%)
OR { 2441}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 37 and name HD1%)
OR { 2441}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 37 and name HD2%)
ASSI { 2444}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 35 and name HB% )
4.400 2.400 1.600 peak 2444 spectrum 1 weight 0.10000E+01 volume 0.65367E-03 ppm1 2.704 ppm2 1.443 CV 1
OR { 2444}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 64 and name HG3 ))
OR { 2444}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 64 and name HG3 ))
ASSI { 2445}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 64 and name HB2 ))
4.100 2.100 1.900 peak 2445 spectrum 1 weight 0.10000E+01 volume 0.57230E-03 ppm1 2.708 ppm2 1.812 CV 1
OR { 2445}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 64 and name HB2 ))
OR { 2445}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 30 and name HB3 ))
ASSI { 2446}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 64 and name HB3 ))
4.400 2.500 1.600 peak 2446 spectrum 1 weight 0.10000E+01 volume 0.69740E-03 ppm1 2.705 ppm2 1.731 CV 1
OR { 2446}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 64 and name HB3 ))
OR { 2446}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 47 and name HG3 ))
ASSI { 2447}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 37 and name HG ))
4.500 2.600 1.500 peak 2447 spectrum 1 weight 0.10000E+01 volume 0.65990E-03 ppm1 2.709 ppm2 1.684 CV 1
OR { 2447}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 64 and name HD3 ))
OR { 2447}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 64 and name HD2 ))
OR { 2447}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 64 and name HD3 ))
OR { 2447}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 64 and name HD2 ))
ASSI { 2448}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 30 and name HG2 ))
3.600 1.600 1.600 peak 2448 spectrum 1 weight 0.10000E+01 volume 0.12652E-02 ppm1 2.676 ppm2 2.145 CV 1
OR { 2448}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 36 and name HB ))
ASSI { 2449}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 65 and name HB3 ))
4.400 2.400 1.600 peak 2449 spectrum 1 weight 0.10000E+01 volume 0.12437E-02 ppm1 2.688 ppm2 2.425 CV 1
OR { 2449}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 34 and name HG2 ))
ASSI { 2450}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 34 and name HA ))
4.400 2.400 1.600 peak 2450 spectrum 1 weight 0.10000E+01 volume 0.58836E-03 ppm1 2.700 ppm2 3.996 CV 1
OR { 2450}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 62 and name HB2 ))
OR { 2450}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 32 and name HA ))
OR { 2450}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 2455}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 55 and name HA ))
3.900 1.900 1.900 peak 2455 spectrum 1 weight 0.10000E+01 volume 0.48703E-03 ppm1 4.532 ppm2 3.956 CV 1
OR { 2455}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 2457}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 60 and name H ))
4.300 2.400 1.700 peak 2457 spectrum 1 weight 0.10000E+01 volume 0.45789E-03 ppm1 4.535 ppm2 7.060 CV 1
OR { 2457}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 66 and name HE% )
ASSI { 2458}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 30 and name HE21))
5.100 3.200 0.900 peak 2458 spectrum 1 weight 0.10000E+01 volume 0.35121E-03 ppm1 2.701 ppm2 7.072 CV 1
OR { 2458}
(( segid " " and resid 61 and name HB3 ))
( segid " " and resid 66 and name HE% )
OR { 2458}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 66 and name HE% )
OR { 2458}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 60 and name H ))
OR { 2458}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 60 and name H ))
ASSI { 2462}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 33 and name HG2%)
3.600 1.600 1.600 peak 2462 spectrum 1 weight 0.10000E+01 volume 0.71416E-03 ppm1 4.531 ppm2 0.940 CV 1
OR { 2462}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 33 and name HG1%)
OR { 2462}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 63 and name HG1%)
OR { 2462}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 63 and name HG2%)
ASSI { 2468}
( segid " " and resid 60 and name HB% )
( segid " " and resid 55 and name HG1%)
2.100 0.500 0.500 peak 2468 spectrum 1 weight 0.10000E+01 volume 0.17537E-01 ppm1 1.234 ppm2 0.784 CV 1
OR { 2468}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 54 and name HB2 ))
ASSI { 2471}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 40 and name HG ))
2.600 0.800 0.800 peak 2471 spectrum 1 weight 0.10000E+01 volume 0.65642E-02 ppm1 1.241 ppm2 1.903 CV 1
OR { 2471}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 40 and name HB2 ))
OR { 2471}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 43 and name HB ))
ASSI { 2474}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 7 and name HB3 ))
2.700 2.700 3.300 peak 2474 spectrum 1 weight 0.10000E+01 volume 0.24569E-02 ppm1 1.244 ppm2 2.212 CV 1
OR { 2474}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 44 and name HB3 ))
OR { 2474}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 49 and name HB3 ))
OR { 2474}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 53 and name HB2 ))
OR { 2474}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 50 and name HB ))
OR { 2474}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 49 and name HB2 ))
ASSI { 2481}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HB ))
1.900 0.400 0.400 peak 2481 spectrum 1 weight 0.10000E+01 volume 0.31684E-01 ppm1 1.245 ppm2 4.206 CV 1
OR { 2481}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 42 and name HB ))
OR { 2481}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HA ))
ASSI { 2484}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 60 and name H ))
2.300 0.700 0.700 peak 2484 spectrum 1 weight 0.10000E+01 volume 0.11012E-01 ppm1 1.234 ppm2 7.074 CV 1
OR { 2484}
( segid " " and resid 60 and name HB% )
( segid " " and resid 66 and name HE% )
ASSI { 2486}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 16 and name HE1 ))
3.800 1.800 1.800 peak 2486 spectrum 1 weight 0.10000E+01 volume 0.14503E-02 ppm1 1.234 ppm2 8.292 CV 1
OR { 2486}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 54 and name H ))
ASSI { 2496}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name H ))
3.100 1.200 1.200 peak 2496 spectrum 1 weight 0.10000E+01 volume 0.18315E-02 ppm1 4.533 ppm2 7.062 CV 1
OR { 2496}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 66 and name HE% )
ASSI { 2497}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 54 and name HD2%)
4.800 2.900 1.200 peak 2497 spectrum 1 weight 0.10000E+01 volume 0.66387E-03 ppm1 4.200 ppm2 0.397 CV 1
OR { 2497}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 54 and name HD2%)
ASSI { 2503}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 59 and name HD1%)
3.500 1.500 1.500 peak 2503 spectrum 1 weight 0.10000E+01 volume 0.42734E-02 ppm1 4.197 ppm2 0.834 CV 1
OR { 2503}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 37 and name HD1%)
OR { 2503}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 59 and name HD1%)
OR { 2503}
(( segid " " and resid 121 and name HA ))
( segid " " and resid 123 and name HD1%)
ASSI { 2505}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 35 and name HB% )
2.000 0.500 0.500 peak 2505 spectrum 1 weight 0.10000E+01 volume 0.14665E-01 ppm1 4.189 ppm2 1.421 CV 1
OR { 2505}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 121 and name HB3 ))
ASSI { 2506}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB2 ))
2.600 0.800 0.800 peak 2506 spectrum 1 weight 0.10000E+01 volume 0.70491E-02 ppm1 4.191 ppm2 1.282 CV 1
OR { 2506}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 38 and name HB% )
ASSI { 2507}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HB3 ))
3.300 1.400 1.400 peak 2507 spectrum 1 weight 0.10000E+01 volume 0.31017E-02 ppm1 4.200 ppm2 2.099 CV 1
OR { 2507}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 30 and name HG2 ))
OR { 2507}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HG13))
OR { 2507}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HB ))
OR { 2507}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 18 and name HB3 ))
ASSI { 2508}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 57 and name HE% )
3.700 1.700 1.700 peak 2508 spectrum 1 weight 0.10000E+01 volume 0.20791E-02 ppm1 4.202 ppm2 1.992 CV 1
OR { 2508}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 57 and name HE% )
OR { 2508}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 57 and name HG2 ))
ASSI { 2509}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 14 and name HB2 ))
3.400 1.400 1.400 peak 2509 spectrum 1 weight 0.10000E+01 volume 0.14137E-02 ppm1 4.203 ppm2 2.404 CV 1
OR { 2509}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 34 and name HG2 ))
OR { 2509}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 19 and name HG3 ))
OR { 2509}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 13 and name HB2 ))
ASSI { 2514}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 54 and name HB3 ))
3.800 1.800 1.800 peak 2514 spectrum 1 weight 0.10000E+01 volume 0.31444E-03 ppm1 1.267 ppm2 1.977 CV 1
OR { 2514}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 57 and name HE% )
ASSI { 2515}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 59 and name HD2%)
1.700 0.300 0.500 peak 2515 spectrum 1 weight 0.10000E+01 volume 0.60226E-01 ppm1 0.822 ppm2 0.936 CV 1
OR { 2515}
( segid " " and resid 37 and name HD2%)
( segid " " and resid 33 and name HG2%)
OR { 2515}
( segid " " and resid 37 and name HD2%)
( segid " " and resid 33 and name HG1%)
OR { 2515}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 22 and name HD2%)
OR { 2515}
( segid " " and resid 37 and name HD2%)
( segid " " and resid 50 and name HG2%)
ASSI { 2517}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HG ))
1.800 0.400 0.400 peak 2517 spectrum 1 weight 0.10000E+01 volume 0.22023E-01 ppm1 0.823 ppm2 1.668 CV 1
OR { 2517}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 57 and name HB3 ))
OR { 2517}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 18 and name HG3 ))
ASSI { 2518}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 18 and name HB2 ))
1.900 0.400 0.400 peak 2518 spectrum 1 weight 0.10000E+01 volume 0.15097E-01 ppm1 0.820 ppm2 1.856 CV 1
OR { 2518}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 47 and name HB2 ))
OR { 2518}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HB3 ))
OR { 2518}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 47 and name HB3 ))
ASSI { 2519}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 34 and name HG2 ))
3.100 1.200 1.200 peak 2519 spectrum 1 weight 0.10000E+01 volume 0.23615E-02 ppm1 0.821 ppm2 2.391 CV 1
OR { 2519}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 129 and name HG2 ))
OR { 2519}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 67 and name HG2 ))
OR { 2519}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 67 and name HG3 ))
ASSI { 2521}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 18 and name HB3 ))
2.100 0.600 0.600 peak 2521 spectrum 1 weight 0.10000E+01 volume 0.71921E-02 ppm1 0.824 ppm2 2.108 CV 1
OR { 2521}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 22 and name HG ))
ASSI { 2528}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 16 and name H ))
3.300 1.300 1.300 peak 2528 spectrum 1 weight 0.10000E+01 volume 0.20409E-02 ppm1 4.199 ppm2 7.981 CV 1
OR { 2528}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 19 and name H ))
ASSI { 2529}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name H ))
2.700 0.900 0.900 peak 2529 spectrum 1 weight 0.10000E+01 volume 0.33624E-02 ppm1 4.190 ppm2 7.870 CV 1
OR { 2529}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 122 and name H ))
ASSI { 2530}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name H ))
2.800 1.000 1.000 peak 2530 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 4.204 ppm2 8.282 CV 1
OR { 2530}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name H ))
ASSI { 2535}
( segid " " and resid 37 and name HD2%)
( segid " " and resid 66 and name HE% )
3.500 1.500 1.500 peak 2535 spectrum 1 weight 0.10000E+01 volume 0.15111E-02 ppm1 0.825 ppm2 7.064 CV 1
OR { 2535}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 52 and name HD2 ))
ASSI { 2537}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 126 and name H ))
3.600 1.600 1.600 peak 2537 spectrum 1 weight 0.10000E+01 volume 0.24961E-02 ppm1 0.825 ppm2 7.661 CV 1
OR { 2537}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 59 and name H ))
ASSI { 2538}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 34 and name H ))
3.200 1.300 1.300 peak 2538 spectrum 1 weight 0.10000E+01 volume 0.21606E-02 ppm1 0.823 ppm2 7.986 CV 1
OR { 2538}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 33 and name H ))
ASSI { 2539}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 18 and name H ))
3.500 1.500 1.500 peak 2539 spectrum 1 weight 0.10000E+01 volume 0.22566E-02 ppm1 0.825 ppm2 8.305 CV 1
OR { 2539}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 48 and name H ))
ASSI { 2540}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name H ))
3.300 1.300 1.300 peak 2540 spectrum 1 weight 0.10000E+01 volume 0.38087E-02 ppm1 0.822 ppm2 8.583 CV 1
OR { 2540}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 22 and name H ))
ASSI { 2541}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 21 and name H ))
4.100 2.100 1.900 peak 2541 spectrum 1 weight 0.10000E+01 volume 0.12610E-02 ppm1 0.822 ppm2 8.976 CV 1
OR { 2541}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 47 and name H ))
ASSI { 2545}
(( segid " " and resid 58 and name HA3 ))
( segid " " and resid 59 and name HD1%)
4.700 2.800 1.300 peak 2545 spectrum 1 weight 0.10000E+01 volume 0.77576E-03 ppm1 4.080 ppm2 0.832 CV 1
OR { 2545}
(( segid " " and resid 58 and name HA3 ))
( segid " " and resid 55 and name HG2%)
OR { 2545}
(( segid " " and resid 58 and name HA3 ))
( segid " " and resid 55 and name HG1%)
ASSI { 2547}
(( segid " " and resid 58 and name HA2 ))
( segid " " and resid 55 and name HG2%)
4.600 2.700 1.400 peak 2547 spectrum 1 weight 0.10000E+01 volume 0.53926E-03 ppm1 3.902 ppm2 0.824 CV 1
OR { 2547}
(( segid " " and resid 58 and name HA2 ))
( segid " " and resid 55 and name HG1%)
OR { 2547}
(( segid " " and resid 58 and name HA2 ))
( segid " " and resid 59 and name HD1%)
ASSI { 2557}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 62 and name H ))
3.700 1.700 1.700 peak 2557 spectrum 1 weight 0.10000E+01 volume 0.13688E-02 ppm1 1.987 ppm2 7.866 CV 1
OR { 2557}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 57 and name H ))
ASSI { 2558}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 101 and name HA ))
4.400 2.400 1.600 peak 2558 spectrum 1 weight 0.10000E+01 volume 0.85480E-03 ppm1 3.952 ppm2 3.662 CV 1
OR { 2558}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 36 and name HA ))
ASSI { 2559}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 101 and name HA ))
4.300 2.300 1.700 peak 2559 spectrum 1 weight 0.10000E+01 volume 0.95793E-03 ppm1 3.977 ppm2 3.661 CV 1
OR { 2559}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 36 and name HA ))
OR { 2559}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 54 and name HA ))
ASSI { 2566}
(( segid " " and resid 57 and name HG2 ))
( segid " " and resid 54 and name HD2%)
5.300 3.500 0.700 peak 2566 spectrum 1 weight 0.10000E+01 volume 0.37539E-03 ppm1 1.986 ppm2 0.409 CV 1
OR { 2566}
(( segid " " and resid 55 and name HB ))
( segid " " and resid 54 and name HD1%)
ASSI { 2568}
(( segid " " and resid 55 and name HB ))
( segid " " and resid 60 and name HB% )
4.100 2.100 1.900 peak 2568 spectrum 1 weight 0.10000E+01 volume 0.68143E-03 ppm1 1.991 ppm2 1.240 CV 1
OR { 2568}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 2569}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 55 and name HA ))
2.800 1.000 1.000 peak 2569 spectrum 1 weight 0.10000E+01 volume 0.37704E-02 ppm1 1.995 ppm2 3.981 CV 1
OR { 2569}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 57 and name HA ))
OR { 2569}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HD3 ))
OR { 2569}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HD2 ))
ASSI { 2571}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 56 and name H ))
3.400 1.400 1.400 peak 2571 spectrum 1 weight 0.10000E+01 volume 0.20024E-02 ppm1 1.999 ppm2 8.072 CV 1
OR { 2571}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 56 and name H ))
ASSI { 2572}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 15 and name H ))
4.400 2.500 1.600 peak 2572 spectrum 1 weight 0.10000E+01 volume 0.66731E-03 ppm1 2.008 ppm2 8.288 CV 1
OR { 2572}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 54 and name H ))
OR { 2572}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 64 and name H ))
ASSI { 2573}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 61 and name H ))
5.200 3.300 0.800 peak 2573 spectrum 1 weight 0.10000E+01 volume 0.18369E-03 ppm1 1.992 ppm2 8.636 CV 1
OR { 2573}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 63 and name H ))
ASSI { 2575}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 59 and name H ))
4.100 2.100 1.900 peak 2575 spectrum 1 weight 0.10000E+01 volume 0.40436E-03 ppm1 1.986 ppm2 7.676 CV 1
OR { 2575}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 59 and name H ))
ASSI { 2577}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 57 and name H ))
3.800 1.800 1.800 peak 2577 spectrum 1 weight 0.10000E+01 volume 0.15161E-02 ppm1 2.156 ppm2 7.862 CV 1
OR { 2577}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 94 and name H ))
OR { 2577}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 92 and name H ))
ASSI { 2580}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 57 and name HB3 ))
2.100 0.500 0.500 peak 2580 spectrum 1 weight 0.10000E+01 volume 0.85567E-02 ppm1 1.987 ppm2 1.682 CV 1
OR { 2580}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 18 and name HG3 ))
ASSI { 2586}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 14 and name HB2 ))
2.000 2.000 4.000 peak 2586 spectrum 1 weight 0.10000E+01 volume 0.38337E-02 ppm1 1.987 ppm2 2.394 CV 1
OR { 2586}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 65 and name HB3 ))
ASSI { 2594}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 60 and name H ))
4.800 2.900 1.200 peak 2594 spectrum 1 weight 0.10000E+01 volume 0.56305E-03 ppm1 1.988 ppm2 7.066 CV 1
OR { 2594}
( segid " " and resid 57 and name HE% )
( segid " " and resid 66 and name HE% )
ASSI { 2598}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 18 and name H ))
2.700 0.900 0.900 peak 2598 spectrum 1 weight 0.10000E+01 volume 0.35474E-02 ppm1 1.987 ppm2 8.300 CV 1
OR { 2598}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 54 and name H ))
ASSI { 2599}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 19 and name H ))
2.400 2.400 3.600 peak 2599 spectrum 1 weight 0.10000E+01 volume 0.15428E-02 ppm1 1.987 ppm2 7.977 CV 1
OR { 2599}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 33 and name H ))
ASSI { 2613}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HG2 ))
2.600 0.800 0.800 peak 2613 spectrum 1 weight 0.10000E+01 volume 0.72161E-02 ppm1 1.717 ppm2 2.217 CV 1
OR { 2613}
(( segid " " and resid 127 and name HG2 ))
(( segid " " and resid 115 and name HB ))
OR { 2613}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 53 and name HB2 ))
ASSI { 2617}
(( segid " " and resid 30 and name HG2 ))
( segid " " and resid 32 and name HG1%)
4.300 2.300 1.700 peak 2617 spectrum 1 weight 0.10000E+01 volume 0.59408E-03 ppm1 2.142 ppm2 1.296 CV 1
OR { 2617}
(( segid " " and resid 30 and name HG2 ))
( segid " " and resid 38 and name HB% )
OR { 2617}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 2620}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name HB3 ))
2.200 0.600 0.600 peak 2620 spectrum 1 weight 0.10000E+01 volume 0.12457E-01 ppm1 2.219 ppm2 1.853 CV 1
OR { 2620}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 30 and name HB3 ))
ASSI { 2621}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 30 and name HB3 ))
2.200 0.600 0.600 peak 2621 spectrum 1 weight 0.10000E+01 volume 0.97784E-02 ppm1 2.132 ppm2 1.853 CV 1
OR { 2621}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 56 and name HB3 ))
ASSI { 2622}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 56 and name HG3 ))
1.200 0.200 1.000 peak 2622 spectrum 1 weight 0.10000E+01 volume 0.95177E-01 ppm1 2.221 ppm2 2.134 CV 1
OR { 2622}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 30 and name HG2 ))
ASSI { 2624}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 31 and name HB3 ))
5.100 3.300 0.900 peak 2624 spectrum 1 weight 0.10000E+01 volume 0.67923E-03 ppm1 2.214 ppm2 2.871 CV 1
OR { 2624}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 2625}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 31 and name HB3 ))
4.600 2.700 1.400 peak 2625 spectrum 1 weight 0.10000E+01 volume 0.58980E-03 ppm1 2.131 ppm2 2.869 CV 1
OR { 2625}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 2628}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 53 and name HA ))
3.900 1.900 1.900 peak 2628 spectrum 1 weight 0.10000E+01 volume 0.28321E-02 ppm1 2.221 ppm2 3.997 CV 1
OR { 2628}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 52 and name HA ))
ASSI { 2630}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 52 and name HA ))
3.100 1.200 1.200 peak 2630 spectrum 1 weight 0.10000E+01 volume 0.21909E-02 ppm1 2.127 ppm2 3.999 CV 1
OR { 2630}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 53 and name HA ))
OR { 2630}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 32 and name HA ))
ASSI { 2632}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 54 and name HA ))
3.900 1.900 1.900 peak 2632 spectrum 1 weight 0.10000E+01 volume 0.68707E-03 ppm1 2.123 ppm2 3.704 CV 1
OR { 2632}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 36 and name HA ))
ASSI { 2638}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 30 and name H ))
4.000 2.000 2.000 peak 2638 spectrum 1 weight 0.10000E+01 volume 0.17047E-02 ppm1 2.216 ppm2 7.477 CV 1
OR { 2638}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 55 and name H ))
ASSI { 2640}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 55 and name H ))
3.600 1.600 1.600 peak 2640 spectrum 1 weight 0.10000E+01 volume 0.14739E-02 ppm1 2.140 ppm2 7.474 CV 1
OR { 2640}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 30 and name H ))
ASSI { 2644}
(( segid " " and resid 56 and name HG2 ))
(( segid " " and resid 57 and name H ))
4.000 2.000 2.000 peak 2644 spectrum 1 weight 0.10000E+01 volume 0.20414E-02 ppm1 2.220 ppm2 7.860 CV 1
OR { 2644}
(( segid " " and resid 30 and name HG3 ))
(( segid " " and resid 35 and name H ))
ASSI { 2646}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 35 and name H ))
3.600 1.700 1.700 peak 2646 spectrum 1 weight 0.10000E+01 volume 0.17312E-02 ppm1 2.128 ppm2 7.859 CV 1
OR { 2646}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 57 and name H ))
ASSI { 2656}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 54 and name HD2%)
4.900 3.000 1.100 peak 2656 spectrum 1 weight 0.10000E+01 volume 0.56003E-03 ppm1 3.962 ppm2 0.408 CV 1
OR { 2656}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 54 and name HD1%)
OR { 2656}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 54 and name HD1%)
ASSI { 2658}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 56 and name HB2 ))
3.900 1.900 1.900 peak 2658 spectrum 1 weight 0.10000E+01 volume 0.20939E-02 ppm1 0.823 ppm2 1.710 CV 1
OR { 2658}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 54 and name HG ))
OR { 2658}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 57 and name HB3 ))
ASSI { 2659}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 55 and name HB ))
2.000 0.500 0.500 peak 2659 spectrum 1 weight 0.10000E+01 volume 0.12740E-01 ppm1 0.820 ppm2 2.006 CV 1
OR { 2659}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 74 and name HB ))
ASSI { 2660}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 63 and name HB ))
3.400 1.400 1.400 peak 2660 spectrum 1 weight 0.10000E+01 volume 0.29398E-02 ppm1 0.819 ppm2 2.204 CV 1
OR { 2660}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 56 and name HG2 ))
ASSI { 2663}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 52 and name HB2 ))
4.800 2.900 1.200 peak 2663 spectrum 1 weight 0.10000E+01 volume 0.40781E-03 ppm1 0.821 ppm2 3.238 CV 1
OR { 2663}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 127 and name HD3 ))
ASSI { 2665}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 55 and name HA ))
2.400 0.700 0.700 peak 2665 spectrum 1 weight 0.10000E+01 volume 0.98798E-02 ppm1 0.820 ppm2 3.971 CV 1
OR { 2665}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 52 and name HA ))
OR { 2665}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 62 and name HB2 ))
ASSI { 2667}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 62 and name HA ))
3.000 1.100 1.100 peak 2667 spectrum 1 weight 0.10000E+01 volume 0.15688E-02 ppm1 0.819 ppm2 4.572 CV 1
OR { 2667}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 60 and name HA ))
ASSI { 2670}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 63 and name H ))
3.200 1.300 1.300 peak 2670 spectrum 1 weight 0.10000E+01 volume 0.16407E-02 ppm1 0.821 ppm2 8.647 CV 1
OR { 2670}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 61 and name H ))
ASSI { 2673}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 62 and name H ))
3.100 1.200 1.200 peak 2673 spectrum 1 weight 0.10000E+01 volume 0.19459E-02 ppm1 0.819 ppm2 7.867 CV 1
OR { 2673}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 57 and name H ))
ASSI { 2674}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 65 and name H ))
4.100 2.100 1.900 peak 2674 spectrum 1 weight 0.10000E+01 volume 0.80287E-03 ppm1 0.819 ppm2 7.669 CV 1
OR { 2674}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 59 and name H ))
ASSI { 2676}
( segid " " and resid 55 and name HG1%)
( segid " " and resid 66 and name HE% )
2.900 1.100 1.100 peak 2676 spectrum 1 weight 0.10000E+01 volume 0.20044E-02 ppm1 0.820 ppm2 7.068 CV 1
OR { 2676}
( segid " " and resid 55 and name HG1%)
(( segid " " and resid 60 and name H ))
ASSI { 2679}
(( segid " " and resid 118 and name HA ))
( segid " " and resid 123 and name HD2%)
3.500 1.500 1.500 peak 2679 spectrum 1 weight 0.10000E+01 volume 0.28053E-02 ppm1 3.657 ppm2 0.622 CV 1
OR { 2679}
(( segid " " and resid 118 and name HA ))
( segid " " and resid 121 and name HD2%)
OR { 2679}
(( segid " " and resid 118 and name HA ))
(( segid " " and resid 123 and name HB3 ))
OR { 2679}
(( segid " " and resid 118 and name HA ))
( segid " " and resid 119 and name HD1%)
ASSI { 2681}
(( segid " " and resid 118 and name HA ))
( segid " " and resid 121 and name HD1%)
2.800 1.000 1.000 peak 2681 spectrum 1 weight 0.10000E+01 volume 0.41326E-02 ppm1 3.675 ppm2 0.761 CV 1
OR { 2681}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB2 ))
OR { 2681}
(( segid " " and resid 118 and name HA ))
( segid " " and resid 118 and name HD2%)
OR { 2681}
(( segid " " and resid 118 and name HA ))
( segid " " and resid 123 and name HD1%)
ASSI { 2683}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 57 and name HB2 ))
3.600 1.600 1.600 peak 2683 spectrum 1 weight 0.10000E+01 volume 0.14484E-02 ppm1 3.677 ppm2 2.115 CV 1
OR { 2683}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 57 and name HG3 ))
OR { 2683}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 18 and name HB3 ))
ASSI { 2684}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB3 ))
2.700 0.900 0.900 peak 2684 spectrum 1 weight 0.10000E+01 volume 0.25940E-02 ppm1 3.676 ppm2 1.962 CV 1
OR { 2684}
(( segid " " and resid 54 and name HA ))
( segid " " and resid 57 and name HE% )
OR { 2684}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
ASSI { 2685}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 57 and name HB3 ))
2.700 0.900 0.900 peak 2685 spectrum 1 weight 0.10000E+01 volume 0.22570E-02 ppm1 3.680 ppm2 1.720 CV 1
OR { 2685}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HG ))
ASSI { 2688}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 60 and name HB% )
3.800 1.800 1.800 peak 2688 spectrum 1 weight 0.10000E+01 volume 0.73021E-03 ppm1 0.732 ppm2 1.243 CV 1
OR { 2688}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 2696}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 53 and name HB2 ))
3.600 1.600 1.600 peak 2696 spectrum 1 weight 0.10000E+01 volume 0.13098E-02 ppm1 0.437 ppm2 2.163 CV 1
OR { 2696}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 17 and name HB3 ))
OR { 2696}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 57 and name HB2 ))
OR { 2696}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 57 and name HG3 ))
ASSI { 2699}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 17 and name HG ))
3.600 1.600 1.600 peak 2699 spectrum 1 weight 0.10000E+01 volume 0.21134E-02 ppm1 0.437 ppm2 1.482 CV 1
OR { 2699}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 51 and name HG12))
OR { 2699}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 59 and name HG ))
ASSI { 2700}
( segid " " and resid 54 and name HD1%)
( segid " " and resid 32 and name HG1%)
3.100 1.200 1.200 peak 2700 spectrum 1 weight 0.10000E+01 volume 0.30022E-02 ppm1 0.437 ppm2 1.255 CV 1
OR { 2700}
( segid " " and resid 54 and name HD1%)
( segid " " and resid 60 and name HB% )
OR { 2700}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 59 and name HB2 ))
ASSI { 2701}
( segid " " and resid 54 and name HD1%)
( segid " " and resid 33 and name HG2%)
2.100 0.600 0.600 peak 2701 spectrum 1 weight 0.10000E+01 volume 0.11121E-01 ppm1 0.437 ppm2 0.937 CV 1
OR { 2701}
( segid " " and resid 54 and name HD1%)
( segid " " and resid 50 and name HG2%)
OR { 2701}
( segid " " and resid 54 and name HD1%)
( segid " " and resid 36 and name HG2%)
OR { 2701}
( segid " " and resid 54 and name HD1%)
( segid " " and resid 33 and name HG1%)
ASSI { 2702}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 54 and name HB2 ))
2.300 0.600 0.600 peak 2702 spectrum 1 weight 0.10000E+01 volume 0.73483E-02 ppm1 0.437 ppm2 0.751 CV 1
OR { 2702}
( segid " " and resid 54 and name HD1%)
( segid " " and resid 17 and name HD2%)
ASSI { 2704}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 55 and name HA ))
4.000 2.000 2.000 peak 2704 spectrum 1 weight 0.10000E+01 volume 0.99454E-03 ppm1 0.438 ppm2 3.983 CV 1
OR { 2704}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 52 and name HA ))
OR { 2704}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 63 and name HA ))
ASSI { 2706}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 53 and name HB2 ))
3.700 1.700 1.700 peak 2706 spectrum 1 weight 0.10000E+01 volume 0.18467E-02 ppm1 0.383 ppm2 2.158 CV 1
OR { 2706}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 57 and name HB2 ))
OR { 2706}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 57 and name HG3 ))
ASSI { 2707}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 57 and name HE% )
2.500 0.800 0.800 peak 2707 spectrum 1 weight 0.10000E+01 volume 0.37895E-02 ppm1 0.382 ppm2 1.969 CV 1
OR { 2707}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 54 and name HB3 ))
ASSI { 2708}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 54 and name HG ))
2.300 0.700 0.700 peak 2708 spectrum 1 weight 0.10000E+01 volume 0.48861E-02 ppm1 0.382 ppm2 1.724 CV 1
OR { 2708}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 57 and name HB3 ))
ASSI { 2709}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 17 and name HG ))
2.300 0.700 0.700 peak 2709 spectrum 1 weight 0.10000E+01 volume 0.46478E-02 ppm1 0.383 ppm2 1.477 CV 1
OR { 2709}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 59 and name HG ))
ASSI { 2710}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 59 and name HB2 ))
2.700 0.900 0.900 peak 2710 spectrum 1 weight 0.10000E+01 volume 0.30674E-02 ppm1 0.382 ppm2 1.257 CV 1
OR { 2710}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 60 and name HB% )
ASSI { 2712}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 36 and name HG2%)
2.700 0.900 0.900 peak 2712 spectrum 1 weight 0.10000E+01 volume 0.84258E-02 ppm1 0.382 ppm2 0.943 CV 1
OR { 2712}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 50 and name HG2%)
OR { 2712}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 59 and name HD2%)
OR { 2712}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 22 and name HD2%)
ASSI { 2714}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 17 and name HD2%)
2.400 0.700 0.700 peak 2714 spectrum 1 weight 0.10000E+01 volume 0.10073E-01 ppm1 0.382 ppm2 0.756 CV 1
OR { 2714}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 54 and name HB2 ))
ASSI { 2717}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 53 and name HA ))
3.300 1.400 1.400 peak 2717 spectrum 1 weight 0.10000E+01 volume 0.17359E-02 ppm1 0.383 ppm2 3.984 CV 1
OR { 2717}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 55 and name HA ))
OR { 2717}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 57 and name HA ))
ASSI { 2724}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 56 and name H ))
4.700 2.700 1.300 peak 2724 spectrum 1 weight 0.10000E+01 volume 0.50516E-03 ppm1 0.383 ppm2 8.099 CV 1
OR { 2724}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 53 and name H ))
ASSI { 2727}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 66 and name HE% )
4.300 2.300 1.700 peak 2727 spectrum 1 weight 0.10000E+01 volume 0.99800E-03 ppm1 0.383 ppm2 7.072 CV 1
OR { 2727}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 60 and name H ))
ASSI { 2728}
( segid " " and resid 54 and name HD2%)
( segid " " and resid 21 and name HD% )
2.700 0.900 0.900 peak 2728 spectrum 1 weight 0.10000E+01 volume 0.26755E-02 ppm1 0.383 ppm2 6.899 CV 1
OR { 2728}
( segid " " and resid 54 and name HD2%)
(( segid " " and resid 66 and name HZ ))
ASSI { 2730}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 33 and name H ))
4.800 2.900 1.200 peak 2730 spectrum 1 weight 0.10000E+01 volume 0.29131E-03 ppm1 0.436 ppm2 7.992 CV 1
OR { 2730}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 34 and name H ))
ASSI { 2731}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 57 and name H ))
5.200 3.400 0.800 peak 2731 spectrum 1 weight 0.10000E+01 volume 0.23963E-03 ppm1 0.439 ppm2 7.863 CV 1
OR { 2731}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 62 and name H ))
ASSI { 2732}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 55 and name H ))
4.800 2.800 1.200 peak 2732 spectrum 1 weight 0.10000E+01 volume 0.69734E-03 ppm1 0.438 ppm2 7.492 CV 1
OR { 2732}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 66 and name H ))
ASSI { 2735}
( segid " " and resid 54 and name HD1%)
( segid " " and resid 21 and name HD% )
2.500 0.800 0.800 peak 2735 spectrum 1 weight 0.10000E+01 volume 0.39759E-02 ppm1 0.436 ppm2 6.913 CV 1
OR { 2735}
( segid " " and resid 54 and name HD1%)
(( segid " " and resid 66 and name HZ ))
ASSI { 2736}
(( segid " " and resid 54 and name HG ))
(( segid " " and resid 66 and name HZ ))
4.800 2.900 1.200 peak 2736 spectrum 1 weight 0.10000E+01 volume 0.43530E-03 ppm1 1.723 ppm2 6.916 CV 1
OR { 2736}
(( segid " " and resid 54 and name HG ))
( segid " " and resid 21 and name HD% )
ASSI { 2737}
(( segid " " and resid 20 and name HG ))
(( segid " " and resid 39 and name H ))
4.600 2.600 1.400 peak 2737 spectrum 1 weight 0.10000E+01 volume 0.42283E-03 ppm1 1.712 ppm2 7.494 CV 1
OR { 2737}
(( segid " " and resid 54 and name HG ))
(( segid " " and resid 55 and name H ))
OR { 2737}
(( segid " " and resid 20 and name HG ))
(( segid " " and resid 24 and name HD22))
ASSI { 2739}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 66 and name HE% )
4.600 2.600 1.400 peak 2739 spectrum 1 weight 0.10000E+01 volume 0.24209E-03 ppm1 0.721 ppm2 7.081 CV 1
OR { 2739}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 60 and name H ))
ASSI { 2740}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 21 and name HD% )
3.400 1.400 1.400 peak 2740 spectrum 1 weight 0.10000E+01 volume 0.58658E-03 ppm1 3.683 ppm2 6.903 CV 1
OR { 2740}
(( segid " " and resid 54 and name HA ))
( segid " " and resid 21 and name HD% )
ASSI { 2741}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 60 and name H ))
4.500 2.500 1.500 peak 2741 spectrum 1 weight 0.10000E+01 volume 0.50570E-03 ppm1 3.679 ppm2 7.065 CV 1
OR { 2741}
(( segid " " and resid 54 and name HA ))
( segid " " and resid 66 and name HE% )
OR { 2741}
(( segid " " and resid 118 and name HA ))
( segid " " and resid 88 and name HD% )
ASSI { 2742}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 55 and name H ))
3.900 1.900 1.900 peak 2742 spectrum 1 weight 0.10000E+01 volume 0.44491E-03 ppm1 3.681 ppm2 7.495 CV 1
OR { 2742}
(( segid " " and resid 118 and name HA ))
(( segid " " and resid 117 and name H ))
ASSI { 2744}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 57 and name H ))
3.100 1.200 1.200 peak 2744 spectrum 1 weight 0.10000E+01 volume 0.11252E-02 ppm1 3.683 ppm2 7.868 CV 1
OR { 2744}
(( segid " " and resid 118 and name HA ))
(( segid " " and resid 119 and name H ))
ASSI { 2745}
(( segid " " and resid 118 and name HA ))
(( segid " " and resid 121 and name H ))
3.300 1.400 1.400 peak 2745 spectrum 1 weight 0.10000E+01 volume 0.79997E-03 ppm1 3.668 ppm2 8.132 CV 1
OR { 2745}
(( segid " " and resid 118 and name HA ))
(( segid " " and resid 120 and name H ))
OR { 2745}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 56 and name H ))
ASSI { 2747}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 54 and name HD2%)
4.600 2.700 1.400 peak 2747 spectrum 1 weight 0.10000E+01 volume 0.56521E-03 ppm1 4.020 ppm2 0.414 CV 1
OR { 2747}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 54 and name HD1%)
OR { 2747}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 54 and name HD2%)
ASSI { 2750}
(( segid " " and resid 83 and name HA ))
( segid " " and resid 106 and name HG2%)
4.400 2.500 1.600 peak 2750 spectrum 1 weight 0.10000E+01 volume 0.80956E-03 ppm1 4.024 ppm2 1.319 CV 1
OR { 2750}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 59 and name HB3 ))
OR { 2750}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 25 and name HD3 ))
OR { 2750}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 25 and name HD2 ))
ASSI { 2753}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 9 and name HE1 ))
4.700 2.800 1.300 peak 2753 spectrum 1 weight 0.10000E+01 volume 0.35681E-03 ppm1 2.897 ppm2 9.893 CV 1
OR { 2753}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HE1 ))
ASSI { 2756}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 36 and name HG2%)
5.400 3.600 0.600 peak 2756 spectrum 1 weight 0.10000E+01 volume 0.25966E-03 ppm1 2.890 ppm2 0.974 CV 1
OR { 2756}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 36 and name HD1%)
OR { 2756}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 33 and name HG2%)
OR { 2756}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 59 and name HD2%)
ASSI { 2760}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 92 and name HG3 ))
3.900 1.900 1.900 peak 2760 spectrum 1 weight 0.10000E+01 volume 0.18474E-02 ppm1 2.193 ppm2 1.545 CV 1
OR { 2760}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 45 and name HG2 ))
OR { 2760}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 45 and name HG2 ))
OR { 2760}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 50 and name HG12))
OR { 2760}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 50 and name HG12))
OR { 2760}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 37 and name HB2 ))
OR { 2760}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 92 and name HB2 ))
OR { 2760}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 37 and name HB2 ))
ASSI { 2763}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 8 and name HA ))
5.100 3.200 0.900 peak 2763 spectrum 1 weight 0.10000E+01 volume 0.47892E-03 ppm1 2.883 ppm2 4.235 CV 1
OR { 2763}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 13 and name HA ))
OR { 2763}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 8 and name HA ))
OR { 2763}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 13 and name HA ))
ASSI { 2767}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HD1 ))
3.700 1.700 1.700 peak 2767 spectrum 1 weight 0.10000E+01 volume 0.80156E-03 ppm1 2.894 ppm2 6.953 CV 1
OR { 2767}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HD1 ))
OR { 2767}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 9 and name HZ2 ))
ASSI { 2770}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name H ))
3.700 1.700 1.700 peak 2770 spectrum 1 weight 0.10000E+01 volume 0.72183E-03 ppm1 2.893 ppm2 8.682 CV 1
OR { 2770}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name H ))
OR { 2770}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 14 and name H ))
ASSI { 2772}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 9 and name HZ2 ))
5.200 3.400 0.800 peak 2772 spectrum 1 weight 0.10000E+01 volume 0.31302E-03 ppm1 4.023 ppm2 6.936 CV 1
OR { 2772}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 21 and name HD% )
ASSI { 2774}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HE22))
4.700 2.800 1.300 peak 2774 spectrum 1 weight 0.10000E+01 volume 0.50928E-03 ppm1 2.195 ppm2 7.500 CV 1
OR { 2774}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HE22))
OR { 2774}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 66 and name H ))
ASSI { 2775}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name H ))
3.000 1.200 1.200 peak 2775 spectrum 1 weight 0.10000E+01 volume 0.16689E-02 ppm1 7.070 ppm2 8.216 CV 1
OR { 2775}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 51 and name H ))
ASSI { 2776}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 14 and name H ))
4.000 2.000 2.000 peak 2776 spectrum 1 weight 0.10000E+01 volume 0.54995E-03 ppm1 7.074 ppm2 8.709 CV 1
OR { 2776}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 63 and name H ))
ASSI { 2780}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 48 and name HE3 ))
3.900 1.900 1.900 peak 2780 spectrum 1 weight 0.10000E+01 volume 0.10440E-02 ppm1 7.070 ppm2 2.957 CV 1
OR { 2780}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 51 and name HA ))
ASSI { 2782}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 13 and name HA ))
4.800 2.800 1.200 peak 2782 spectrum 1 weight 0.10000E+01 volume 0.45134E-03 ppm1 7.071 ppm2 4.230 CV 1
OR { 2782}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 42 and name HB ))
ASSI { 2784}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 63 and name HB ))
3.400 1.400 1.400 peak 2784 spectrum 1 weight 0.10000E+01 volume 0.13406E-02 ppm1 7.070 ppm2 2.211 CV 1
OR { 2784}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 17 and name HB3 ))
ASSI { 2785}
(( segid " " and resid 9 and name HE3 ))
(( segid " " and resid 12 and name HB3 ))
4.900 3.000 1.100 peak 2785 spectrum 1 weight 0.10000E+01 volume 0.58922E-03 ppm1 7.071 ppm2 2.008 CV 1
OR { 2785}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 55 and name HB ))
OR { 2785}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 2786}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 47 and name HB3 ))
3.600 1.600 1.600 peak 2786 spectrum 1 weight 0.10000E+01 volume 0.70521E-03 ppm1 7.070 ppm2 1.864 CV 1
OR { 2786}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 69 and name HB2 ))
OR { 2786}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 47 and name HB2 ))
OR { 2786}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 69 and name HB3 ))
OR { 2786}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 56 and name HB3 ))
OR { 2786}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 64 and name HB2 ))
ASSI { 2788}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 48 and name HG3 ))
3.100 1.200 1.200 peak 2788 spectrum 1 weight 0.10000E+01 volume 0.15301E-02 ppm1 7.071 ppm2 1.515 CV 1
OR { 2788}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 51 and name HG12))
ASSI { 2791}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 55 and name HG2%)
3.700 1.800 1.800 peak 2791 spectrum 1 weight 0.10000E+01 volume 0.19386E-02 ppm1 7.070 ppm2 0.777 CV 1
OR { 2791}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 55 and name HG1%)
OR { 2791}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 51 and name HD1%)
ASSI { 2794}
(( segid " " and resid 52 and name HE1 ))
(( segid " " and resid 48 and name HD2 ))
3.700 1.700 1.700 peak 2794 spectrum 1 weight 0.10000E+01 volume 0.61660E-03 ppm1 7.826 ppm2 1.707 CV 1
OR { 2794}
(( segid " " and resid 52 and name HE1 ))
(( segid " " and resid 56 and name HB2 ))
ASSI { 2795}
(( segid " " and resid 52 and name HE1 ))
(( segid " " and resid 63 and name HB ))
4.600 2.700 1.400 peak 2795 spectrum 1 weight 0.10000E+01 volume 0.45380E-03 ppm1 7.824 ppm2 2.230 CV 1
OR { 2795}
(( segid " " and resid 52 and name HE1 ))
(( segid " " and resid 56 and name HG2 ))
ASSI { 2803}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 55 and name HG2%)
4.600 2.700 1.400 peak 2803 spectrum 1 weight 0.10000E+01 volume 0.66826E-03 ppm1 3.244 ppm2 0.779 CV 1
OR { 2803}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 55 and name HG1%)
OR { 2803}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 51 and name HD1%)
OR { 2803}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 17 and name HD2%)
ASSI { 2804}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 50 and name HG2%)
4.300 2.300 1.700 peak 2804 spectrum 1 weight 0.10000E+01 volume 0.89179E-03 ppm1 3.236 ppm2 0.943 CV 1
OR { 2804}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 63 and name HG2%)
OR { 2804}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 33 and name HG2%)
OR { 2804}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 63 and name HG1%)
ASSI { 2807}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 53 and name HB2 ))
4.800 2.900 1.200 peak 2807 spectrum 1 weight 0.10000E+01 volume 0.42200E-03 ppm1 3.236 ppm2 2.213 CV 1
OR { 2807}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 56 and name HG2 ))
ASSI { 2808}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HA ))
2.900 1.100 1.100 peak 2808 spectrum 1 weight 0.10000E+01 volume 0.26293E-02 ppm1 3.240 ppm2 4.019 CV 1
OR { 2808}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 53 and name HA ))
ASSI { 2811}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name H ))
2.900 1.100 1.100 peak 2811 spectrum 1 weight 0.10000E+01 volume 0.16475E-02 ppm1 2.976 ppm2 8.215 CV 1
OR { 2811}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name H ))
ASSI { 2814}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HD1%)
2.800 1.000 1.000 peak 2814 spectrum 1 weight 0.10000E+01 volume 0.28725E-02 ppm1 2.976 ppm2 0.766 CV 1
OR { 2814}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 54 and name HB2 ))
ASSI { 2816}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 33 and name HG2%)
2.900 1.100 1.100 peak 2816 spectrum 1 weight 0.10000E+01 volume 0.24209E-02 ppm1 2.977 ppm2 0.939 CV 1
OR { 2816}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 50 and name HG2%)
OR { 2816}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 33 and name HG1%)
ASSI { 2820}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 50 and name HB ))
4.500 2.600 1.500 peak 2820 spectrum 1 weight 0.10000E+01 volume 0.32619E-03 ppm1 2.966 ppm2 2.175 CV 1
OR { 2820}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 53 and name HB2 ))
OR { 2820}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 63 and name HB ))
OR { 2820}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 67 and name HB3 ))
ASSI { 2825}
(( segid " " and resid 51 and name HB ))
( segid " " and resid 33 and name HG2%)
4.600 2.700 1.400 peak 2825 spectrum 1 weight 0.10000E+01 volume 0.58656E-03 ppm1 1.617 ppm2 0.943 CV 1
OR { 2825}
(( segid " " and resid 51 and name HB ))
( segid " " and resid 63 and name HG2%)
OR { 2825}
(( segid " " and resid 51 and name HB ))
( segid " " and resid 33 and name HG1%)
ASSI { 2837}
( segid " " and resid 51 and name HG2%)
( segid " " and resid 55 and name HG1%)
2.300 0.700 0.700 peak 2837 spectrum 1 weight 0.10000E+01 volume 0.22040E-01 ppm1 0.660 ppm2 0.773 CV 1
OR { 2837}
( segid " " and resid 51 and name HG2%)
( segid " " and resid 51 and name HD1%)
ASSI { 2841}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 54 and name HB3 ))
3.800 1.800 1.800 peak 2841 spectrum 1 weight 0.10000E+01 volume 0.16873E-02 ppm1 0.659 ppm2 1.890 CV 1
OR { 2841}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 47 and name HB2 ))
OR { 2841}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 47 and name HB3 ))
OR { 2841}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 37 and name HB3 ))
ASSI { 2844}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 48 and name HG2 ))
3.800 1.800 1.800 peak 2844 spectrum 1 weight 0.10000E+01 volume 0.17327E-02 ppm1 0.659 ppm2 1.314 CV 1
OR { 2844}
( segid " " and resid 51 and name HG2%)
( segid " " and resid 32 and name HG1%)
ASSI { 2846}
( segid " " and resid 51 and name HG2%)
( segid " " and resid 63 and name HG2%)
2.200 0.600 0.600 peak 2846 spectrum 1 weight 0.10000E+01 volume 0.16201E-01 ppm1 0.660 ppm2 0.946 CV 1
OR { 2846}
( segid " " and resid 51 and name HG2%)
( segid " " and resid 63 and name HG1%)
OR { 2846}
( segid " " and resid 51 and name HG2%)
( segid " " and resid 33 and name HG2%)
ASSI { 2852}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 50 and name HA ))
4.300 2.300 1.700 peak 2852 spectrum 1 weight 0.10000E+01 volume 0.97935E-03 ppm1 0.660 ppm2 3.772 CV 1
OR { 2852}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 62 and name HB3 ))
OR { 2852}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 47 and name HA ))
ASSI { 2853}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 62 and name HA ))
5.000 3.200 1.000 peak 2853 spectrum 1 weight 0.10000E+01 volume 0.36529E-03 ppm1 0.657 ppm2 4.571 CV 1
OR { 2853}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 66 and name HA ))
ASSI { 2859}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 47 and name HD3 ))
2.400 2.400 3.600 peak 2859 spectrum 1 weight 0.10000E+01 volume 0.11690E-02 ppm1 0.765 ppm2 3.235 CV 1
OR { 2859}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 47 and name HD2 ))
OR { 2859}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 52 and name HB2 ))
ASSI { 2862}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 50 and name HB ))
3.000 1.100 1.100 peak 2862 spectrum 1 weight 0.10000E+01 volume 0.20811E-02 ppm1 0.764 ppm2 2.201 CV 1
OR { 2862}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 67 and name HB3 ))
ASSI { 2863}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 47 and name HB2 ))
3.000 1.100 1.100 peak 2863 spectrum 1 weight 0.10000E+01 volume 0.25177E-02 ppm1 0.765 ppm2 1.863 CV 1
OR { 2863}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 37 and name HB3 ))
OR { 2863}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 47 and name HB3 ))
ASSI { 2868}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 66 and name HE% )
4.300 2.300 1.700 peak 2868 spectrum 1 weight 0.10000E+01 volume 0.32699E-03 ppm1 2.976 ppm2 7.092 CV 1
OR { 2868}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name HD2 ))
ASSI { 2869}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 52 and name HD2 ))
4.200 2.200 1.800 peak 2869 spectrum 1 weight 0.10000E+01 volume 0.31702E-03 ppm1 1.618 ppm2 7.069 CV 1
OR { 2869}
(( segid " " and resid 51 and name HB ))
( segid " " and resid 66 and name HE% )
ASSI { 2870}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 51 and name H ))
2.500 0.800 0.800 peak 2870 spectrum 1 weight 0.10000E+01 volume 0.23310E-02 ppm1 1.622 ppm2 8.214 CV 1
OR { 2870}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 52 and name H ))
ASSI { 2871}
(( segid " " and resid 51 and name HG12))
(( segid " " and resid 51 and name H ))
4.100 2.100 1.900 peak 2871 spectrum 1 weight 0.10000E+01 volume 0.12972E-02 ppm1 1.498 ppm2 8.211 CV 1
OR { 2871}
(( segid " " and resid 51 and name HG12))
(( segid " " and resid 52 and name H ))
ASSI { 2872}
(( segid " " and resid 90 and name HB3 ))
( segid " " and resid 91 and name HD% )
4.100 2.100 1.900 peak 2872 spectrum 1 weight 0.10000E+01 volume 0.76030E-03 ppm1 1.492 ppm2 7.092 CV 1
OR { 2872}
(( segid " " and resid 51 and name HG12))
( segid " " and resid 66 and name HE% )
OR { 2872}
(( segid " " and resid 51 and name HG12))
(( segid " " and resid 52 and name HD2 ))
ASSI { 2873}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 67 and name H ))
4.600 2.600 1.400 peak 2873 spectrum 1 weight 0.10000E+01 volume 0.56799E-03 ppm1 0.658 ppm2 7.844 CV 1
OR { 2873}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 52 and name HE1 ))
ASSI { 2874}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 65 and name H ))
4.600 2.700 1.400 peak 2874 spectrum 1 weight 0.10000E+01 volume 0.41378E-03 ppm1 0.658 ppm2 7.703 CV 1
OR { 2874}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 49 and name H ))
ASSI { 2875}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 66 and name H ))
3.800 1.800 1.800 peak 2875 spectrum 1 weight 0.10000E+01 volume 0.12279E-02 ppm1 0.660 ppm2 7.502 CV 1
OR { 2875}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 55 and name H ))
ASSI { 2878}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 52 and name HD2 ))
2.500 0.800 0.800 peak 2878 spectrum 1 weight 0.10000E+01 volume 0.34523E-02 ppm1 0.660 ppm2 7.080 CV 1
OR { 2878}
( segid " " and resid 51 and name HG2%)
( segid " " and resid 66 and name HE% )
ASSI { 2879}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 66 and name HZ ))
3.700 1.800 1.800 peak 2879 spectrum 1 weight 0.10000E+01 volume 0.10523E-02 ppm1 0.659 ppm2 6.942 CV 1
OR { 2879}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 67 and name HE22))
ASSI { 2880}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 52 and name H ))
2.800 1.000 1.000 peak 2880 spectrum 1 weight 0.10000E+01 volume 0.54632E-02 ppm1 0.660 ppm2 8.216 CV 1
OR { 2880}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 51 and name H ))
ASSI { 2883}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 34 and name H ))
4.800 2.900 1.200 peak 2883 spectrum 1 weight 0.10000E+01 volume 0.48724E-03 ppm1 0.762 ppm2 7.985 CV 1
OR { 2883}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 33 and name H ))
ASSI { 2885}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 49 and name H ))
3.200 1.300 1.300 peak 2885 spectrum 1 weight 0.10000E+01 volume 0.43820E-03 ppm1 0.767 ppm2 7.721 CV 1
OR { 2885}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 65 and name H ))
ASSI { 2888}
( segid " " and resid 51 and name HD1%)
( segid " " and resid 66 and name HE% )
4.200 2.200 1.800 peak 2888 spectrum 1 weight 0.10000E+01 volume 0.13952E-02 ppm1 0.765 ppm2 7.081 CV 1
OR { 2888}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 52 and name HD2 ))
ASSI { 2897}
(( segid " " and resid 51 and name HG13))
(( segid " " and resid 51 and name H ))
4.100 2.100 1.900 peak 2897 spectrum 1 weight 0.10000E+01 volume 0.73310E-03 ppm1 0.090 ppm2 8.213 CV 1
OR { 2897}
(( segid " " and resid 51 and name HG13))
(( segid " " and resid 52 and name H ))
ASSI { 2901}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name H ))
2.800 1.000 1.000 peak 2901 spectrum 1 weight 0.10000E+01 volume 0.20813E-02 ppm1 3.782 ppm2 8.205 CV 1
OR { 2901}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 51 and name H ))
ASSI { 2906}
(( segid " " and resid 50 and name HG12))
( segid " " and resid 50 and name HD1%)
2.000 0.500 0.500 peak 2906 spectrum 1 weight 0.10000E+01 volume 0.10433E-01 ppm1 1.555 ppm2 0.928 CV 1
OR { 2906}
(( segid " " and resid 50 and name HG13))
( segid " " and resid 50 and name HD1%)
OR { 2906}
(( segid " " and resid 50 and name HG12))
( segid " " and resid 50 and name HG2%)
OR { 2906}
(( segid " " and resid 50 and name HG13))
( segid " " and resid 50 and name HG2%)
OR { 2906}
(( segid " " and resid 127 and name HG3 ))
( segid " " and resid 115 and name HG2%)
ASSI { 2907}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 50 and name HB ))
2.800 1.000 1.000 peak 2907 spectrum 1 weight 0.10000E+01 volume 0.26748E-02 ppm1 1.568 ppm2 2.177 CV 1
OR { 2907}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 50 and name HB ))
OR { 2907}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 97 and name HB ))
OR { 2907}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 53 and name HB2 ))
OR { 2907}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 17 and name HB3 ))
OR { 2907}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 49 and name HB3 ))
OR { 2907}
(( segid " " and resid 127 and name HG3 ))
(( segid " " and resid 115 and name HB ))
OR { 2907}
(( segid " " and resid 103 and name HD3 ))
(( segid " " and resid 102 and name HB3 ))
OR { 2907}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 49 and name HB3 ))
ASSI { 2909}
(( segid " " and resid 127 and name HG3 ))
(( segid " " and resid 127 and name HD3 ))
2.500 0.800 0.800 peak 2909 spectrum 1 weight 0.10000E+01 volume 0.30370E-02 ppm1 1.554 ppm2 3.265 CV 1
OR { 2909}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 47 and name HD3 ))
OR { 2909}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 47 and name HD2 ))
ASSI { 2910}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 47 and name HA ))
3.200 1.300 1.300 peak 2910 spectrum 1 weight 0.10000E+01 volume 0.27013E-02 ppm1 1.549 ppm2 3.754 CV 1
OR { 2910}
(( segid " " and resid 127 and name HG3 ))
(( segid " " and resid 127 and name HA ))
OR { 2910}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 50 and name HA ))
ASSI { 2913}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 50 and name HG13))
2.200 0.600 0.600 peak 2913 spectrum 1 weight 0.10000E+01 volume 0.84615E-02 ppm1 0.914 ppm2 1.626 CV 1
OR { 2913}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 37 and name HG ))
ASSI { 2914}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 50 and name HB ))
2.000 0.500 0.500 peak 2914 spectrum 1 weight 0.10000E+01 volume 0.74471E-02 ppm1 0.915 ppm2 2.180 CV 1
OR { 2914}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 17 and name HB3 ))
ASSI { 2915}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 49 and name HG2 ))
4.400 2.400 1.600 peak 2915 spectrum 1 weight 0.10000E+01 volume 0.63871E-03 ppm1 0.922 ppm2 2.556 CV 1
OR { 2915}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 89 and name HG3 ))
ASSI { 2917}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 50 and name HA ))
2.500 0.800 0.800 peak 2917 spectrum 1 weight 0.10000E+01 volume 0.47485E-02 ppm1 0.914 ppm2 3.774 CV 1
OR { 2917}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 47 and name HA ))
ASSI { 2921}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 13 and name HG3 ))
2.300 2.300 3.700 peak 2921 spectrum 1 weight 0.10000E+01 volume 0.10547E-02 ppm1 0.890 ppm2 2.436 CV 1
OR { 2921}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 13 and name HG2 ))
OR { 2921}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 14 and name HB2 ))
OR { 2921}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 34 and name HG2 ))
OR { 2921}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 13 and name HB3 ))
OR { 2921}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 13 and name HB2 ))
ASSI { 2922}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 45 and name HD2 ))
3.500 1.500 1.500 peak 2922 spectrum 1 weight 0.10000E+01 volume 0.20854E-02 ppm1 0.892 ppm2 2.308 CV 1
OR { 2922}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 49 and name HG3 ))
ASSI { 2923}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 50 and name HB ))
2.400 0.700 0.700 peak 2923 spectrum 1 weight 0.10000E+01 volume 0.47775E-02 ppm1 0.891 ppm2 2.188 CV 1
OR { 2923}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 49 and name HB3 ))
OR { 2923}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 49 and name HB2 ))
ASSI { 2925}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 50 and name HG13))
2.000 0.500 0.500 peak 2925 spectrum 1 weight 0.10000E+01 volume 0.12623E-01 ppm1 0.890 ppm2 1.628 CV 1
OR { 2925}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 45 and name HB2 ))
ASSI { 2926}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 50 and name HG12))
2.000 0.500 0.500 peak 2926 spectrum 1 weight 0.10000E+01 volume 0.11792E-01 ppm1 0.890 ppm2 1.566 CV 1
OR { 2926}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 50 and name HG13))
OR { 2926}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 37 and name HB2 ))
ASSI { 2928}
( segid " " and resid 50 and name HD1%)
( segid " " and resid 42 and name HG2%)
2.100 2.100 3.900 peak 2928 spectrum 1 weight 0.10000E+01 volume 0.21993E-02 ppm1 0.889 ppm2 1.245 CV 1
OR { 2928}
( segid " " and resid 50 and name HD1%)
( segid " " and resid 46 and name HG2%)
ASSI { 2929}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 51 and name HA ))
2.600 2.600 3.400 peak 2929 spectrum 1 weight 0.10000E+01 volume 0.50368E-03 ppm1 0.892 ppm2 2.977 CV 1
OR { 2929}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 48 and name HE2 ))
ASSI { 2938}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 38 and name H ))
3.000 3.000 3.000 peak 2938 spectrum 1 weight 0.10000E+01 volume 0.25095E-03 ppm1 0.888 ppm2 7.566 CV 1
OR { 2938}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 39 and name H ))
ASSI { 2942}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 43 and name H ))
2.700 2.700 3.300 peak 2942 spectrum 1 weight 0.10000E+01 volume 0.46582E-03 ppm1 0.888 ppm2 7.998 CV 1
OR { 2942}
( segid " " and resid 50 and name HD1%)
(( segid " " and resid 53 and name HE1 ))
ASSI { 2944}
( segid " " and resid 50 and name HG2%)
( segid " " and resid 66 and name HE% )
4.800 2.900 1.200 peak 2944 spectrum 1 weight 0.10000E+01 volume 0.38978E-03 ppm1 0.884 ppm2 7.072 CV 1
OR { 2944}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 45 and name HE ))
ASSI { 2945}
(( segid " " and resid 50 and name HB ))
(( segid " " and resid 50 and name H ))
2.300 0.700 0.700 peak 2945 spectrum 1 weight 0.10000E+01 volume 0.26387E-02 ppm1 2.184 ppm2 8.205 CV 1
OR { 2945}
(( segid " " and resid 50 and name HB ))
(( segid " " and resid 51 and name H ))
ASSI { 2947}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 50 and name H ))
3.800 1.800 1.800 peak 2947 spectrum 1 weight 0.10000E+01 volume 0.13983E-02 ppm1 1.549 ppm2 8.198 CV 1
OR { 2947}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 51 and name H ))
ASSI { 2948}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 37 and name H ))
4.100 2.100 1.900 peak 2948 spectrum 1 weight 0.10000E+01 volume 0.55728E-03 ppm1 1.564 ppm2 8.591 CV 1
OR { 2948}
(( segid " " and resid 127 and name HG3 ))
(( segid " " and resid 128 and name H ))
OR { 2948}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 37 and name H ))
OR { 2948}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 97 and name H ))
ASSI { 2950}
(( segid " " and resid 127 and name HG3 ))
(( segid " " and resid 127 and name H ))
3.700 1.700 1.700 peak 2950 spectrum 1 weight 0.10000E+01 volume 0.35971E-03 ppm1 1.558 ppm2 9.023 CV 1
OR { 2950}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 47 and name H ))
ASSI { 2951}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 91 and name H ))
4.400 2.400 1.600 peak 2951 spectrum 1 weight 0.10000E+01 volume 0.10452E-02 ppm1 1.562 ppm2 7.763 CV 1
OR { 2951}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 49 and name H ))
OR { 2951}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 49 and name H ))
OR { 2951}
(( segid " " and resid 127 and name HG3 ))
(( segid " " and resid 130 and name H ))
OR { 2951}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 49 and name H ))
ASSI { 2952}
(( segid " " and resid 50 and name HG13))
(( segid " " and resid 45 and name HE ))
4.200 2.200 1.800 peak 2952 spectrum 1 weight 0.10000E+01 volume 0.44270E-03 ppm1 1.564 ppm2 7.120 CV 1
OR { 2952}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 88 and name HZ ))
OR { 2952}
(( segid " " and resid 50 and name HG12))
(( segid " " and resid 45 and name HE ))
OR { 2952}
(( segid " " and resid 127 and name HG3 ))
( segid " " and resid 131 and name HD% )
ASSI { 2953}
( segid " " and resid 50 and name HG2%)
( segid " " and resid 21 and name HD% )
4.100 2.100 1.900 peak 2953 spectrum 1 weight 0.10000E+01 volume 0.15899E-02 ppm1 0.915 ppm2 6.912 CV 1
OR { 2953}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 9 and name HZ2 ))
OR { 2953}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 66 and name HZ ))
ASSI { 2954}
( segid " " and resid 114 and name HG2%)
( segid " " and resid 88 and name HD% )
3.900 1.900 1.900 peak 2954 spectrum 1 weight 0.10000E+01 volume 0.10977E-02 ppm1 0.917 ppm2 7.079 CV 1
OR { 2954}
( segid " " and resid 50 and name HG2%)
( segid " " and resid 66 and name HE% )
OR { 2954}
( segid " " and resid 114 and name HG2%)
(( segid " " and resid 76 and name HZ2 ))
OR { 2954}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 45 and name HE ))
ASSI { 2956}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 55 and name H ))
4.400 2.400 1.600 peak 2956 spectrum 1 weight 0.10000E+01 volume 0.52152E-03 ppm1 0.916 ppm2 7.491 CV 1
OR { 2956}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 66 and name H ))
ASSI { 2957}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 49 and name H ))
4.800 2.800 1.200 peak 2957 spectrum 1 weight 0.10000E+01 volume 0.45925E-03 ppm1 0.910 ppm2 7.703 CV 1
OR { 2957}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 59 and name H ))
ASSI { 2958}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 33 and name H ))
4.100 2.100 1.900 peak 2958 spectrum 1 weight 0.10000E+01 volume 0.10946E-02 ppm1 0.920 ppm2 7.989 CV 1
OR { 2958}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 34 and name H ))
ASSI { 2959}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 51 and name H ))
2.800 1.000 1.000 peak 2959 spectrum 1 weight 0.10000E+01 volume 0.42230E-02 ppm1 0.914 ppm2 8.207 CV 1
OR { 2959}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 50 and name H ))
ASSI { 2968}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 52 and name HB2 ))
4.200 2.300 1.800 peak 2968 spectrum 1 weight 0.10000E+01 volume 0.73729E-03 ppm1 2.200 ppm2 3.244 CV 1
OR { 2968}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 52 and name HB2 ))
OR { 2968}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 88 and name HB3 ))
OR { 2968}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 68 and name HD2 ))
ASSI { 2969}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 52 and name HB3 ))
4.900 3.000 1.100 peak 2969 spectrum 1 weight 0.10000E+01 volume 0.54277E-03 ppm1 2.208 ppm2 3.167 CV 1
OR { 2969}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 88 and name HB3 ))
OR { 2969}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 52 and name HB3 ))
ASSI { 2970}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HA ))
2.600 0.800 0.800 peak 2970 spectrum 1 weight 0.10000E+01 volume 0.53267E-02 ppm1 2.226 ppm2 4.015 CV 1
OR { 2970}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HA ))
ASSI { 2978}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 46 and name H ))
3.400 1.500 1.500 peak 2978 spectrum 1 weight 0.10000E+01 volume 0.94140E-03 ppm1 2.571 ppm2 7.707 CV 1
OR { 2978}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 49 and name H ))
ASSI { 2979}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 50 and name H ))
4.700 2.800 1.300 peak 2979 spectrum 1 weight 0.10000E+01 volume 0.33829E-03 ppm1 2.550 ppm2 8.197 CV 1
OR { 2979}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 52 and name H ))
ASSI { 2981}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name H ))
2.300 0.700 0.700 peak 2981 spectrum 1 weight 0.10000E+01 volume 0.47911E-02 ppm1 2.228 ppm2 7.985 CV 1
OR { 2981}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name H ))
ASSI { 2982}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 48 and name H ))
3.800 1.800 1.800 peak 2982 spectrum 1 weight 0.10000E+01 volume 0.14577E-02 ppm1 2.227 ppm2 8.303 CV 1
OR { 2982}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 48 and name H ))
OR { 2982}
(( segid " " and resid 36 and name HG12))
(( segid " " and resid 18 and name H ))
ASSI { 2985}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 52 and name H ))
3.100 1.200 1.200 peak 2985 spectrum 1 weight 0.10000E+01 volume 0.21164E-02 ppm1 4.211 ppm2 8.209 CV 1
OR { 2985}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name H ))
ASSI { 2987}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HE21))
4.700 2.800 1.300 peak 2987 spectrum 1 weight 0.10000E+01 volume 0.30708E-03 ppm1 4.207 ppm2 7.067 CV 1
OR { 2987}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 52 and name HD2 ))
OR { 2987}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 45 and name HE ))
ASSI { 2988}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 51 and name HD1%)
2.600 0.800 0.800 peak 2988 spectrum 1 weight 0.10000E+01 volume 0.38569E-02 ppm1 3.882 ppm2 0.775 CV 1
OR { 2988}
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ASSI { 2989}
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3.600 1.600 1.600 peak 2989 spectrum 1 weight 0.10000E+01 volume 0.36611E-02 ppm1 3.862 ppm2 1.326 CV 1
OR { 2989}
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OR { 2989}
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ASSI { 2990}
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2.700 0.900 0.900 peak 2990 spectrum 1 weight 0.10000E+01 volume 0.42755E-02 ppm1 3.886 ppm2 1.515 CV 1
OR { 2990}
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ASSI { 2992}
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2.800 0.900 0.900 peak 2992 spectrum 1 weight 0.10000E+01 volume 0.48588E-02 ppm1 3.886 ppm2 1.867 CV 1
OR { 2992}
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ASSI { 2995}
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1.900 0.400 0.400 peak 2995 spectrum 1 weight 0.10000E+01 volume 0.31729E-01 ppm1 1.873 ppm2 1.487 CV 1
OR { 2995}
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ASSI { 2999}
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3.700 1.700 1.700 peak 2999 spectrum 1 weight 0.10000E+01 volume 0.12545E-02 ppm1 1.872 ppm2 3.226 CV 1
OR { 2999}
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OR { 2999}
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ASSI { 3001}
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2.300 0.600 0.600 peak 3001 spectrum 1 weight 0.10000E+01 volume 0.11006E-01 ppm1 1.875 ppm2 4.382 CV 1
OR { 3001}
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ASSI { 3007}
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4.300 2.300 1.700 peak 3007 spectrum 1 weight 0.10000E+01 volume 0.48016E-03 ppm1 1.338 ppm2 2.209 CV 1
OR { 3007}
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OR { 3007}
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(( segid " " and resid 63 and name HB ))
ASSI { 3011}
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4.000 2.000 2.000 peak 3011 spectrum 1 weight 0.10000E+01 volume 0.12781E-02 ppm1 1.336 ppm2 0.778 CV 1
OR { 3011}
(( segid " " and resid 48 and name HG2 ))
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ASSI { 3013}
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4.200 2.200 1.800 peak 3013 spectrum 1 weight 0.10000E+01 volume 0.87066E-03 ppm1 1.873 ppm2 8.221 CV 1
OR { 3013}
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ASSI { 3018}
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3.800 1.800 1.800 peak 3018 spectrum 1 weight 0.10000E+01 volume 0.70100E-03 ppm1 1.334 ppm2 8.217 CV 1
OR { 3018}
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(( segid " " and resid 48 and name HG2 ))
(( segid " " and resid 50 and name H ))
ASSI { 3019}
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4.000 2.000 2.000 peak 3019 spectrum 1 weight 0.10000E+01 volume 0.74801E-03 ppm1 1.514 ppm2 8.220 CV 1
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ASSI { 3020}
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3.700 1.700 1.700 peak 3020 spectrum 1 weight 0.10000E+01 volume 0.96315E-03 ppm1 1.699 ppm2 7.818 CV 1
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OR { 3020}
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ASSI { 3021}
(( segid " " and resid 48 and name HD2 ))
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4.400 2.400 1.600 peak 3021 spectrum 1 weight 0.10000E+01 volume 0.89209E-03 ppm1 1.687 ppm2 8.227 CV 1
OR { 3021}
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OR { 3021}
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(( segid " " and resid 51 and name H ))
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OR { 3021}
(( segid " " and resid 48 and name HD3 ))
(( segid " " and resid 50 and name H ))
ASSI { 3022}
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(( segid " " and resid 127 and name HA ))
2.500 0.800 0.800 peak 3022 spectrum 1 weight 0.10000E+01 volume 0.26280E-02 ppm1 1.702 ppm2 3.746 CV 1
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(( segid " " and resid 47 and name HA ))
ASSI { 3023}
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2.300 0.700 0.700 peak 3023 spectrum 1 weight 0.10000E+01 volume 0.79766E-02 ppm1 3.739 ppm2 0.948 CV 1
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OR { 3023}
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OR { 3023}
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( segid " " and resid 36 and name HD1%)
OR { 3023}
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( segid " " and resid 22 and name HD2%)
OR { 3023}
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( segid " " and resid 59 and name HD2%)
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( segid " " and resid 33 and name HG2%)
ASSI { 3024}
(( segid " " and resid 47 and name HA ))
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2.200 0.600 0.600 peak 3024 spectrum 1 weight 0.10000E+01 volume 0.60317E-02 ppm1 3.740 ppm2 0.828 CV 1
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( segid " " and resid 59 and name HD1%)
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ASSI { 3025}
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2.300 0.700 0.700 peak 3025 spectrum 1 weight 0.10000E+01 volume 0.55222E-02 ppm1 3.741 ppm2 1.860 CV 1
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(( segid " " and resid 127 and name HB3 ))
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(( segid " " and resid 127 and name HA ))
(( segid " " and resid 127 and name HB2 ))
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(( segid " " and resid 47 and name HB3 ))
ASSI { 3026}
(( segid " " and resid 127 and name HA ))
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2.500 0.800 0.800 peak 3026 spectrum 1 weight 0.10000E+01 volume 0.37262E-02 ppm1 3.738 ppm2 1.696 CV 1
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(( segid " " and resid 47 and name HG3 ))
OR { 3026}
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(( segid " " and resid 18 and name HG3 ))
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(( segid " " and resid 37 and name HG ))
ASSI { 3027}
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( segid " " and resid 115 and name HG1%)
3.000 1.100 1.100 peak 3027 spectrum 1 weight 0.10000E+01 volume 0.16939E-02 ppm1 1.875 ppm2 1.158 CV 1
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( segid " " and resid 115 and name HG1%)
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ASSI { 3028}
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(( segid " " and resid 68 and name HG2 ))
1.700 0.300 0.500 peak 3028 spectrum 1 weight 0.10000E+01 volume 0.66078E-01 ppm1 1.833 ppm2 1.641 CV 1
OR { 3028}
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(( segid " " and resid 68 and name HG2 ))
OR { 3028}
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(( segid " " and resid 68 and name HG3 ))
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(( segid " " and resid 68 and name HG3 ))
OR { 3028}
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ASSI { 3030}
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2.400 0.700 0.700 peak 3030 spectrum 1 weight 0.10000E+01 volume 0.56859E-02 ppm1 1.742 ppm2 0.948 CV 1
OR { 3030}
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( segid " " and resid 130 and name HD2%)
OR { 3030}
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( segid " " and resid 130 and name HD1%)
OR { 3030}
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ASSI { 3031}
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2.900 1.100 1.100 peak 3031 spectrum 1 weight 0.10000E+01 volume 0.30487E-02 ppm1 1.738 ppm2 0.806 CV 1
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OR { 3031}
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ASSI { 3032}
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(( segid " " and resid 127 and name HA ))
2.600 0.900 0.900 peak 3032 spectrum 1 weight 0.10000E+01 volume 0.26139E-02 ppm1 1.752 ppm2 3.748 CV 1
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(( segid " " and resid 90 and name HA ))
OR { 3032}
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ASSI { 3033}
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2.900 1.000 1.000 peak 3033 spectrum 1 weight 0.10000E+01 volume 0.32716E-02 ppm1 3.202 ppm2 2.229 CV 1
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OR { 3033}
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OR { 3033}
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ASSI { 3034}
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3.000 1.100 1.100 peak 3034 spectrum 1 weight 0.10000E+01 volume 0.35823E-02 ppm1 3.211 ppm2 2.178 CV 1
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OR { 3034}
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OR { 3034}
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OR { 3034}
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OR { 3034}
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( segid " " and resid 102 and name HE% )
OR { 3034}
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ASSI { 3035}
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2.900 1.100 1.100 peak 3035 spectrum 1 weight 0.10000E+01 volume 0.44263E-02 ppm1 3.203 ppm2 4.315 CV 1
OR { 3035}
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(( segid " " and resid 134 and name HA ))
OR { 3035}
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OR { 3035}
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OR { 3035}
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OR { 3035}
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ASSI { 3036}
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3.700 1.700 1.700 peak 3036 spectrum 1 weight 0.10000E+01 volume 0.10740E-02 ppm1 1.817 ppm2 7.985 CV 1
OR { 3036}
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(( segid " " and resid 84 and name H ))
ASSI { 3038}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 50 and name HD1%)
3.700 1.700 1.700 peak 3038 spectrum 1 weight 0.10000E+01 volume 0.18209E-02 ppm1 4.598 ppm2 0.841 CV 1
OR { 3038}
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( segid " " and resid 37 and name HD2%)
ASSI { 3040}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 45 and name HB2 ))
4.100 2.100 1.900 peak 3040 spectrum 1 weight 0.10000E+01 volume 0.92731E-03 ppm1 4.595 ppm2 1.700 CV 1
OR { 3040}
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(( segid " " and resid 47 and name HG3 ))
OR { 3040}
(( segid " " and resid 46 and name HA ))
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ASSI { 3041}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 47 and name HB3 ))
4.500 2.500 1.500 peak 3041 spectrum 1 weight 0.10000E+01 volume 0.92887E-03 ppm1 4.597 ppm2 1.884 CV 1
OR { 3041}
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(( segid " " and resid 47 and name HB2 ))
OR { 3041}
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(( segid " " and resid 48 and name HB3 ))
ASSI { 3044}
(( segid " " and resid 46 and name HB ))
(( segid " " and resid 45 and name HG2 ))
4.600 2.600 1.400 peak 3044 spectrum 1 weight 0.10000E+01 volume 0.81899E-03 ppm1 4.727 ppm2 1.481 CV 1
OR { 3044}
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ASSI { 3045}
(( segid " " and resid 46 and name HB ))
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3.900 1.900 1.900 peak 3045 spectrum 1 weight 0.10000E+01 volume 0.17901E-02 ppm1 4.727 ppm2 1.666 CV 1
OR { 3045}
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(( segid " " and resid 48 and name HD3 ))
OR { 3045}
(( segid " " and resid 46 and name HB ))
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ASSI { 3046}
(( segid " " and resid 46 and name HB ))
(( segid " " and resid 48 and name HB3 ))
4.100 2.100 1.900 peak 3046 spectrum 1 weight 0.10000E+01 volume 0.99382E-03 ppm1 4.721 ppm2 1.870 CV 1
OR { 3046}
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(( segid " " and resid 47 and name HB3 ))
OR { 3046}
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(( segid " " and resid 47 and name HB2 ))
ASSI { 3048}
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(( segid " " and resid 80 and name HB3 ))
3.100 1.200 1.200 peak 3048 spectrum 1 weight 0.10000E+01 volume 0.24163E-02 ppm1 1.220 ppm2 2.557 CV 1
OR { 3048}
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(( segid " " and resid 49 and name HG2 ))
ASSI { 3050}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 46 and name HB ))
3.000 1.200 1.200 peak 3050 spectrum 1 weight 0.10000E+01 volume 0.18048E-02 ppm1 1.219 ppm2 4.691 CV 1
OR { 3050}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 77 and name HB ))
ASSI { 3051}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 77 and name HA ))
3.300 1.400 1.400 peak 3051 spectrum 1 weight 0.10000E+01 volume 0.22622E-02 ppm1 1.217 ppm2 4.613 CV 1
OR { 3051}
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(( segid " " and resid 46 and name HA ))
ASSI { 3056}
( segid " " and resid 46 and name HG2%)
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3.700 1.700 1.700 peak 3056 spectrum 1 weight 0.10000E+01 volume 0.15121E-02 ppm1 1.220 ppm2 7.454 CV 1
OR { 3056}
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(( segid " " and resid 80 and name HE21))
ASSI { 3057}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 46 and name H ))
2.700 0.900 0.900 peak 3057 spectrum 1 weight 0.10000E+01 volume 0.32419E-02 ppm1 1.216 ppm2 7.681 CV 1
OR { 3057}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 49 and name H ))
ASSI { 3066}
(( segid " " and resid 45 and name HD2 ))
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2.300 2.300 3.700 peak 3066 spectrum 1 weight 0.10000E+01 volume 0.13712E-02 ppm1 2.301 ppm2 2.436 CV 1
OR { 3066}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 13 and name HG2 ))
OR { 3066}
(( segid " " and resid 45 and name HD2 ))
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OR { 3066}
(( segid " " and resid 45 and name HD2 ))
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ASSI { 3086}
(( segid " " and resid 45 and name HD2 ))
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5.500 3.800 0.500 peak 3086 spectrum 1 weight 0.10000E+01 volume 0.31702E-03 ppm1 2.312 ppm2 7.680 CV 1
OR { 3086}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 49 and name H ))
ASSI { 3088}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 46 and name H ))
5.500 3.700 0.500 peak 3088 spectrum 1 weight 0.10000E+01 volume 0.37203E-03 ppm1 2.854 ppm2 7.681 CV 1
OR { 3088}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 49 and name H ))
ASSI { 3103}
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(( segid " " and resid 30 and name HB2 ))
1.700 0.300 0.500 peak 3103 spectrum 1 weight 0.10000E+01 volume 0.18999E-01 ppm1 1.859 ppm2 2.057 CV 1
OR { 3103}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HG2 ))
ASSI { 3108}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 44 and name HA ))
4.000 2.000 2.000 peak 3108 spectrum 1 weight 0.10000E+01 volume 0.17637E-02 ppm1 2.056 ppm2 4.379 CV 1
OR { 3108}
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(( segid " " and resid 43 and name HA ))
ASSI { 3109}
(( segid " " and resid 44 and name HG3 ))
(( segid " " and resid 44 and name HA ))
3.700 1.700 1.700 peak 3109 spectrum 1 weight 0.10000E+01 volume 0.27388E-02 ppm1 1.905 ppm2 4.379 CV 1
OR { 3109}
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(( segid " " and resid 43 and name HA ))
ASSI { 3117}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HB3 ))
3.700 1.700 1.700 peak 3117 spectrum 1 weight 0.10000E+01 volume 0.19036E-02 ppm1 3.546 ppm2 2.205 CV 1
OR { 3117}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 44 and name HB3 ))
ASSI { 3119}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HG2 ))
2.200 0.600 0.600 peak 3119 spectrum 1 weight 0.10000E+01 volume 0.10433E-01 ppm1 3.550 ppm2 1.941 CV 1
OR { 3119}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 44 and name HG3 ))
OR { 3119}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 3124}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 45 and name H ))
3.600 1.600 1.600 peak 3124 spectrum 1 weight 0.10000E+01 volume 0.20110E-03 ppm1 3.542 ppm2 8.106 CV 1
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(( segid " " and resid 45 and name H ))
ASSI { 3144}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 7 and name HB2 ))
2.800 1.000 1.000 peak 3144 spectrum 1 weight 0.10000E+01 volume 0.33525E-02 ppm1 0.744 ppm2 1.714 CV 1
OR { 3144}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 45 and name HB3 ))
OR { 3144}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 45 and name HB2 ))
ASSI { 3146}
( segid " " and resid 43 and name HG1%)
( segid " " and resid 6 and name HB% )
3.300 1.300 1.300 peak 3146 spectrum 1 weight 0.10000E+01 volume 0.26690E-02 ppm1 0.744 ppm2 1.343 CV 1
OR { 3146}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 45 and name HG3 ))
ASSI { 3148}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 9 and name HB3 ))
3.400 1.400 1.400 peak 3148 spectrum 1 weight 0.10000E+01 volume 0.11452E-02 ppm1 0.744 ppm2 2.851 CV 1
OR { 3148}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 45 and name HD3 ))
OR { 3148}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 9 and name HB2 ))
ASSI { 3152}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HB ))
2.500 0.800 0.800 peak 3152 spectrum 1 weight 0.10000E+01 volume 0.60840E-02 ppm1 4.383 ppm2 1.901 CV 1
OR { 3152}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HG3 ))
ASSI { 3163}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 42 and name HA ))
2.200 2.200 3.800 peak 3163 spectrum 1 weight 0.10000E+01 volume 0.18683E-02 ppm1 0.743 ppm2 4.201 CV 1
OR { 3163}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 42 and name HB ))
OR { 3163}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 8 and name HA ))
OR { 3163}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 49 and name HA ))
ASSI { 3165}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 42 and name HB ))
2.200 2.200 3.800 peak 3165 spectrum 1 weight 0.10000E+01 volume 0.30626E-02 ppm1 0.713 ppm2 4.202 CV 1
OR { 3165}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 42 and name HA ))
OR { 3165}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 49 and name HA ))
ASSI { 3169}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 9 and name HE3 ))
3.400 1.400 1.400 peak 3169 spectrum 1 weight 0.10000E+01 volume 0.14232E-02 ppm1 0.713 ppm2 7.105 CV 1
OR { 3169}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 45 and name HE ))
ASSI { 3172}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 42 and name H ))
3.400 1.500 1.500 peak 3172 spectrum 1 weight 0.10000E+01 volume 0.46777E-03 ppm1 0.713 ppm2 8.164 CV 1
OR { 3172}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 50 and name H ))
ASSI { 3174}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 9 and name HE3 ))
3.300 1.400 1.400 peak 3174 spectrum 1 weight 0.10000E+01 volume 0.13139E-02 ppm1 0.744 ppm2 7.101 CV 1
OR { 3174}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 45 and name HE ))
ASSI { 3179}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 9 and name HE3 ))
4.400 2.500 1.600 peak 3179 spectrum 1 weight 0.10000E+01 volume 0.42015E-03 ppm1 1.903 ppm2 7.110 CV 1
OR { 3179}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 45 and name HE ))
ASSI { 3183}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 40 and name HG ))
4.900 3.000 1.100 peak 3183 spectrum 1 weight 0.10000E+01 volume 0.40083E-03 ppm1 4.204 ppm2 1.905 CV 1
OR { 3183}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HB ))
OR { 3183}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 3184}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 41 and name HB3 ))
3.600 1.700 1.700 peak 3184 spectrum 1 weight 0.10000E+01 volume 0.43145E-03 ppm1 4.202 ppm2 2.819 CV 1
OR { 3184}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 45 and name HD3 ))
ASSI { 3188}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 40 and name HG ))
4.100 2.100 1.900 peak 3188 spectrum 1 weight 0.10000E+01 volume 0.94282E-03 ppm1 4.199 ppm2 1.905 CV 1
OR { 3188}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 40 and name HB2 ))
OR { 3188}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 43 and name HB ))
ASSI { 3195}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HD22))
3.900 1.900 1.900 peak 3195 spectrum 1 weight 0.10000E+01 volume 0.16411E-02 ppm1 2.836 ppm2 6.743 CV 1
OR { 3195}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HD22))
OR { 3195}
(( segid " " and resid 131 and name HB2 ))
( segid " " and resid 131 and name HE% )
ASSI { 3198}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 131 and name H ))
2.700 0.900 0.900 peak 3198 spectrum 1 weight 0.10000E+01 volume 0.30728E-02 ppm1 2.835 ppm2 7.441 CV 1
OR { 3198}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HD21))
OR { 3198}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HD21))
ASSI { 3203}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 133 and name HG2 ))
4.500 2.500 1.500 peak 3203 spectrum 1 weight 0.10000E+01 volume 0.64450E-03 ppm1 2.796 ppm2 1.553 CV 1
OR { 3203}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 133 and name HG3 ))
OR { 3203}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 40 and name HB3 ))
OR { 3203}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 15 and name HB% )
OR { 3203}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 40 and name HB3 ))
ASSI { 3205}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 133 and name HG2 ))
4.200 2.200 1.800 peak 3205 spectrum 1 weight 0.10000E+01 volume 0.90102E-03 ppm1 2.830 ppm2 1.484 CV 1
OR { 3205}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 133 and name HG3 ))
OR { 3205}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 132 and name HG2 ))
ASSI { 3207}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HA ))
4.000 2.000 2.000 peak 3207 spectrum 1 weight 0.10000E+01 volume 0.45319E-03 ppm1 2.837 ppm2 4.770 CV 1
OR { 3207}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HA ))
OR { 3207}
(( segid " " and resid 131 and name HB2 ))
(( segid " " and resid 131 and name HA ))
ASSI { 3213}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 40 and name HD2%)
2.100 0.500 0.500 peak 3213 spectrum 1 weight 0.10000E+01 volume 0.19414E-01 ppm1 1.921 ppm2 0.957 CV 1
OR { 3213}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 22 and name HD1%)
OR { 3213}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 40 and name HD1%)
ASSI { 3217}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 25 and name HE2 ))
5.100 3.200 0.900 peak 3217 spectrum 1 weight 0.10000E+01 volume 0.46629E-03 ppm1 1.914 ppm2 3.011 CV 1
OR { 3217}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 25 and name HE3 ))
OR { 3217}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 21 and name HB3 ))
ASSI { 3218}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 41 and name HB3 ))
4.200 2.200 1.800 peak 3218 spectrum 1 weight 0.10000E+01 volume 0.46427E-03 ppm1 1.923 ppm2 2.854 CV 1
OR { 3218}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 45 and name HD3 ))
OR { 3218}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 26 and name HB2 ))
OR { 3218}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 3219}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 41 and name HB3 ))
4.700 2.800 1.300 peak 3219 spectrum 1 weight 0.10000E+01 volume 0.20494E-03 ppm1 1.529 ppm2 2.882 CV 1
OR { 3219}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 45 and name HD3 ))
OR { 3219}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 3221}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 80 and name HA ))
3.500 1.500 1.500 peak 3221 spectrum 1 weight 0.10000E+01 volume 0.17600E-02 ppm1 1.905 ppm2 3.968 CV 1
OR { 3221}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 81 and name HA ))
ASSI { 3222}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 19 and name HA ))
3.300 1.300 1.300 peak 3222 spectrum 1 weight 0.10000E+01 volume 0.14954E-02 ppm1 1.925 ppm2 4.005 CV 1
OR { 3222}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 17 and name HA ))
ASSI { 3223}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 37 and name HA ))
3.400 1.500 1.500 peak 3223 spectrum 1 weight 0.10000E+01 volume 0.13126E-02 ppm1 1.922 ppm2 3.944 CV 1
OR { 3223}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 17 and name HA ))
ASSI { 3226}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 37 and name HA ))
3.200 1.300 1.300 peak 3226 spectrum 1 weight 0.10000E+01 volume 0.11957E-02 ppm1 1.525 ppm2 3.929 CV 1
OR { 3226}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 17 and name HA ))
ASSI { 3229}
( segid " " and resid 40 and name HD1%)
( segid " " and resid 54 and name HD2%)
4.000 2.000 2.000 peak 3229 spectrum 1 weight 0.10000E+01 volume 0.19364E-02 ppm1 0.993 ppm2 0.406 CV 1
OR { 3229}
( segid " " and resid 40 and name HD1%)
( segid " " and resid 54 and name HD1%)
OR { 3229}
( segid " " and resid 22 and name HD1%)
( segid " " and resid 54 and name HD2%)
ASSI { 3230}
( segid " " and resid 40 and name HD1%)
( segid " " and resid 20 and name HD2%)
1.700 1.700 4.300 peak 3230 spectrum 1 weight 0.10000E+01 volume 0.72273E-02 ppm1 0.989 ppm2 0.607 CV 1
OR { 3230}
( segid " " and resid 40 and name HD1%)
( segid " " and resid 51 and name HG2%)
ASSI { 3231}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 40 and name HB3 ))
2.500 0.800 0.800 peak 3231 spectrum 1 weight 0.10000E+01 volume 0.96769E-02 ppm1 0.989 ppm2 1.528 CV 1
OR { 3231}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 17 and name HG ))
ASSI { 3233}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 83 and name HG3 ))
3.400 1.400 1.400 peak 3233 spectrum 1 weight 0.10000E+01 volume 0.29155E-02 ppm1 0.973 ppm2 2.462 CV 1
OR { 3233}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 13 and name HG3 ))
OR { 3233}
( segid " " and resid 82 and name HD1%)
(( segid " " and resid 85 and name HG2 ))
OR { 3233}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 13 and name HG2 ))
ASSI { 3234}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 45 and name HD3 ))
3.700 1.700 1.700 peak 3234 spectrum 1 weight 0.10000E+01 volume 0.12599E-02 ppm1 0.987 ppm2 2.856 CV 1
OR { 3234}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 14 and name HG2 ))
OR { 3234}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 9 and name HB2 ))
OR { 3234}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 53 and name HB3 ))
OR { 3234}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 41 and name HB3 ))
ASSI { 3235}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 18 and name HD3 ))
2.900 1.100 1.100 peak 3235 spectrum 1 weight 0.10000E+01 volume 0.24022E-02 ppm1 0.986 ppm2 3.360 CV 1
OR { 3235}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 16 and name HB3 ))
ASSI { 3236}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 42 and name HB ))
3.800 1.800 1.800 peak 3236 spectrum 1 weight 0.10000E+01 volume 0.14969E-02 ppm1 0.987 ppm2 4.224 CV 1
OR { 3236}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 42 and name HA ))
OR { 3236}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 23 and name HA ))
ASSI { 3239}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 102 and name H ))
3.200 1.200 1.200 peak 3239 spectrum 1 weight 0.10000E+01 volume 0.26426E-02 ppm1 0.927 ppm2 8.646 CV 1
OR { 3239}
( segid " " and resid 98 and name HD1%)
(( segid " " and resid 97 and name H ))
ASSI { 3243}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 9 and name HE3 ))
4.300 2.400 1.700 peak 3243 spectrum 1 weight 0.10000E+01 volume 0.65496E-03 ppm1 0.988 ppm2 7.077 CV 1
OR { 3243}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 45 and name HE ))
ASSI { 3244}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 16 and name HD2 ))
3.700 1.800 1.800 peak 3244 spectrum 1 weight 0.10000E+01 volume 0.66180E-03 ppm1 0.991 ppm2 7.296 CV 1
OR { 3244}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 24 and name H ))
ASSI { 3245}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 39 and name H ))
2.900 2.900 3.100 peak 3245 spectrum 1 weight 0.10000E+01 volume 0.60910E-03 ppm1 0.990 ppm2 7.538 CV 1
OR { 3245}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 55 and name H ))
ASSI { 3247}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 40 and name H ))
3.900 1.900 1.900 peak 3247 spectrum 1 weight 0.10000E+01 volume 0.20360E-02 ppm1 0.988 ppm2 7.870 CV 1
OR { 3247}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 23 and name H ))
ASSI { 3250}
(( segid " " and resid 113 and name HG2 ))
(( segid " " and resid 115 and name H ))
4.600 2.600 1.400 peak 3250 spectrum 1 weight 0.10000E+01 volume 0.46679E-03 ppm1 1.880 ppm2 8.570 CV 1
OR { 3250}
(( segid " " and resid 113 and name HG3 ))
(( segid " " and resid 115 and name H ))
OR { 3250}
(( segid " " and resid 113 and name HG2 ))
(( segid " " and resid 112 and name H ))
OR { 3250}
(( segid " " and resid 113 and name HG3 ))
(( segid " " and resid 112 and name H ))
ASSI { 3251}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name H ))
2.600 0.900 0.900 peak 3251 spectrum 1 weight 0.10000E+01 volume 0.31156E-02 ppm1 1.924 ppm2 7.866 CV 1
OR { 3251}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 23 and name H ))
ASSI { 3258}
(( segid " " and resid 39 and name HB2 ))
( segid " " and resid 36 and name HG2%)
4.400 2.400 1.600 peak 3258 spectrum 1 weight 0.10000E+01 volume 0.57004E-03 ppm1 3.466 ppm2 0.978 CV 1
OR { 3258}
(( segid " " and resid 39 and name HB2 ))
( segid " " and resid 40 and name HD2%)
OR { 3258}
(( segid " " and resid 39 and name HB2 ))
( segid " " and resid 40 and name HD1%)
ASSI { 3262}
(( segid " " and resid 39 and name HB3 ))
( segid " " and resid 36 and name HG2%)
4.600 2.700 1.400 peak 3262 spectrum 1 weight 0.10000E+01 volume 0.67678E-03 ppm1 2.858 ppm2 0.968 CV 1
OR { 3262}
(( segid " " and resid 39 and name HB3 ))
( segid " " and resid 40 and name HD2%)
OR { 3262}
(( segid " " and resid 39 and name HB3 ))
( segid " " and resid 40 and name HD1%)
ASSI { 3271}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 40 and name H ))
5.100 3.300 0.900 peak 3271 spectrum 1 weight 0.10000E+01 volume 0.38895E-03 ppm1 7.413 ppm2 7.868 CV 1
OR { 3271}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 35 and name H ))
ASSI { 3279}
(( segid " " and resid 16 and name HE1 ))
(( segid " " and resid 39 and name HB3 ))
5.300 3.500 0.700 peak 3279 spectrum 1 weight 0.10000E+01 volume 0.20117E-03 ppm1 8.309 ppm2 2.853 CV 1
OR { 3279}
(( segid " " and resid 16 and name HE1 ))
(( segid " " and resid 41 and name HB3 ))
ASSI { 3280}
(( segid " " and resid 16 and name HE1 ))
(( segid " " and resid 20 and name HG ))
5.600 3.900 0.400 peak 3280 spectrum 1 weight 0.10000E+01 volume 0.12208E-03 ppm1 8.314 ppm2 1.724 CV 1
OR { 3280}
(( segid " " and resid 16 and name HE1 ))
(( segid " " and resid 17 and name HB2 ))
ASSI { 3282}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 40 and name HB2 ))
6.000 4.700 0.000 peak 3282 spectrum 1 weight 0.10000E+01 volume 0.11323E-03 ppm1 7.415 ppm2 1.895 CV 1
OR { 3282}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 37 and name HB3 ))
ASSI { 3288}
(( segid " " and resid 39 and name HD2 ))
( segid " " and resid 36 and name HG2%)
4.300 2.300 1.700 peak 3288 spectrum 1 weight 0.10000E+01 volume 0.47712E-03 ppm1 7.411 ppm2 0.978 CV 1
OR { 3288}
(( segid " " and resid 39 and name HD2 ))
( segid " " and resid 40 and name HD2%)
OR { 3288}
(( segid " " and resid 39 and name HD2 ))
( segid " " and resid 40 and name HD1%)
ASSI { 3291}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 50 and name HD1%)
4.200 2.200 1.800 peak 3291 spectrum 1 weight 0.10000E+01 volume 0.79106E-03 ppm1 4.071 ppm2 0.936 CV 1
OR { 3291}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 36 and name HG2%)
OR { 3291}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 40 and name HD2%)
OR { 3291}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 50 and name HG2%)
ASSI { 3294}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 37 and name HB3 ))
4.100 2.100 1.900 peak 3294 spectrum 1 weight 0.10000E+01 volume 0.77773E-03 ppm1 4.065 ppm2 1.887 CV 1
OR { 3294}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 3297}
( segid " " and resid 38 and name HB% )
( segid " " and resid 50 and name HG2%)
3.400 1.400 1.400 peak 3297 spectrum 1 weight 0.10000E+01 volume 0.38790E-02 ppm1 1.279 ppm2 0.947 CV 1
OR { 3297}
( segid " " and resid 38 and name HB% )
( segid " " and resid 36 and name HG2%)
ASSI { 3300}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 37 and name HB3 ))
3.900 1.900 1.900 peak 3300 spectrum 1 weight 0.10000E+01 volume 0.18676E-02 ppm1 1.278 ppm2 1.864 CV 1
OR { 3300}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 40 and name HB2 ))
ASSI { 3302}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 37 and name HB2 ))
3.400 1.400 1.400 peak 3302 spectrum 1 weight 0.10000E+01 volume 0.41236E-02 ppm1 1.279 ppm2 1.552 CV 1
OR { 3302}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 50 and name HG12))
ASSI { 3308}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name H ))
2.700 0.900 0.900 peak 3308 spectrum 1 weight 0.10000E+01 volume 0.40025E-02 ppm1 4.079 ppm2 7.581 CV 1
OR { 3308}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name H ))
ASSI { 3311}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 38 and name H ))
2.100 0.500 0.500 peak 3311 spectrum 1 weight 0.10000E+01 volume 0.13750E-01 ppm1 1.278 ppm2 7.582 CV 1
OR { 3311}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 39 and name H ))
ASSI { 3313}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 40 and name H ))
4.000 2.000 2.000 peak 3313 spectrum 1 weight 0.10000E+01 volume 0.18439E-02 ppm1 1.279 ppm2 7.869 CV 1
OR { 3313}
( segid " " and resid 38 and name HB% )
(( segid " " and resid 35 and name H ))
ASSI { 3316}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 36 and name HG2%)
2.600 0.900 0.900 peak 3316 spectrum 1 weight 0.10000E+01 volume 0.59891E-02 ppm1 3.938 ppm2 0.972 CV 1
OR { 3316}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 40 and name HD2%)
OR { 3316}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 40 and name HD1%)
OR { 3316}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 33 and name HG2%)
ASSI { 3317}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 50 and name HD1%)
2.500 0.800 0.800 peak 3317 spectrum 1 weight 0.10000E+01 volume 0.97374E-02 ppm1 3.929 ppm2 0.857 CV 1
OR { 3317}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 50 and name HG2%)
OR { 3317}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 37 and name HD2%)
ASSI { 3318}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 38 and name HB% )
4.200 2.200 1.800 peak 3318 spectrum 1 weight 0.10000E+01 volume 0.93198E-03 ppm1 3.931 ppm2 1.287 CV 1
OR { 3318}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 42 and name HG2%)
ASSI { 3319}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 50 and name HG12))
2.100 0.600 0.600 peak 3319 spectrum 1 weight 0.10000E+01 volume 0.39255E-02 ppm1 3.929 ppm2 1.553 CV 1
OR { 3319}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB2 ))
OR { 3319}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 50 and name HG13))
ASSI { 3320}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HG ))
3.000 1.100 1.100 peak 3320 spectrum 1 weight 0.10000E+01 volume 0.38637E-02 ppm1 3.935 ppm2 1.673 CV 1
OR { 3320}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 54 and name HG ))
ASSI { 3322}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 39 and name HB3 ))
5.000 3.100 1.000 peak 3322 spectrum 1 weight 0.10000E+01 volume 0.39708E-03 ppm1 3.931 ppm2 2.860 CV 1
OR { 3322}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 45 and name HD3 ))
OR { 3322}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 3325}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 37 and name HB2 ))
1.700 0.400 0.500 peak 3325 spectrum 1 weight 0.10000E+01 volume 0.68167E-02 ppm1 1.852 ppm2 1.564 CV 1
OR { 3325}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 50 and name HG12))
OR { 3325}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 50 and name HG13))
ASSI { 3326}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HB3 ))
1.700 0.300 0.500 peak 3326 spectrum 1 weight 0.10000E+01 volume 0.73330E-02 ppm1 1.558 ppm2 1.854 CV 1
OR { 3326}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 47 and name HB3 ))
ASSI { 3329}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 47 and name HA ))
3.900 1.900 1.900 peak 3329 spectrum 1 weight 0.10000E+01 volume 0.35616E-03 ppm1 1.545 ppm2 3.740 CV 1
OR { 3329}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 50 and name HA ))
OR { 3329}
(( segid " " and resid 119 and name HB3 ))
(( segid " " and resid 127 and name HA ))
ASSI { 3331}
(( segid " " and resid 138 and name HG ))
(( segid " " and resid 140 and name HA ))
4.000 2.000 2.000 peak 3331 spectrum 1 weight 0.10000E+01 volume 0.62490E-03 ppm1 1.648 ppm2 4.534 CV 1
OR { 3331}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 6 and name HA ))
OR { 3331}
(( segid " " and resid 5 and name HG3 ))
(( segid " " and resid 6 and name HA ))
OR { 3331}
(( segid " " and resid 128 and name HG2 ))
(( segid " " and resid 126 and name HA ))
OR { 3331}
(( segid " " and resid 128 and name HG3 ))
(( segid " " and resid 126 and name HA ))
ASSI { 3333}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 36 and name H ))
3.200 1.300 1.300 peak 3333 spectrum 1 weight 0.10000E+01 volume 0.32553E-02 ppm1 0.803 ppm2 8.134 CV 1
OR { 3333}
( segid " " and resid 119 and name HD2%)
(( segid " " and resid 116 and name H ))
ASSI { 3337}
(( segid " " and resid 130 and name HG ))
( segid " " and resid 131 and name HE% )
5.400 3.600 0.600 peak 3337 spectrum 1 weight 0.10000E+01 volume 0.29611E-03 ppm1 1.647 ppm2 6.741 CV 1
OR { 3337}
(( segid " " and resid 128 and name HG3 ))
( segid " " and resid 131 and name HE% )
OR { 3337}
(( segid " " and resid 37 and name HG ))
(( segid " " and resid 9 and name HH2 ))
ASSI { 3338}
(( segid " " and resid 75 and name HG ))
(( segid " " and resid 76 and name HD1 ))
4.200 2.200 1.800 peak 3338 spectrum 1 weight 0.10000E+01 volume 0.47946E-03 ppm1 1.580 ppm2 7.372 CV 1
OR { 3338}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 131 and name H ))
ASSI { 3339}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 126 and name H ))
4.000 2.000 2.000 peak 3339 spectrum 1 weight 0.10000E+01 volume 0.43809E-03 ppm1 1.567 ppm2 7.604 CV 1
OR { 3339}
(( segid " " and resid 119 and name HG ))
(( segid " " and resid 123 and name H ))
ASSI { 3340}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 38 and name H ))
3.700 1.700 1.700 peak 3340 spectrum 1 weight 0.10000E+01 volume 0.10361E-02 ppm1 1.860 ppm2 7.586 CV 1
OR { 3340}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 39 and name H ))
ASSI { 3341}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 38 and name H ))
3.600 1.600 1.600 peak 3341 spectrum 1 weight 0.10000E+01 volume 0.11867E-02 ppm1 1.558 ppm2 7.586 CV 1
OR { 3341}
(( segid " " and resid 118 and name HB3 ))
(( segid " " and resid 123 and name H ))
OR { 3341}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 39 and name H ))
OR { 3341}
(( segid " " and resid 118 and name HB3 ))
(( segid " " and resid 117 and name H ))
ASSI { 3342}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name H ))
3.000 1.100 1.100 peak 3342 spectrum 1 weight 0.10000E+01 volume 0.11644E-02 ppm1 3.927 ppm2 7.569 CV 1
OR { 3342}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 39 and name H ))
ASSI { 3349}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 40 and name HB3 ))
3.900 1.900 1.900 peak 3349 spectrum 1 weight 0.10000E+01 volume 0.83359E-03 ppm1 3.661 ppm2 1.506 CV 1
OR { 3349}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 17 and name HG ))
OR { 3349}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 37 and name HB2 ))
ASSI { 3354}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 37 and name HA ))
4.100 2.100 1.900 peak 3354 spectrum 1 weight 0.10000E+01 volume 0.10547E-02 ppm1 3.658 ppm2 3.946 CV 1
OR { 3354}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 20 and name HA ))
OR { 3354}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 17 and name HA ))
ASSI { 3356}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 14 and name HA ))
3.800 1.800 1.800 peak 3356 spectrum 1 weight 0.10000E+01 volume 0.79189E-03 ppm1 2.112 ppm2 3.966 CV 1
OR { 3356}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 37 and name HA ))
OR { 3356}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 21 and name HA ))
ASSI { 3357}
(( segid " " and resid 36 and name HG13))
( segid " " and resid 36 and name HD1%)
2.300 0.700 0.700 peak 3357 spectrum 1 weight 0.10000E+01 volume 0.49124E-02 ppm1 2.118 ppm2 0.990 CV 1
OR { 3357}
(( segid " " and resid 36 and name HG13))
( segid " " and resid 32 and name HG2%)
OR { 3357}
(( segid " " and resid 36 and name HG13))
( segid " " and resid 36 and name HG2%)
ASSI { 3358}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 88 and name HA ))
3.500 3.500 2.500 peak 3358 spectrum 1 weight 0.10000E+01 volume 0.36135E-02 ppm1 2.109 ppm2 3.981 CV 1
OR { 3358}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 123 and name HA ))
ASSI { 3363}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 20 and name HG ))
3.100 1.200 1.200 peak 3363 spectrum 1 weight 0.10000E+01 volume 0.46801E-02 ppm1 0.965 ppm2 1.666 CV 1
OR { 3363}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 37 and name HG ))
ASSI { 3364}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 50 and name HG12))
2.300 0.700 0.700 peak 3364 spectrum 1 weight 0.10000E+01 volume 0.57108E-02 ppm1 0.970 ppm2 1.525 CV 1
OR { 3364}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 17 and name HG ))
OR { 3364}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 37 and name HB2 ))
ASSI { 3366}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 33 and name H ))
3.900 1.900 1.900 peak 3366 spectrum 1 weight 0.10000E+01 volume 0.78086E-03 ppm1 1.010 ppm2 7.997 CV 1
OR { 3366}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 34 and name H ))
ASSI { 3368}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 33 and name H ))
4.000 2.000 2.000 peak 3368 spectrum 1 weight 0.10000E+01 volume 0.11654E-02 ppm1 0.973 ppm2 7.989 CV 1
OR { 3368}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 34 and name H ))
ASSI { 3369}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 40 and name H ))
3.800 1.800 1.800 peak 3369 spectrum 1 weight 0.10000E+01 volume 0.12764E-02 ppm1 0.975 ppm2 7.871 CV 1
OR { 3369}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 35 and name H ))
ASSI { 3376}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HB2 ))
4.100 2.100 1.900 peak 3376 spectrum 1 weight 0.10000E+01 volume 0.23944E-02 ppm1 4.201 ppm2 1.817 CV 1
OR { 3376}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 18 and name HB2 ))
ASSI { 3379}
( segid " " and resid 35 and name HB% )
( segid " " and resid 32 and name HG2%)
2.600 0.900 0.900 peak 3379 spectrum 1 weight 0.10000E+01 volume 0.76789E-02 ppm1 1.415 ppm2 1.011 CV 1
OR { 3379}
( segid " " and resid 35 and name HB% )
( segid " " and resid 36 and name HD1%)
ASSI { 3380}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 30 and name HG2 ))
2.500 0.800 0.800 peak 3380 spectrum 1 weight 0.10000E+01 volume 0.62337E-02 ppm1 1.415 ppm2 2.134 CV 1
OR { 3380}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 36 and name HG13))
ASSI { 3384}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 32 and name HA ))
2.400 0.700 0.700 peak 3384 spectrum 1 weight 0.10000E+01 volume 0.65991E-02 ppm1 1.415 ppm2 3.965 CV 1
OR { 3384}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 20 and name HA ))
ASSI { 3386}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HA ))
5.200 3.300 0.800 peak 3386 spectrum 1 weight 0.10000E+01 volume 0.69689E-03 ppm1 4.200 ppm2 3.795 CV 1
OR { 3386}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 18 and name HA ))
ASSI { 3387}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HA ))
4.400 2.500 1.600 peak 3387 spectrum 1 weight 0.10000E+01 volume 0.55336E-03 ppm1 4.192 ppm2 3.678 CV 1
OR { 3387}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 54 and name HA ))
OR { 3387}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 118 and name HA ))
ASSI { 3391}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 24 and name H ))
3.100 3.100 2.900 peak 3391 spectrum 1 weight 0.10000E+01 volume 0.62702E-03 ppm1 1.415 ppm2 7.284 CV 1
OR { 3391}
( segid " " and resid 35 and name HB% )
( segid " " and resid 66 and name HD% )
ASSI { 3393}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 36 and name H ))
2.500 0.800 0.800 peak 3393 spectrum 1 weight 0.10000E+01 volume 0.63559E-02 ppm1 1.415 ppm2 8.101 CV 1
OR { 3393}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 24 and name HD21))
ASSI { 3394}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 34 and name H ))
3.300 1.300 1.300 peak 3394 spectrum 1 weight 0.10000E+01 volume 0.31869E-02 ppm1 1.416 ppm2 7.988 CV 1
OR { 3394}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 33 and name H ))
ASSI { 3397}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 37 and name H ))
4.500 2.600 1.500 peak 3397 spectrum 1 weight 0.10000E+01 volume 0.30541E-03 ppm1 4.193 ppm2 8.591 CV 1
OR { 3397}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 22 and name H ))
ASSI { 3399}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 17 and name H ))
4.700 2.800 1.300 peak 3399 spectrum 1 weight 0.10000E+01 volume 0.25565E-03 ppm1 4.201 ppm2 8.741 CV 1
OR { 3399}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 14 and name H ))
ASSI { 3403}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 20 and name HD2%)
3.300 1.400 1.400 peak 3403 spectrum 1 weight 0.10000E+01 volume 0.20713E-02 ppm1 3.965 ppm2 0.612 CV 1
OR { 3403}
(( segid " " and resid 80 and name HA ))
( segid " " and resid 84 and name HD2%)
ASSI { 3404}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 40 and name HD1%)
2.300 0.700 0.700 peak 3404 spectrum 1 weight 0.10000E+01 volume 0.75833E-02 ppm1 3.969 ppm2 0.964 CV 1
OR { 3404}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 36 and name HG2%)
OR { 3404}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 33 and name HG1%)
OR { 3404}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 40 and name HD2%)
ASSI { 3408}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 37 and name HB2 ))
3.700 1.800 1.800 peak 3408 spectrum 1 weight 0.10000E+01 volume 0.32300E-02 ppm1 3.980 ppm2 1.552 CV 1
OR { 3408}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 15 and name HB% )
OR { 3408}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 47 and name HG2 ))
OR { 3408}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 50 and name HG12))
ASSI { 3409}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 56 and name HB3 ))
3.400 1.500 1.500 peak 3409 spectrum 1 weight 0.10000E+01 volume 0.46331E-02 ppm1 3.990 ppm2 1.856 CV 1
OR { 3409}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 37 and name HB3 ))
ASSI { 3410}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HG2 ))
2.600 0.800 0.800 peak 3410 spectrum 1 weight 0.10000E+01 volume 0.34688E-02 ppm1 3.989 ppm2 2.420 CV 1
OR { 3410}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HB2 ))
OR { 3410}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HG3 ))
ASSI { 3411}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HA ))
2.400 0.700 0.700 peak 3411 spectrum 1 weight 0.10000E+01 volume 0.39484E-02 ppm1 2.286 ppm2 4.020 CV 1
OR { 3411}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HA ))
ASSI { 3412}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HA ))
2.600 0.800 0.800 peak 3412 spectrum 1 weight 0.10000E+01 volume 0.36667E-02 ppm1 2.423 ppm2 3.984 CV 1
OR { 3412}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 83 and name HA ))
OR { 3412}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 80 and name HA ))
OR { 3412}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HA ))
ASSI { 3415}
(( segid " " and resid 89 and name HG2 ))
( segid " " and resid 123 and name HD1%)
3.000 1.100 1.100 peak 3415 spectrum 1 weight 0.10000E+01 volume 0.24179E-02 ppm1 2.419 ppm2 0.831 CV 1
OR { 3415}
(( segid " " and resid 34 and name HG2 ))
( segid " " and resid 37 and name HD1%)
ASSI { 3416}
(( segid " " and resid 34 and name HG2 ))
( segid " " and resid 33 and name HG1%)
3.200 1.300 1.300 peak 3416 spectrum 1 weight 0.10000E+01 volume 0.36943E-02 ppm1 2.415 ppm2 0.945 CV 1
OR { 3416}
(( segid " " and resid 34 and name HG2 ))
( segid " " and resid 33 and name HG2%)
OR { 3416}
(( segid " " and resid 89 and name HG2 ))
( segid " " and resid 97 and name HG2%)
ASSI { 3417}
(( segid " " and resid 83 and name HG3 ))
( segid " " and resid 106 and name HG2%)
4.000 2.000 2.000 peak 3417 spectrum 1 weight 0.10000E+01 volume 0.11459E-02 ppm1 2.421 ppm2 1.288 CV 1
OR { 3417}
(( segid " " and resid 34 and name HG2 ))
( segid " " and resid 38 and name HB% )
OR { 3417}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 92 and name HG2 ))
ASSI { 3418}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HG3 ))
1.600 0.300 0.600 peak 3418 spectrum 1 weight 0.10000E+01 volume 0.35815E-01 ppm1 2.422 ppm2 2.246 CV 1
OR { 3418}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB3 ))
OR { 3418}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB2 ))
OR { 3418}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HB3 ))
OR { 3418}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 83 and name HB3 ))
OR { 3418}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HB2 ))
ASSI { 3419}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 34 and name HG2 ))
1.600 0.300 0.600 peak 3419 spectrum 1 weight 0.10000E+01 volume 0.27340E-01 ppm1 2.250 ppm2 2.427 CV 1
OR { 3419}
(( segid " " and resid 126 and name HG3 ))
(( segid " " and resid 129 and name HG2 ))
OR { 3419}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 129 and name HG2 ))
ASSI { 3422}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 90 and name H ))
3.700 1.700 1.700 peak 3422 spectrum 1 weight 0.10000E+01 volume 0.18116E-02 ppm1 2.419 ppm2 7.880 CV 1
OR { 3422}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 35 and name H ))
ASSI { 3424}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name H ))
2.700 0.900 0.900 peak 3424 spectrum 1 weight 0.10000E+01 volume 0.38673E-02 ppm1 2.287 ppm2 7.985 CV 1
OR { 3424}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name H ))
ASSI { 3428}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name H ))
3.100 1.200 1.200 peak 3428 spectrum 1 weight 0.10000E+01 volume 0.16904E-02 ppm1 3.985 ppm2 7.870 CV 1
OR { 3428}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 23 and name H ))
ASSI { 3429}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 37 and name H ))
3.400 1.400 1.400 peak 3429 spectrum 1 weight 0.10000E+01 volume 0.17770E-02 ppm1 3.982 ppm2 8.587 CV 1
OR { 3429}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 22 and name H ))
ASSI { 3432}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 18 and name H ))
3.300 1.400 1.400 peak 3432 spectrum 1 weight 0.10000E+01 volume 0.10901E-02 ppm1 3.969 ppm2 8.307 CV 1
OR { 3432}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 15 and name H ))
ASSI { 3433}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 36 and name HD1%)
1.800 0.400 0.400 peak 3433 spectrum 1 weight 0.10000E+01 volume 0.10878E-01 ppm1 3.579 ppm2 0.959 CV 1
OR { 3433}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 33 and name HG2%)
OR { 3433}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 36 and name HG2%)
ASSI { 3434}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 35 and name HB% )
4.000 2.000 2.000 peak 3434 spectrum 1 weight 0.10000E+01 volume 0.91244E-03 ppm1 3.581 ppm2 1.425 CV 1
OR { 3434}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 105 and name HG13))
OR { 3434}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 98 and name HB2 ))
ASSI { 3436}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB ))
2.600 0.900 0.900 peak 3436 spectrum 1 weight 0.10000E+01 volume 0.12946E-02 ppm1 3.581 ppm2 2.338 CV 1
OR { 3436}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 100 and name HB2 ))
ASSI { 3441}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HA ))
3.100 1.200 1.200 peak 3441 spectrum 1 weight 0.10000E+01 volume 0.10468E-02 ppm1 2.339 ppm2 3.979 CV 1
OR { 3441}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 80 and name HA ))
ASSI { 3442}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 33 and name H ))
2.300 0.700 0.700 peak 3442 spectrum 1 weight 0.10000E+01 volume 0.41212E-02 ppm1 2.338 ppm2 7.990 CV 1
OR { 3442}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 34 and name H ))
ASSI { 3443}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 36 and name H ))
3.100 1.200 1.200 peak 3443 spectrum 1 weight 0.10000E+01 volume 0.10296E-02 ppm1 3.581 ppm2 8.096 CV 1
OR { 3443}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 105 and name H ))
ASSI { 3444}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name H ))
2.700 0.900 0.900 peak 3444 spectrum 1 weight 0.10000E+01 volume 0.16060E-02 ppm1 3.579 ppm2 7.984 CV 1
OR { 3444}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name H ))
ASSI { 3452}
( segid " " and resid 32 and name HG1%)
( segid " " and resid 32 and name HG2%)
1.900 0.500 0.500 peak 3452 spectrum 1 weight 0.10000E+01 volume 0.24056E-01 ppm1 1.295 ppm2 1.025 CV 1
OR { 3452}
( segid " " and resid 32 and name HG1%)
( segid " " and resid 36 and name HD1%)
ASSI { 3453}
( segid " " and resid 32 and name HG1%)
( segid " " and resid 36 and name HD1%)
2.200 0.600 0.600 peak 3453 spectrum 1 weight 0.10000E+01 volume 0.18593E-01 ppm1 1.295 ppm2 0.954 CV 1
OR { 3453}
( segid " " and resid 32 and name HG1%)
( segid " " and resid 33 and name HG1%)
OR { 3453}
( segid " " and resid 32 and name HG1%)
( segid " " and resid 33 and name HG2%)
ASSI { 3454}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 54 and name HG ))
4.100 2.100 1.900 peak 3454 spectrum 1 weight 0.10000E+01 volume 0.15692E-02 ppm1 1.293 ppm2 1.689 CV 1
OR { 3454}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 37 and name HG ))
OR { 3454}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 20 and name HG ))
ASSI { 3455}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 37 and name HG ))
4.000 2.000 2.000 peak 3455 spectrum 1 weight 0.10000E+01 volume 0.19326E-02 ppm1 1.294 ppm2 1.635 CV 1
OR { 3455}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 51 and name HB ))
ASSI { 3459}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 32 and name HA ))
3.100 1.200 1.200 peak 3459 spectrum 1 weight 0.10000E+01 volume 0.46051E-02 ppm1 1.295 ppm2 3.966 CV 1
OR { 3459}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 21 and name HA ))
ASSI { 3470}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 21 and name HA ))
2.100 0.600 0.600 peak 3470 spectrum 1 weight 0.10000E+01 volume 0.91804E-02 ppm1 1.035 ppm2 3.971 CV 1
OR { 3470}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 32 and name HA ))
ASSI { 3473}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 24 and name H ))
3.000 1.100 1.100 peak 3473 spectrum 1 weight 0.10000E+01 volume 0.23508E-02 ppm1 1.036 ppm2 7.284 CV 1
OR { 3473}
( segid " " and resid 32 and name HG2%)
( segid " " and resid 66 and name HD% )
ASSI { 3476}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 25 and name H ))
2.900 1.000 1.000 peak 3476 spectrum 1 weight 0.10000E+01 volume 0.35185E-02 ppm1 1.035 ppm2 8.036 CV 1
OR { 3476}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 34 and name H ))
ASSI { 3479}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 22 and name H ))
3.600 1.600 1.600 peak 3479 spectrum 1 weight 0.10000E+01 volume 0.16799E-02 ppm1 1.033 ppm2 8.552 CV 1
OR { 3479}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 37 and name H ))
ASSI { 3481}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 66 and name H ))
5.500 3.700 0.500 peak 3481 spectrum 1 weight 0.10000E+01 volume 0.48196E-03 ppm1 1.294 ppm2 7.494 CV 1
OR { 3481}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 24 and name HD22))
ASSI { 3486}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 37 and name H ))
4.900 3.000 1.100 peak 3486 spectrum 1 weight 0.10000E+01 volume 0.62459E-03 ppm1 1.296 ppm2 8.553 CV 1
OR { 3486}
( segid " " and resid 32 and name HG1%)
(( segid " " and resid 22 and name H ))
ASSI { 3490}
(( segid " " and resid 32 and name HB ))
( segid " " and resid 66 and name HD% )
4.700 2.700 1.300 peak 3490 spectrum 1 weight 0.10000E+01 volume 0.29501E-03 ppm1 2.370 ppm2 7.296 CV 1
OR { 3490}
(( segid " " and resid 32 and name HB ))
(( segid " " and resid 24 and name H ))
ASSI { 3491}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 66 and name HZ ))
4.600 2.700 1.400 peak 3491 spectrum 1 weight 0.10000E+01 volume 0.56164E-03 ppm1 3.968 ppm2 6.907 CV 1
OR { 3491}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 21 and name HD% )
ASSI { 3500}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 61 and name HA ))
3.000 1.200 1.200 peak 3500 spectrum 1 weight 0.10000E+01 volume 0.27425E-02 ppm1 2.701 ppm2 4.541 CV 1
OR { 3500}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 61 and name HA ))
OR { 3500}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 30 and name HA ))
ASSI { 3512}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HA ))
2.900 1.100 1.100 peak 3512 spectrum 1 weight 0.10000E+01 volume 0.11594E-02 ppm1 2.048 ppm2 4.559 CV 1
OR { 3512}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HA ))
ASSI { 3515}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HE21))
4.100 2.100 1.900 peak 3515 spectrum 1 weight 0.10000E+01 volume 0.92305E-03 ppm1 2.058 ppm2 7.032 CV 1
OR { 3515}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 30 and name HE21))
ASSI { 3516}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HE22))
3.900 1.900 1.900 peak 3516 spectrum 1 weight 0.10000E+01 volume 0.13920E-02 ppm1 2.058 ppm2 7.753 CV 1
OR { 3516}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 30 and name HE22))
ASSI { 3517}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 27 and name H ))
3.700 1.800 1.800 peak 3517 spectrum 1 weight 0.10000E+01 volume 0.34109E-03 ppm1 1.847 ppm2 7.300 CV 1
OR { 3517}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 24 and name H ))
ASSI { 3519}
(( segid " " and resid 122 and name HA3 ))
( segid " " and resid 123 and name HD1%)
4.700 2.700 1.300 peak 3519 spectrum 1 weight 0.10000E+01 volume 0.72656E-03 ppm1 3.752 ppm2 0.832 CV 1
OR { 3519}
(( segid " " and resid 122 and name HA3 ))
( segid " " and resid 124 and name HG2%)
OR { 3519}
(( segid " " and resid 122 and name HA3 ))
( segid " " and resid 119 and name HD2%)
ASSI { 3521}
(( segid " " and resid 29 and name HA3 ))
(( segid " " and resid 30 and name HB2 ))
3.700 1.700 1.700 peak 3521 spectrum 1 weight 0.10000E+01 volume 0.89652E-03 ppm1 3.749 ppm2 2.004 CV 1
OR { 3521}
(( segid " " and resid 29 and name HA3 ))
(( segid " " and resid 28 and name HB2 ))
OR { 3521}
(( segid " " and resid 29 and name HA3 ))
(( segid " " and resid 28 and name HB3 ))
ASSI { 3528}
(( segid " " and resid 28 and name HB3 ))
( segid " " and resid 27 and name HG2%)
3.400 1.400 1.400 peak 3528 spectrum 1 weight 0.10000E+01 volume 0.45248E-02 ppm1 1.991 ppm2 0.904 CV 1
OR { 3528}
(( segid " " and resid 86 and name HB2 ))
( segid " " and resid 82 and name HD2%)
OR { 3528}
(( segid " " and resid 86 and name HB3 ))
( segid " " and resid 82 and name HD2%)
OR { 3528}
(( segid " " and resid 28 and name HB2 ))
( segid " " and resid 27 and name HG2%)
ASSI { 3529}
(( segid " " and resid 135 and name HB2 ))
(( segid " " and resid 136 and name HG3 ))
3.500 1.500 1.500 peak 3529 spectrum 1 weight 0.10000E+01 volume 0.19545E-02 ppm1 1.999 ppm2 1.455 CV 1
OR { 3529}
(( segid " " and resid 86 and name HB3 ))
(( segid " " and resid 90 and name HB3 ))
OR { 3529}
(( segid " " and resid 135 and name HB2 ))
(( segid " " and resid 136 and name HG2 ))
OR { 3529}
(( segid " " and resid 86 and name HB2 ))
(( segid " " and resid 90 and name HB3 ))
ASSI { 3532}
(( segid " " and resid 126 and name HG2 ))
(( segid " " and resid 125 and name H ))
4.400 2.500 1.600 peak 3532 spectrum 1 weight 0.10000E+01 volume 0.66354E-03 ppm1 2.254 ppm2 8.848 CV 1
OR { 3532}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 29 and name H ))
OR { 3532}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 31 and name H ))
ASSI { 3536}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 97 and name HG2%)
2.100 0.600 0.600 peak 3536 spectrum 1 weight 0.10000E+01 volume 0.84596E-02 ppm1 3.892 ppm2 0.976 CV 1
OR { 3536}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 101 and name HD1%)
OR { 3536}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 27 and name HG1%)
ASSI { 3541}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 75 and name HA ))
4.200 2.200 1.800 peak 3541 spectrum 1 weight 0.10000E+01 volume 0.72875E-03 ppm1 0.872 ppm2 4.454 CV 1
OR { 3541}
( segid " " and resid 74 and name HG1%)
(( segid " " and resid 107 and name HA ))
ASSI { 3547}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HA ))
4.500 2.600 1.500 peak 3547 spectrum 1 weight 0.10000E+01 volume 0.38422E-03 ppm1 2.912 ppm2 3.862 CV 1
OR { 3547}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 25 and name HA ))
ASSI { 3551}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 66 and name HD% )
4.200 2.200 1.800 peak 3551 spectrum 1 weight 0.10000E+01 volume 0.77794E-03 ppm1 2.483 ppm2 7.301 CV 1
OR { 3551}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 27 and name H ))
ASSI { 3562}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 22 and name HD2%)
3.800 1.800 1.800 peak 3562 spectrum 1 weight 0.10000E+01 volume 0.12136E-02 ppm1 1.140 ppm2 0.952 CV 1
OR { 3562}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 36 and name HD1%)
ASSI { 3571}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HB2 ))
2.400 0.700 0.700 peak 3571 spectrum 1 weight 0.10000E+01 volume 0.58938E-02 ppm1 1.347 ppm2 1.472 CV 1
OR { 3571}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 25 and name HB2 ))
OR { 3571}
(( segid " " and resid 25 and name HD3 ))
(( segid " " and resid 22 and name HB3 ))
ASSI { 3577}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 21 and name HE% )
4.600 2.600 1.400 peak 3577 spectrum 1 weight 0.10000E+01 volume 0.58401E-03 ppm1 3.855 ppm2 6.860 CV 1
OR { 3577}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 21 and name HD% )
OR { 3577}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HE22))
ASSI { 3578}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 27 and name H ))
3.500 1.500 1.500 peak 3578 spectrum 1 weight 0.10000E+01 volume 0.10319E-02 ppm1 3.849 ppm2 7.288 CV 1
OR { 3578}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 24 and name H ))
ASSI { 3580}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 27 and name H ))
4.900 3.100 1.100 peak 3580 spectrum 1 weight 0.10000E+01 volume 0.42033E-03 ppm1 1.486 ppm2 7.285 CV 1
OR { 3580}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 24 and name H ))
ASSI { 3583}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 24 and name H ))
4.400 2.400 1.600 peak 3583 spectrum 1 weight 0.10000E+01 volume 0.33681E-03 ppm1 1.140 ppm2 7.286 CV 1
OR { 3583}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 27 and name H ))
ASSI { 3585}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 22 and name H ))
4.400 2.400 1.600 peak 3585 spectrum 1 weight 0.10000E+01 volume 0.39549E-03 ppm1 1.143 ppm2 8.531 CV 1
OR { 3585}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 26 and name H ))
ASSI { 3586}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 26 and name H ))
4.300 2.300 1.700 peak 3586 spectrum 1 weight 0.10000E+01 volume 0.65134E-03 ppm1 1.488 ppm2 8.541 CV 1
OR { 3586}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 22 and name H ))
ASSI { 3590}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 27 and name H ))
4.800 2.900 1.200 peak 3590 spectrum 1 weight 0.10000E+01 volume 0.55468E-03 ppm1 1.147 ppm2 7.287 CV 1
OR { 3590}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 24 and name H ))
ASSI { 3593}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 23 and name HB% )
3.700 1.700 1.700 peak 3593 spectrum 1 weight 0.10000E+01 volume 0.18576E-02 ppm1 4.934 ppm2 1.428 CV 1
OR { 3593}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 35 and name HB% )
ASSI { 3595}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HB3 ))
2.800 0.900 0.900 peak 3595 spectrum 1 weight 0.10000E+01 volume 0.43135E-02 ppm1 4.934 ppm2 2.487 CV 1
OR { 3595}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB2 ))
ASSI { 3597}
(( segid " " and resid 24 and name HB3 ))
( segid " " and resid 35 and name HB% )
4.000 2.000 2.000 peak 3597 spectrum 1 weight 0.10000E+01 volume 0.94593E-03 ppm1 2.577 ppm2 1.424 CV 1
OR { 3597}
(( segid " " and resid 24 and name HB3 ))
( segid " " and resid 23 and name HB% )
ASSI { 3598}
(( segid " " and resid 24 and name HB2 ))
( segid " " and resid 35 and name HB% )
3.400 1.500 1.500 peak 3598 spectrum 1 weight 0.10000E+01 volume 0.99284E-03 ppm1 2.500 ppm2 1.426 CV 1
OR { 3598}
(( segid " " and resid 24 and name HB2 ))
( segid " " and resid 23 and name HB% )
ASSI { 3599}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 32 and name HA ))
4.300 2.300 1.700 peak 3599 spectrum 1 weight 0.10000E+01 volume 0.32700E-03 ppm1 2.584 ppm2 3.969 CV 1
OR { 3599}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 21 and name HA ))
ASSI { 3600}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 32 and name HA ))
4.000 2.000 2.000 peak 3600 spectrum 1 weight 0.10000E+01 volume 0.31319E-03 ppm1 2.483 ppm2 3.965 CV 1
OR { 3600}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 21 and name HA ))
ASSI { 3605}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name H ))
4.400 2.500 1.600 peak 3605 spectrum 1 weight 0.10000E+01 volume 0.61775E-03 ppm1 2.567 ppm2 7.282 CV 1
OR { 3605}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 27 and name H ))
ASSI { 3616}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 22 and name H ))
4.600 2.600 1.400 peak 3616 spectrum 1 weight 0.10000E+01 volume 0.45883E-03 ppm1 4.234 ppm2 8.541 CV 1
OR { 3616}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 26 and name H ))
ASSI { 3618}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB3 ))
2.400 0.700 0.700 peak 3618 spectrum 1 weight 0.10000E+01 volume 0.42364E-02 ppm1 3.719 ppm2 1.453 CV 1
OR { 3618}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HB2 ))
OR { 3618}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 59 and name HG ))
ASSI { 3620}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HG2 ))
2.600 0.900 0.900 peak 3620 spectrum 1 weight 0.10000E+01 volume 0.16202E-02 ppm1 3.714 ppm2 1.232 CV 1
OR { 3620}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 3621}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HG ))
3.200 1.300 1.300 peak 3621 spectrum 1 weight 0.10000E+01 volume 0.24236E-02 ppm1 3.716 ppm2 2.052 CV 1
OR { 3621}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 18 and name HB3 ))
ASSI { 3622}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB3 ))
2.600 0.900 0.900 peak 3622 spectrum 1 weight 0.10000E+01 volume 0.25667E-02 ppm1 3.714 ppm2 1.935 CV 1
OR { 3622}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
ASSI { 3624}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 53 and name HA ))
3.700 1.700 1.700 peak 3624 spectrum 1 weight 0.10000E+01 volume 0.11334E-02 ppm1 3.686 ppm2 3.993 CV 1
OR { 3624}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 55 and name HA ))
OR { 3624}
(( segid " " and resid 118 and name HA ))
(( segid " " and resid 117 and name HA ))
OR { 3624}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 21 and name HA ))
OR { 3624}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 57 and name HA ))
OR { 3624}
(( segid " " and resid 118 and name HA ))
(( segid " " and resid 123 and name HA ))
OR { 3624}
(( segid " " and resid 118 and name HA ))
(( segid " " and resid 122 and name HA2 ))
ASSI { 3627}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 25 and name HE2 ))
3.900 1.900 1.900 peak 3627 spectrum 1 weight 0.10000E+01 volume 0.39459E-03 ppm1 1.454 ppm2 3.009 CV 1
OR { 3627}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 25 and name HE3 ))
OR { 3627}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 21 and name HB3 ))
ASSI { 3632}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 88 and name HA ))
2.500 0.800 0.800 peak 3632 spectrum 1 weight 0.10000E+01 volume 0.37823E-02 ppm1 0.952 ppm2 3.984 CV 1
OR { 3632}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 98 and name HA ))
OR { 3632}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 21 and name HA ))
ASSI { 3633}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 88 and name H ))
4.600 2.700 1.400 peak 3633 spectrum 1 weight 0.10000E+01 volume 0.84325E-03 ppm1 0.947 ppm2 8.946 CV 1
OR { 3633}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 21 and name H ))
ASSI { 3641}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name H ))
3.900 1.900 1.900 peak 3641 spectrum 1 weight 0.10000E+01 volume 0.51071E-03 ppm1 3.713 ppm2 8.037 CV 1
OR { 3641}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 56 and name H ))
ASSI { 3642}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name H ))
2.800 0.900 0.900 peak 3642 spectrum 1 weight 0.10000E+01 volume 0.14455E-02 ppm1 3.721 ppm2 8.553 CV 1
OR { 3642}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 26 and name H ))
ASSI { 3644}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 24 and name H ))
4.500 2.600 1.500 peak 3644 spectrum 1 weight 0.10000E+01 volume 0.26113E-03 ppm1 3.714 ppm2 7.289 CV 1
OR { 3644}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 27 and name H ))
ASSI { 3649}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 21 and name HA ))
3.300 1.300 1.300 peak 3649 spectrum 1 weight 0.10000E+01 volume 0.15452E-02 ppm1 6.906 ppm2 4.008 CV 1
OR { 3649}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 32 and name HA ))
ASSI { 3652}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 22 and name HG ))
4.300 2.300 1.700 peak 3652 spectrum 1 weight 0.10000E+01 volume 0.11181E-02 ppm1 6.906 ppm2 2.072 CV 1
OR { 3652}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 36 and name HG13))
OR { 3652}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 36 and name HB ))
OR { 3652}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 18 and name HB3 ))
ASSI { 3653}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HB2 ))
4.000 2.000 2.000 peak 3653 spectrum 1 weight 0.10000E+01 volume 0.10176E-02 ppm1 6.904 ppm2 1.460 CV 1
OR { 3653}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 22 and name HB3 ))
OR { 3653}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 59 and name HG ))
ASSI { 3654}
( segid " " and resid 21 and name HD% )
( segid " " and resid 32 and name HG1%)
2.900 1.100 1.100 peak 3654 spectrum 1 weight 0.10000E+01 volume 0.24939E-02 ppm1 6.905 ppm2 1.296 CV 1
OR { 3654}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HD3 ))
OR { 3654}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 25 and name HD2 ))
ASSI { 3655}
( segid " " and resid 21 and name HD% )
( segid " " and resid 36 and name HD1%)
2.100 0.600 0.600 peak 3655 spectrum 1 weight 0.10000E+01 volume 0.56979E-02 ppm1 6.904 ppm2 1.003 CV 1
OR { 3655}
( segid " " and resid 21 and name HD% )
( segid " " and resid 32 and name HG2%)
ASSI { 3656}
( segid " " and resid 21 and name HD% )
( segid " " and resid 22 and name HD2%)
2.200 0.600 0.600 peak 3656 spectrum 1 weight 0.10000E+01 volume 0.56670E-02 ppm1 6.905 ppm2 0.953 CV 1
OR { 3656}
( segid " " and resid 21 and name HD% )
( segid " " and resid 36 and name HD1%)
OR { 3656}
( segid " " and resid 21 and name HD% )
( segid " " and resid 22 and name HD1%)
ASSI { 3661}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 23 and name HB% )
4.200 2.200 1.800 peak 3661 spectrum 1 weight 0.10000E+01 volume 0.72763E-03 ppm1 4.008 ppm2 1.442 CV 1
OR { 3661}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 35 and name HB% )
OR { 3661}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 25 and name HB2 ))
OR { 3661}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HB3 ))
ASSI { 3663}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 32 and name HG2%)
2.200 0.600 0.600 peak 3663 spectrum 1 weight 0.10000E+01 volume 0.56560E-02 ppm1 4.012 ppm2 1.017 CV 1
OR { 3663}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 36 and name HD1%)
ASSI { 3664}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 20 and name HB3 ))
3.800 1.800 1.800 peak 3664 spectrum 1 weight 0.10000E+01 volume 0.10020E-02 ppm1 4.017 ppm2 2.046 CV 1
OR { 3664}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HG ))
ASSI { 3666}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HA ))
4.200 2.200 1.800 peak 3666 spectrum 1 weight 0.10000E+01 volume 0.51315E-03 ppm1 4.013 ppm2 3.717 CV 1
OR { 3666}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 54 and name HA ))
ASSI { 3667}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 36 and name HD1%)
2.800 1.000 1.000 peak 3667 spectrum 1 weight 0.10000E+01 volume 0.19727E-02 ppm1 3.038 ppm2 0.992 CV 1
OR { 3667}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 22 and name HD2%)
OR { 3667}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 36 and name HD1%)
OR { 3667}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 32 and name HG2%)
OR { 3667}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 22 and name HD2%)
OR { 3667}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 22 and name HD1%)
ASSI { 3668}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 17 and name HG ))
4.000 2.000 2.000 peak 3668 spectrum 1 weight 0.10000E+01 volume 0.14416E-02 ppm1 3.034 ppm2 1.473 CV 1
OR { 3668}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 59 and name HG ))
OR { 3668}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 22 and name HB3 ))
OR { 3668}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 59 and name HG ))
OR { 3668}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 17 and name HG ))
OR { 3668}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 25 and name HB2 ))
OR { 3668}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 22 and name HB3 ))
ASSI { 3676}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 21 and name HA ))
4.300 2.300 1.700 peak 3676 spectrum 1 weight 0.10000E+01 volume 0.97006E-03 ppm1 6.843 ppm2 4.001 CV 1
OR { 3676}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 32 and name HA ))
ASSI { 3679}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 21 and name HB3 ))
3.800 1.800 1.800 peak 3679 spectrum 1 weight 0.10000E+01 volume 0.17605E-02 ppm1 6.843 ppm2 3.014 CV 1
OR { 3679}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 21 and name HB2 ))
OR { 3679}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 25 and name HE2 ))
ASSI { 3680}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 32 and name HB ))
4.800 2.900 1.200 peak 3680 spectrum 1 weight 0.10000E+01 volume 0.42059E-03 ppm1 6.840 ppm2 2.362 CV 1
OR { 3680}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 33 and name HB ))
ASSI { 3681}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 22 and name HG ))
5.100 3.200 0.900 peak 3681 spectrum 1 weight 0.10000E+01 volume 0.66937E-03 ppm1 6.845 ppm2 2.066 CV 1
OR { 3681}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 36 and name HG13))
OR { 3681}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 36 and name HB ))
OR { 3681}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 18 and name HB3 ))
ASSI { 3682}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 54 and name HG ))
5.100 3.300 0.900 peak 3682 spectrum 1 weight 0.10000E+01 volume 0.45945E-03 ppm1 6.847 ppm2 1.696 CV 1
OR { 3682}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 57 and name HB3 ))
OR { 3682}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 18 and name HG3 ))
ASSI { 3683}
( segid " " and resid 21 and name HE% )
( segid " " and resid 32 and name HG1%)
2.400 0.700 0.700 peak 3683 spectrum 1 weight 0.10000E+01 volume 0.64661E-02 ppm1 6.845 ppm2 1.301 CV 1
OR { 3683}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 25 and name HD3 ))
ASSI { 3684}
( segid " " and resid 21 and name HE% )
( segid " " and resid 59 and name HD2%)
2.900 1.100 1.100 peak 3684 spectrum 1 weight 0.10000E+01 volume 0.61690E-02 ppm1 6.844 ppm2 0.948 CV 1
OR { 3684}
( segid " " and resid 21 and name HE% )
( segid " " and resid 22 and name HD2%)
OR { 3684}
( segid " " and resid 21 and name HE% )
( segid " " and resid 36 and name HD1%)
ASSI { 3685}
( segid " " and resid 21 and name HE% )
( segid " " and resid 59 and name HD1%)
3.400 1.500 1.500 peak 3685 spectrum 1 weight 0.10000E+01 volume 0.18157E-02 ppm1 6.845 ppm2 0.832 CV 1
OR { 3685}
( segid " " and resid 21 and name HE% )
( segid " " and resid 55 and name HG1%)
ASSI { 3687}
( segid " " and resid 21 and name HE% )
( segid " " and resid 66 and name HD% )
4.300 2.300 1.700 peak 3687 spectrum 1 weight 0.10000E+01 volume 0.62714E-03 ppm1 6.842 ppm2 7.282 CV 1
OR { 3687}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 24 and name H ))
ASSI { 3690}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 22 and name H ))
5.300 3.600 0.700 peak 3690 spectrum 1 weight 0.10000E+01 volume 0.35216E-03 ppm1 6.845 ppm2 8.554 CV 1
OR { 3690}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 26 and name H ))
ASSI { 3691}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 33 and name H ))
6.000 4.600 0.000 peak 3691 spectrum 1 weight 0.10000E+01 volume 0.25160E-03 ppm1 6.846 ppm2 8.027 CV 1
OR { 3691}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 25 and name H ))
ASSI { 3692}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 24 and name H ))
5.000 3.200 1.000 peak 3692 spectrum 1 weight 0.10000E+01 volume 0.23101E-03 ppm1 6.895 ppm2 7.296 CV 1
OR { 3692}
( segid " " and resid 21 and name HD% )
( segid " " and resid 66 and name HD% )
ASSI { 3693}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 23 and name H ))
5.200 3.400 0.800 peak 3693 spectrum 1 weight 0.10000E+01 volume 0.22305E-03 ppm1 6.907 ppm2 7.836 CV 1
OR { 3693}
( segid " " and resid 21 and name HD% )
(( segid " " and resid 35 and name H ))
ASSI { 3695}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 24 and name HD21))
4.400 2.400 1.600 peak 3695 spectrum 1 weight 0.10000E+01 volume 0.37731E-03 ppm1 4.018 ppm2 8.085 CV 1
OR { 3695}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 25 and name H ))
OR { 3695}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 36 and name H ))
ASSI { 3696}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 25 and name H ))
4.800 2.800 1.200 peak 3696 spectrum 1 weight 0.10000E+01 volume 0.34501E-03 ppm1 4.004 ppm2 8.031 CV 1
OR { 3696}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 33 and name H ))
OR { 3696}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 19 and name H ))
ASSI { 3701}
(( segid " " and resid 47 and name HD2 ))
(( segid " " and resid 48 and name H ))
4.200 2.200 1.800 peak 3701 spectrum 1 weight 0.10000E+01 volume 0.10669E-02 ppm1 3.275 ppm2 8.309 CV 1
OR { 3701}
(( segid " " and resid 18 and name HD2 ))
(( segid " " and resid 18 and name H ))
OR { 3701}
(( segid " " and resid 47 and name HD3 ))
(( segid " " and resid 48 and name H ))
ASSI { 3703}
(( segid " " and resid 18 and name HG2 ))
(( segid " " and resid 19 and name H ))
3.500 1.500 1.500 peak 3703 spectrum 1 weight 0.10000E+01 volume 0.75412E-03 ppm1 1.639 ppm2 7.982 CV 1
OR { 3703}
(( segid " " and resid 18 and name HG2 ))
(( segid " " and resid 16 and name H ))
ASSI { 3704}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HD2 ))
3.300 1.400 1.400 peak 3704 spectrum 1 weight 0.10000E+01 volume 0.11928E-02 ppm1 3.788 ppm2 3.301 CV 1
OR { 3704}
(( segid " " and resid 127 and name HA ))
(( segid " " and resid 127 and name HD3 ))
OR { 3704}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HD3 ))
OR { 3704}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HD2 ))
ASSI { 3705}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HD2 ))
3.300 1.400 1.400 peak 3705 spectrum 1 weight 0.10000E+01 volume 0.11163E-02 ppm1 3.751 ppm2 3.296 CV 1
OR { 3705}
(( segid " " and resid 127 and name HA ))
(( segid " " and resid 127 and name HD3 ))
OR { 3705}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HD3 ))
ASSI { 3708}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HG2 ))
3.200 1.300 1.300 peak 3708 spectrum 1 weight 0.10000E+01 volume 0.35614E-02 ppm1 3.792 ppm2 1.635 CV 1
OR { 3708}
(( segid " " and resid 127 and name HA ))
(( segid " " and resid 130 and name HG ))
OR { 3708}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 37 and name HG ))
OR { 3708}
(( segid " " and resid 127 and name HA ))
(( segid " " and resid 130 and name HB3 ))
ASSI { 3709}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HB3 ))
2.600 0.800 0.800 peak 3709 spectrum 1 weight 0.10000E+01 volume 0.24912E-02 ppm1 3.792 ppm2 2.084 CV 1
OR { 3709}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 22 and name HG ))
ASSI { 3712}
(( segid " " and resid 98 and name HG ))
( segid " " and resid 98 and name HD1%)
1.900 0.400 0.400 peak 3712 spectrum 1 weight 0.10000E+01 volume 0.16950E-01 ppm1 1.669 ppm2 0.929 CV 1
OR { 3712}
(( segid " " and resid 86 and name HG3 ))
( segid " " and resid 82 and name HD1%)
OR { 3712}
(( segid " " and resid 86 and name HG3 ))
( segid " " and resid 82 and name HD2%)
ASSI { 3713}
(( segid " " and resid 113 and name HD2 ))
( segid " " and resid 74 and name HG2%)
2.600 0.800 0.800 peak 3713 spectrum 1 weight 0.10000E+01 volume 0.75811E-02 ppm1 3.334 ppm2 0.943 CV 1
OR { 3713}
(( segid " " and resid 113 and name HD3 ))
( segid " " and resid 74 and name HG2%)
OR { 3713}
(( segid " " and resid 18 and name HD3 ))
( segid " " and resid 22 and name HD1%)
OR { 3713}
(( segid " " and resid 18 and name HD3 ))
( segid " " and resid 22 and name HD2%)
OR { 3713}
(( segid " " and resid 18 and name HD3 ))
( segid " " and resid 59 and name HD2%)
ASSI { 3714}
(( segid " " and resid 113 and name HD2 ))
( segid " " and resid 74 and name HG1%)
3.000 1.100 1.100 peak 3714 spectrum 1 weight 0.10000E+01 volume 0.37729E-02 ppm1 3.333 ppm2 0.833 CV 1
OR { 3714}
(( segid " " and resid 113 and name HD3 ))
( segid " " and resid 74 and name HG1%)
OR { 3714}
(( segid " " and resid 18 and name HD3 ))
( segid " " and resid 59 and name HD1%)
ASSI { 3715}
(( segid " " and resid 111 and name HD2 ))
(( segid " " and resid 98 and name HB2 ))
3.400 1.500 1.500 peak 3715 spectrum 1 weight 0.10000E+01 volume 0.30066E-02 ppm1 3.329 ppm2 1.482 CV 1
OR { 3715}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 59 and name HG ))
OR { 3715}
(( segid " " and resid 111 and name HD2 ))
( segid " " and resid 112 and name HB% )
ASSI { 3716}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name HG2 ))
2.100 0.500 0.500 peak 3716 spectrum 1 weight 0.10000E+01 volume 0.89866E-02 ppm1 3.333 ppm2 1.639 CV 1
OR { 3716}
(( segid " " and resid 111 and name HD2 ))
(( segid " " and resid 111 and name HG3 ))
ASSI { 3717}
(( segid " " and resid 18 and name HD2 ))
(( segid " " and resid 18 and name HB2 ))
2.300 0.700 0.700 peak 3717 spectrum 1 weight 0.10000E+01 volume 0.64842E-02 ppm1 3.321 ppm2 1.832 CV 1
OR { 3717}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name HB2 ))
OR { 3717}
(( segid " " and resid 111 and name HD2 ))
(( segid " " and resid 111 and name HB3 ))
ASSI { 3718}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name HB3 ))
2.500 0.800 0.800 peak 3718 spectrum 1 weight 0.10000E+01 volume 0.35966E-02 ppm1 3.341 ppm2 2.082 CV 1
OR { 3718}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 22 and name HG ))
ASSI { 3719}
(( segid " " and resid 111 and name HD2 ))
(( segid " " and resid 99 and name HA2 ))
3.700 1.700 1.700 peak 3719 spectrum 1 weight 0.10000E+01 volume 0.16591E-02 ppm1 3.331 ppm2 3.777 CV 1
OR { 3719}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name HA ))
ASSI { 3720}
(( segid " " and resid 47 and name HD3 ))
(( segid " " and resid 47 and name HA ))
2.900 1.000 1.000 peak 3720 spectrum 1 weight 0.10000E+01 volume 0.21590E-02 ppm1 3.275 ppm2 3.769 CV 1
OR { 3720}
(( segid " " and resid 47 and name HD2 ))
(( segid " " and resid 47 and name HA ))
OR { 3720}
(( segid " " and resid 127 and name HD3 ))
(( segid " " and resid 127 and name HA ))
ASSI { 3721}
(( segid " " and resid 111 and name HD2 ))
(( segid " " and resid 111 and name HA ))
4.200 2.200 1.800 peak 3721 spectrum 1 weight 0.10000E+01 volume 0.82960E-03 ppm1 3.338 ppm2 4.012 CV 1
OR { 3721}
(( segid " " and resid 111 and name HD2 ))
(( segid " " and resid 98 and name HA ))
OR { 3721}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 19 and name HA ))
ASSI { 3725}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 23 and name HB% )
3.400 1.500 1.500 peak 3725 spectrum 1 weight 0.10000E+01 volume 0.28103E-02 ppm1 3.976 ppm2 1.457 CV 1
OR { 3725}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 22 and name HB3 ))
OR { 3725}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 35 and name HB% )
OR { 3725}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 87 and name HB3 ))
ASSI { 3730}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 14 and name HA ))
3.000 1.200 1.200 peak 3730 spectrum 1 weight 0.10000E+01 volume 0.97529E-03 ppm1 2.223 ppm2 3.970 CV 1
OR { 3730}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HA ))
ASSI { 3734}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 17 and name HB3 ))
3.000 1.100 1.100 peak 3734 spectrum 1 weight 0.10000E+01 volume 0.46908E-02 ppm1 1.073 ppm2 2.201 CV 1
OR { 3734}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 53 and name HB2 ))
OR { 3734}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 50 and name HB ))
ASSI { 3735}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 36 and name HB ))
3.300 1.400 1.400 peak 3735 spectrum 1 weight 0.10000E+01 volume 0.44213E-02 ppm1 1.072 ppm2 2.137 CV 1
OR { 3735}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 50 and name HB ))
OR { 3735}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 36 and name HG13))
ASSI { 3736}
( segid " " and resid 17 and name HD1%)
( segid " " and resid 57 and name HE% )
3.400 1.500 1.500 peak 3736 spectrum 1 weight 0.10000E+01 volume 0.36096E-02 ppm1 1.073 ppm2 1.979 CV 1
OR { 3736}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 54 and name HB3 ))
ASSI { 3738}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 54 and name HG ))
2.200 0.600 0.600 peak 3738 spectrum 1 weight 0.10000E+01 volume 0.54618E-02 ppm1 1.072 ppm2 1.766 CV 1
OR { 3738}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 17 and name HB2 ))
ASSI { 3741}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 17 and name HA ))
2.300 0.600 0.600 peak 3741 spectrum 1 weight 0.10000E+01 volume 0.65589E-02 ppm1 1.073 ppm2 3.966 CV 1
OR { 3741}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 37 and name HA ))
ASSI { 3743}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 36 and name HA ))
3.800 1.800 1.800 peak 3743 spectrum 1 weight 0.10000E+01 volume 0.17819E-02 ppm1 1.072 ppm2 3.671 CV 1
OR { 3743}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 54 and name HA ))
ASSI { 3744}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 14 and name HA ))
3.200 1.200 1.200 peak 3744 spectrum 1 weight 0.10000E+01 volume 0.40448E-02 ppm1 0.734 ppm2 3.976 CV 1
OR { 3744}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 17 and name HA ))
OR { 3744}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 53 and name HA ))
ASSI { 3745}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 50 and name HA ))
3.200 1.300 1.300 peak 3745 spectrum 1 weight 0.10000E+01 volume 0.19695E-02 ppm1 0.736 ppm2 3.779 CV 1
OR { 3745}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 18 and name HA ))
ASSI { 3750}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 14 and name HB2 ))
3.100 1.200 1.200 peak 3750 spectrum 1 weight 0.10000E+01 volume 0.14819E-02 ppm1 0.734 ppm2 2.380 CV 1
OR { 3750}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 13 and name HG3 ))
OR { 3750}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 13 and name HG2 ))
OR { 3750}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 33 and name HB ))
ASSI { 3751}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 53 and name HB2 ))
2.200 0.600 0.600 peak 3751 spectrum 1 weight 0.10000E+01 volume 0.63921E-02 ppm1 0.735 ppm2 2.207 CV 1
OR { 3751}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 17 and name HB3 ))
ASSI { 3753}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 17 and name HB2 ))
2.300 0.700 0.700 peak 3753 spectrum 1 weight 0.10000E+01 volume 0.61629E-02 ppm1 0.735 ppm2 1.761 CV 1
OR { 3753}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 54 and name HG ))
ASSI { 3757}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 40 and name H ))
4.700 2.800 1.300 peak 3757 spectrum 1 weight 0.10000E+01 volume 0.47305E-03 ppm1 1.070 ppm2 7.864 CV 1
OR { 3757}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 57 and name H ))
OR { 3757}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 35 and name H ))
ASSI { 3758}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 18 and name H ))
3.700 1.700 1.700 peak 3758 spectrum 1 weight 0.10000E+01 volume 0.16378E-02 ppm1 1.073 ppm2 8.300 CV 1
OR { 3758}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 54 and name H ))
ASSI { 3763}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 54 and name H ))
3.200 1.300 1.300 peak 3763 spectrum 1 weight 0.10000E+01 volume 0.23921E-02 ppm1 0.735 ppm2 8.299 CV 1
OR { 3763}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 18 and name H ))
ASSI { 3765}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 19 and name H ))
4.800 2.900 1.200 peak 3765 spectrum 1 weight 0.10000E+01 volume 0.69908E-03 ppm1 0.736 ppm2 7.984 CV 1
OR { 3765}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 16 and name H ))
OR { 3765}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 53 and name HE1 ))
ASSI { 3768}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 45 and name HE ))
3.700 1.700 1.700 peak 3768 spectrum 1 weight 0.10000E+01 volume 0.15634E-02 ppm1 0.736 ppm2 7.065 CV 1
OR { 3768}
( segid " " and resid 17 and name HD2%)
(( segid " " and resid 9 and name HE3 ))
OR { 3768}
( segid " " and resid 17 and name HD2%)
( segid " " and resid 66 and name HE% )
ASSI { 3778}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HE1 ))
5.400 3.700 0.600 peak 3778 spectrum 1 weight 0.10000E+01 volume 0.19041E-03 ppm1 7.304 ppm2 8.303 CV 1
OR { 3778}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 18 and name H ))
ASSI { 3779}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 19 and name H ))
4.800 2.900 1.200 peak 3779 spectrum 1 weight 0.10000E+01 volume 0.65791E-03 ppm1 7.302 ppm2 7.978 CV 1
OR { 3779}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name H ))
ASSI { 3784}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 15 and name H ))
5.100 3.200 0.900 peak 3784 spectrum 1 weight 0.10000E+01 volume 0.38980E-03 ppm1 3.390 ppm2 8.275 CV 1
OR { 3784}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HE1 ))
OR { 3784}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 15 and name H ))
OR { 3784}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HE1 ))
ASSI { 3785}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 15 and name H ))
4.700 2.800 1.300 peak 3785 spectrum 1 weight 0.10000E+01 volume 0.61872E-03 ppm1 3.333 ppm2 8.262 CV 1
OR { 3785}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 15 and name H ))
OR { 3785}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HE1 ))
ASSI { 3790}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 13 and name HA ))
3.700 1.700 1.700 peak 3790 spectrum 1 weight 0.10000E+01 volume 0.76690E-03 ppm1 3.337 ppm2 4.238 CV 1
OR { 3790}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 13 and name HA ))
OR { 3790}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 42 and name HB ))
OR { 3790}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 42 and name HB ))
ASSI { 3791}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 17 and name HA ))
4.700 2.700 1.300 peak 3791 spectrum 1 weight 0.10000E+01 volume 0.36326E-03 ppm1 3.400 ppm2 3.987 CV 1
OR { 3791}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 14 and name HA ))
OR { 3791}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 17 and name HA ))
OR { 3791}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 14 and name HA ))
OR { 3791}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 19 and name HA ))
ASSI { 3792}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 17 and name HA ))
4.200 2.200 1.800 peak 3792 spectrum 1 weight 0.10000E+01 volume 0.47952E-03 ppm1 3.329 ppm2 4.009 CV 1
OR { 3792}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 14 and name HA ))
OR { 3792}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 19 and name HA ))
ASSI { 3793}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 42 and name HB ))
5.300 3.500 0.700 peak 3793 spectrum 1 weight 0.10000E+01 volume 0.25246E-03 ppm1 7.302 ppm2 4.241 CV 1
OR { 3793}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 13 and name HA ))
OR { 3793}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 15 and name HA ))
ASSI { 3794}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 20 and name HA ))
4.500 2.600 1.500 peak 3794 spectrum 1 weight 0.10000E+01 volume 0.36451E-03 ppm1 7.301 ppm2 3.963 CV 1
OR { 3794}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 17 and name HA ))
ASSI { 3796}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 13 and name HG3 ))
4.100 2.100 1.900 peak 3796 spectrum 1 weight 0.10000E+01 volume 0.55638E-03 ppm1 3.355 ppm2 2.403 CV 1
OR { 3796}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 13 and name HG3 ))
OR { 3796}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 13 and name HG2 ))
OR { 3796}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 19 and name HG3 ))
OR { 3796}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 13 and name HB2 ))
OR { 3796}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 13 and name HG2 ))
OR { 3796}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 13 and name HB3 ))
OR { 3796}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 19 and name HG3 ))
ASSI { 3797}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 19 and name HB3 ))
4.800 2.900 1.200 peak 3797 spectrum 1 weight 0.10000E+01 volume 0.56794E-03 ppm1 3.341 ppm2 2.236 CV 1
OR { 3797}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 19 and name HB3 ))
OR { 3797}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 17 and name HB3 ))
ASSI { 3799}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 14 and name HB3 ))
5.400 3.700 0.600 peak 3799 spectrum 1 weight 0.10000E+01 volume 0.24304E-03 ppm1 3.391 ppm2 2.100 CV 1
OR { 3799}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 14 and name HG3 ))
OR { 3799}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 14 and name HB3 ))
OR { 3799}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 18 and name HB3 ))
OR { 3799}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 14 and name HG3 ))
OR { 3799}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 18 and name HB3 ))
ASSI { 3800}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 40 and name HB2 ))
5.100 3.200 0.900 peak 3800 spectrum 1 weight 0.10000E+01 volume 0.21242E-03 ppm1 3.403 ppm2 1.952 CV 1
OR { 3800}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 57 and name HE% )
OR { 3800}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 40 and name HB2 ))
OR { 3800}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 57 and name HE% )
ASSI { 3801}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 40 and name HG ))
5.400 3.700 0.600 peak 3801 spectrum 1 weight 0.10000E+01 volume 0.17838E-03 ppm1 3.366 ppm2 1.857 CV 1
OR { 3801}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 40 and name HB2 ))
OR { 3801}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 40 and name HG ))
OR { 3801}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 40 and name HB2 ))
OR { 3801}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 18 and name HB2 ))
ASSI { 3808}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 17 and name HD2%)
5.500 3.800 0.500 peak 3808 spectrum 1 weight 0.10000E+01 volume 0.25703E-03 ppm1 3.347 ppm2 0.746 CV 1
OR { 3808}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 17 and name HD2%)
OR { 3808}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 43 and name HG2%)
OR { 3808}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 43 and name HG1%)
ASSI { 3809}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 20 and name HB3 ))
5.600 3.900 0.400 peak 3809 spectrum 1 weight 0.10000E+01 volume 0.25541E-03 ppm1 7.299 ppm2 2.050 CV 1
OR { 3809}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 22 and name HG ))
OR { 3809}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 18 and name HB3 ))
ASSI { 3812}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 40 and name HG ))
4.800 2.900 1.200 peak 3812 spectrum 1 weight 0.10000E+01 volume 0.25655E-03 ppm1 7.304 ppm2 1.911 CV 1
OR { 3812}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 40 and name HB2 ))
OR { 3812}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 22 and name HB2 ))
ASSI { 3813}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 20 and name HG ))
4.300 2.300 1.700 peak 3813 spectrum 1 weight 0.10000E+01 volume 0.13258E-02 ppm1 7.301 ppm2 1.687 CV 1
OR { 3813}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 18 and name HG3 ))
ASSI { 3815}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 23 and name HB% )
5.600 4.000 0.400 peak 3815 spectrum 1 weight 0.10000E+01 volume 0.16093E-03 ppm1 7.295 ppm2 1.411 CV 1
OR { 3815}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 22 and name HB3 ))
ASSI { 3817}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 40 and name HD1%)
3.700 1.700 1.700 peak 3817 spectrum 1 weight 0.10000E+01 volume 0.13662E-02 ppm1 7.301 ppm2 0.970 CV 1
OR { 3817}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 40 and name HD2%)
OR { 3817}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 36 and name HG2%)
OR { 3817}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 22 and name HD1%)
ASSI { 3820}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HA ))
3.900 1.900 1.900 peak 3820 spectrum 1 weight 0.10000E+01 volume 0.97257E-03 ppm1 4.734 ppm2 3.937 CV 1
OR { 3820}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 14 and name HA ))
OR { 3820}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 20 and name HA ))
ASSI { 3825}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name H ))
2.700 0.900 0.900 peak 3825 spectrum 1 weight 0.10000E+01 volume 0.24372E-02 ppm1 4.726 ppm2 7.976 CV 1
OR { 3825}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 19 and name H ))
ASSI { 3826}
( segid " " and resid 15 and name HB% )
( segid " " and resid 22 and name HD1%)
4.400 2.400 1.600 peak 3826 spectrum 1 weight 0.10000E+01 volume 0.82566E-03 ppm1 1.574 ppm2 0.947 CV 1
OR { 3826}
( segid " " and resid 15 and name HB% )
( segid " " and resid 22 and name HD2%)
OR { 3826}
( segid " " and resid 15 and name HB% )
( segid " " and resid 40 and name HD1%)
OR { 3826}
( segid " " and resid 15 and name HB% )
( segid " " and resid 59 and name HD2%)
ASSI { 3828}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 14 and name HB2 ))
3.200 1.300 1.300 peak 3828 spectrum 1 weight 0.10000E+01 volume 0.27637E-02 ppm1 1.573 ppm2 2.433 CV 1
OR { 3828}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 19 and name HG2 ))
OR { 3828}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 13 and name HB3 ))
OR { 3828}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 13 and name HB2 ))
ASSI { 3830}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 14 and name HB3 ))
3.400 1.400 1.400 peak 3830 spectrum 1 weight 0.10000E+01 volume 0.34095E-02 ppm1 1.573 ppm2 2.099 CV 1
OR { 3830}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 18 and name HB3 ))
OR { 3830}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 14 and name HG3 ))
ASSI { 3832}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 18 and name HD3 ))
3.700 1.700 1.700 peak 3832 spectrum 1 weight 0.10000E+01 volume 0.18588E-02 ppm1 1.572 ppm2 3.351 CV 1
OR { 3832}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 16 and name HB3 ))
OR { 3832}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 16 and name HB2 ))
ASSI { 3834}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 14 and name HA ))
3.900 1.900 1.900 peak 3834 spectrum 1 weight 0.10000E+01 volume 0.15143E-02 ppm1 1.571 ppm2 4.004 CV 1
OR { 3834}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 19 and name HA ))
ASSI { 3837}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 14 and name H ))
4.000 2.000 2.000 peak 3837 spectrum 1 weight 0.10000E+01 volume 0.17600E-02 ppm1 1.571 ppm2 8.731 CV 1
OR { 3837}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 17 and name H ))
ASSI { 3838}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 12 and name H ))
3.100 3.100 2.900 peak 3838 spectrum 1 weight 0.10000E+01 volume 0.50667E-03 ppm1 1.572 ppm2 8.964 CV 1
OR { 3838}
( segid " " and resid 15 and name HB% )
(( segid " " and resid 21 and name H ))
ASSI { 3839}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 42 and name HG2%)
4.700 2.700 1.300 peak 3839 spectrum 1 weight 0.10000E+01 volume 0.50591E-03 ppm1 3.995 ppm2 1.274 CV 1
OR { 3839}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 114 and name HG12))
ASSI { 3840}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 17 and name HG ))
4.000 2.000 2.000 peak 3840 spectrum 1 weight 0.10000E+01 volume 0.15221E-02 ppm1 3.989 ppm2 1.468 CV 1
OR { 3840}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 98 and name HB2 ))
OR { 3840}
(( segid " " and resid 111 and name HA ))
( segid " " and resid 112 and name HB% )
ASSI { 3841}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 111 and name HG3 ))
3.200 1.300 1.300 peak 3841 spectrum 1 weight 0.10000E+01 volume 0.20049E-02 ppm1 3.993 ppm2 1.619 CV 1
OR { 3841}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 51 and name HB ))
ASSI { 3842}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 17 and name HB2 ))
2.500 0.800 0.800 peak 3842 spectrum 1 weight 0.10000E+01 volume 0.29837E-02 ppm1 3.988 ppm2 1.754 CV 1
OR { 3842}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 111 and name HG2 ))
ASSI { 3844}
(( segid " " and resid 111 and name HA ))
( segid " " and resid 102 and name HE% )
2.600 0.800 0.800 peak 3844 spectrum 1 weight 0.10000E+01 volume 0.43588E-02 ppm1 3.986 ppm2 2.160 CV 1
OR { 3844}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HG3 ))
ASSI { 3845}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB2 ))
3.000 1.100 1.100 peak 3845 spectrum 1 weight 0.10000E+01 volume 0.21626E-02 ppm1 3.984 ppm2 2.398 CV 1
OR { 3845}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 80 and name HB2 ))
OR { 3845}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 13 and name HB3 ))
OR { 3845}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 13 and name HG3 ))
ASSI { 3846}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HG2 ))
3.000 1.100 1.100 peak 3846 spectrum 1 weight 0.10000E+01 volume 0.14841E-02 ppm1 3.982 ppm2 2.855 CV 1
OR { 3846}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HG2 ))
ASSI { 3853}
(( segid " " and resid 135 and name HB3 ))
(( segid " " and resid 136 and name HE2 ))
3.900 1.900 1.900 peak 3853 spectrum 1 weight 0.10000E+01 volume 0.68413E-03 ppm1 2.086 ppm2 3.017 CV 1
OR { 3853}
(( segid " " and resid 135 and name HB3 ))
(( segid " " and resid 136 and name HE3 ))
OR { 3853}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 64 and name HE3 ))
OR { 3853}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 64 and name HE2 ))
ASSI { 3856}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 43 and name H ))
5.100 3.300 0.900 peak 3856 spectrum 1 weight 0.10000E+01 volume 0.34391E-03 ppm1 2.844 ppm2 7.992 CV 1
OR { 3856}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 16 and name H ))
OR { 3856}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 43 and name H ))
ASSI { 3857}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 15 and name H ))
4.800 2.900 1.200 peak 3857 spectrum 1 weight 0.10000E+01 volume 0.47833E-03 ppm1 2.846 ppm2 8.276 CV 1
OR { 3857}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 18 and name H ))
OR { 3857}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 16 and name HE1 ))
ASSI { 3866}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 14 and name H ))
3.600 1.600 1.600 peak 3866 spectrum 1 weight 0.10000E+01 volume 0.90720E-03 ppm1 4.252 ppm2 8.745 CV 1
OR { 3866}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 17 and name H ))
ASSI { 3867}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name H ))
3.100 1.200 1.200 peak 3867 spectrum 1 weight 0.10000E+01 volume 0.14871E-02 ppm1 4.251 ppm2 8.017 CV 1
OR { 3867}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 16 and name H ))
ASSI { 3870}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 13 and name H ))
3.700 1.700 1.700 peak 3870 spectrum 1 weight 0.10000E+01 volume 0.24348E-02 ppm1 2.431 ppm2 8.025 CV 1
OR { 3870}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name H ))
OR { 3870}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 43 and name H ))
OR { 3870}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 43 and name H ))
ASSI { 3874}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 16 and name HB2 ))
3.800 1.800 1.800 peak 3874 spectrum 1 weight 0.10000E+01 volume 0.55256E-03 ppm1 2.437 ppm2 3.370 CV 1
OR { 3874}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 16 and name HB3 ))
OR { 3874}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 16 and name HB2 ))
OR { 3874}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 16 and name HB3 ))
OR { 3874}
(( segid " " and resid 129 and name HG3 ))
(( segid " " and resid 115 and name HA ))
ASSI { 3875}
(( segid " " and resid 129 and name HG3 ))
(( segid " " and resid 128 and name HD3 ))
3.700 3.700 2.300 peak 3875 spectrum 1 weight 0.10000E+01 volume 0.70528E-03 ppm1 2.387 ppm2 3.204 CV 1
OR { 3875}
(( segid " " and resid 129 and name HG2 ))
(( segid " " and resid 127 and name HD2 ))
OR { 3875}
(( segid " " and resid 129 and name HG3 ))
(( segid " " and resid 127 and name HD2 ))
ASSI { 3876}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 12 and name HA ))
2.900 1.000 1.000 peak 3876 spectrum 1 weight 0.10000E+01 volume 0.46331E-02 ppm1 2.443 ppm2 4.145 CV 1
OR { 3876}
(( segid " " and resid 129 and name HG3 ))
(( segid " " and resid 129 and name HA ))
OR { 3876}
(( segid " " and resid 129 and name HG2 ))
(( segid " " and resid 129 and name HA ))
ASSI { 3882}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 12 and name HG2 ))
2.300 0.700 0.700 peak 3882 spectrum 1 weight 0.10000E+01 volume 0.87027E-02 ppm1 1.975 ppm2 2.452 CV 1
OR { 3882}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 13 and name HB2 ))
ASSI { 3891}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 14 and name HG3 ))
3.600 1.600 1.600 peak 3891 spectrum 1 weight 0.10000E+01 volume 0.19221E-02 ppm1 4.513 ppm2 2.133 CV 1
OR { 3891}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HG2 ))
ASSI { 3893}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HD2 ))
4.300 2.300 1.700 peak 3893 spectrum 1 weight 0.10000E+01 volume 0.44153E-03 ppm1 4.533 ppm2 4.017 CV 1
OR { 3893}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HD3 ))
OR { 3893}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 14 and name HA ))
ASSI { 3894}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 12 and name HA ))
4.100 2.100 1.900 peak 3894 spectrum 1 weight 0.10000E+01 volume 0.44350E-03 ppm1 4.527 ppm2 4.163 CV 1
OR { 3894}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 15 and name HA ))
ASSI { 3904}
(( segid " " and resid 11 and name HG2 ))
(( segid " " and resid 11 and name HA ))
4.600 2.700 1.400 peak 3904 spectrum 1 weight 0.10000E+01 volume 0.59574E-03 ppm1 2.143 ppm2 4.524 CV 1
OR { 3904}
(( segid " " and resid 11 and name HG2 ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 3906}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 10 and name HB2 ))
3.800 1.800 1.800 peak 3906 spectrum 1 weight 0.10000E+01 volume 0.49345E-03 ppm1 3.994 ppm2 4.498 CV 1
OR { 3906}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 10 and name HB2 ))
OR { 3906}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 11 and name HA ))
ASSI { 3920}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HB3 ))
2.700 0.900 0.900 peak 3920 spectrum 1 weight 0.10000E+01 volume 0.11353E-02 ppm1 4.478 ppm2 4.037 CV 1
OR { 3920}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 11 and name HD2 ))
ASSI { 3921}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 12 and name HB2 ))
4.800 2.900 1.200 peak 3921 spectrum 1 weight 0.10000E+01 volume 0.60643E-03 ppm1 4.058 ppm2 2.136 CV 1
OR { 3921}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 11 and name HG2 ))
ASSI { 3922}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 13 and name HB3 ))
4.600 2.700 1.400 peak 3922 spectrum 1 weight 0.10000E+01 volume 0.65730E-03 ppm1 4.066 ppm2 2.428 CV 1
OR { 3922}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 13 and name HB2 ))
OR { 3922}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 12 and name HG2 ))
OR { 3922}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 3924}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 13 and name HB3 ))
4.500 2.600 1.500 peak 3924 spectrum 1 weight 0.10000E+01 volume 0.53488E-03 ppm1 4.489 ppm2 2.410 CV 1
OR { 3924}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 13 and name HB2 ))
OR { 3924}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 12 and name HG2 ))
OR { 3924}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 3929}
(( segid " " and resid 9 and name HD1 ))
(( segid " " and resid 53 and name HB2 ))
4.700 2.700 1.300 peak 3929 spectrum 1 weight 0.10000E+01 volume 0.27481E-03 ppm1 6.974 ppm2 2.230 CV 1
OR { 3929}
(( segid " " and resid 9 and name HD1 ))
(( segid " " and resid 17 and name HB3 ))
OR { 3929}
(( segid " " and resid 9 and name HD1 ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 3930}
(( segid " " and resid 9 and name HD1 ))
( segid " " and resid 8 and name HG2%)
3.200 1.300 1.300 peak 3930 spectrum 1 weight 0.10000E+01 volume 0.61848E-03 ppm1 6.974 ppm2 1.251 CV 1
OR { 3930}
(( segid " " and resid 9 and name HD1 ))
( segid " " and resid 42 and name HG2%)
ASSI { 3933}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 8 and name HA ))
4.000 2.000 2.000 peak 3933 spectrum 1 weight 0.10000E+01 volume 0.10330E-02 ppm1 4.493 ppm2 4.246 CV 1
OR { 3933}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 8 and name HB ))
OR { 3933}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 13 and name HA ))
ASSI { 3936}
(( segid " " and resid 9 and name HZ3 ))
( segid " " and resid 43 and name HG2%)
3.900 1.900 1.900 peak 3936 spectrum 1 weight 0.10000E+01 volume 0.84795E-03 ppm1 6.806 ppm2 0.737 CV 1
OR { 3936}
(( segid " " and resid 9 and name HZ3 ))
( segid " " and resid 17 and name HD2%)
OR { 3936}
(( segid " " and resid 9 and name HZ3 ))
( segid " " and resid 43 and name HG1%)
ASSI { 3938}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 40 and name HB3 ))
5.800 4.300 0.200 peak 3938 spectrum 1 weight 0.10000E+01 volume 0.19408E-03 ppm1 6.810 ppm2 1.492 CV 1
OR { 3938}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 17 and name HG ))
ASSI { 3942}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 14 and name HG2 ))
5.000 3.100 1.000 peak 3942 spectrum 1 weight 0.10000E+01 volume 0.27958E-03 ppm1 6.807 ppm2 2.882 CV 1
OR { 3942}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 9 and name HB2 ))
OR { 3942}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 9 and name HB3 ))
ASSI { 3943}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 14 and name HA ))
4.100 2.100 1.900 peak 3943 spectrum 1 weight 0.10000E+01 volume 0.28315E-03 ppm1 6.812 ppm2 3.970 CV 1
OR { 3943}
(( segid " " and resid 9 and name HZ3 ))
(( segid " " and resid 17 and name HA ))
ASSI { 3946}
(( segid " " and resid 9 and name HH2 ))
( segid " " and resid 40 and name HD2%)
3.400 1.400 1.400 peak 3946 spectrum 1 weight 0.10000E+01 volume 0.17916E-02 ppm1 6.714 ppm2 0.911 CV 1
OR { 3946}
(( segid " " and resid 9 and name HH2 ))
( segid " " and resid 50 and name HD1%)
OR { 3946}
(( segid " " and resid 9 and name HH2 ))
( segid " " and resid 50 and name HG2%)
ASSI { 3948}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 40 and name HB2 ))
5.600 4.000 0.400 peak 3948 spectrum 1 weight 0.10000E+01 volume 0.19260E-03 ppm1 6.724 ppm2 1.887 CV 1
OR { 3948}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 40 and name HG ))
OR { 3948}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 37 and name HB3 ))
ASSI { 3949}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 17 and name HB3 ))
5.000 3.200 1.000 peak 3949 spectrum 1 weight 0.10000E+01 volume 0.34442E-03 ppm1 6.718 ppm2 2.200 CV 1
OR { 3949}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 53 and name HB2 ))
ASSI { 3950}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 14 and name HG2 ))
4.600 2.600 1.400 peak 3950 spectrum 1 weight 0.10000E+01 volume 0.19039E-03 ppm1 6.697 ppm2 2.858 CV 1
OR { 3950}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 45 and name HD3 ))
OR { 3950}
(( segid " " and resid 9 and name HH2 ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 3953}
(( segid " " and resid 9 and name HZ2 ))
( segid " " and resid 50 and name HD1%)
3.300 1.300 1.300 peak 3953 spectrum 1 weight 0.10000E+01 volume 0.19238E-02 ppm1 6.921 ppm2 0.902 CV 1
OR { 3953}
(( segid " " and resid 9 and name HZ2 ))
( segid " " and resid 40 and name HD2%)
OR { 3953}
(( segid " " and resid 9 and name HZ2 ))
( segid " " and resid 50 and name HG2%)
ASSI { 3955}
(( segid " " and resid 9 and name HZ2 ))
( segid " " and resid 57 and name HE% )
5.500 3.800 0.500 peak 3955 spectrum 1 weight 0.10000E+01 volume 0.24026E-03 ppm1 6.918 ppm2 1.967 CV 1
OR { 3955}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 54 and name HB3 ))
ASSI { 3956}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 45 and name HB3 ))
4.400 2.400 1.600 peak 3956 spectrum 1 weight 0.10000E+01 volume 0.54700E-03 ppm1 6.921 ppm2 1.692 CV 1
OR { 3956}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 45 and name HB2 ))
OR { 3956}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 54 and name HG ))
OR { 3956}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 56 and name HB2 ))
ASSI { 3957}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 50 and name HG13))
3.800 1.800 1.800 peak 3957 spectrum 1 weight 0.10000E+01 volume 0.59712E-03 ppm1 6.924 ppm2 1.648 CV 1
OR { 3957}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 45 and name HB3 ))
OR { 3957}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 45 and name HB2 ))
ASSI { 3958}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 50 and name HG13))
3.900 1.900 1.900 peak 3958 spectrum 1 weight 0.10000E+01 volume 0.57415E-03 ppm1 6.925 ppm2 1.559 CV 1
OR { 3958}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 50 and name HG12))
OR { 3958}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 45 and name HG2 ))
ASSI { 3962}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 53 and name HB2 ))
3.500 1.500 1.500 peak 3962 spectrum 1 weight 0.10000E+01 volume 0.12022E-02 ppm1 6.920 ppm2 2.215 CV 1
OR { 3962}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 17 and name HB3 ))
OR { 3962}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 3963}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 45 and name HD3 ))
3.600 1.600 1.600 peak 3963 spectrum 1 weight 0.10000E+01 volume 0.79975E-03 ppm1 6.919 ppm2 2.880 CV 1
OR { 3963}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 53 and name HB3 ))
OR { 3963}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 14 and name HG2 ))
ASSI { 3965}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 14 and name HA ))
5.600 3.900 0.400 peak 3965 spectrum 1 weight 0.10000E+01 volume 0.18298E-03 ppm1 6.925 ppm2 4.007 CV 1
OR { 3965}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 53 and name HA ))
OR { 3965}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 17 and name HA ))
ASSI { 3967}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 50 and name H ))
4.500 2.500 1.500 peak 3967 spectrum 1 weight 0.10000E+01 volume 0.43400E-03 ppm1 6.922 ppm2 8.200 CV 1
OR { 3967}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 52 and name H ))
OR { 3967}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 42 and name H ))
ASSI { 3968}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 53 and name H ))
4.400 2.400 1.600 peak 3968 spectrum 1 weight 0.10000E+01 volume 0.50026E-03 ppm1 6.920 ppm2 8.141 CV 1
OR { 3968}
(( segid " " and resid 9 and name HZ2 ))
(( segid " " and resid 42 and name H ))
ASSI { 3975}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 43 and name H ))
6.000 5.000 0.000 peak 3975 spectrum 1 weight 0.10000E+01 volume 0.12138E-03 ppm1 2.887 ppm2 7.953 CV 1
OR { 3975}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 16 and name H ))
OR { 3975}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 43 and name H ))
OR { 3975}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 16 and name H ))
ASSI { 3980}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 7 and name HA ))
4.000 2.000 2.000 peak 3980 spectrum 1 weight 0.10000E+01 volume 0.10687E-02 ppm1 4.236 ppm2 4.457 CV 1
OR { 3980}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HA ))
ASSI { 3981}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 9 and name HA ))
4.200 2.200 1.800 peak 3981 spectrum 1 weight 0.10000E+01 volume 0.10835E-02 ppm1 4.207 ppm2 4.460 CV 1
OR { 3981}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 7 and name HA ))
ASSI { 3982}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name H ))
2.900 2.900 3.100 peak 3982 spectrum 1 weight 0.10000E+01 volume 0.22218E-02 ppm1 1.250 ppm2 8.337 CV 1
OR { 3982}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 48 and name H ))
ASSI { 3988}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 7 and name HA ))
3.400 1.400 1.400 peak 3988 spectrum 1 weight 0.10000E+01 volume 0.31264E-02 ppm1 1.247 ppm2 4.476 CV 1
OR { 3988}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 40 and name HA ))
ASSI { 3990}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 9 and name HE1 ))
4.500 2.500 1.500 peak 3990 spectrum 1 weight 0.10000E+01 volume 0.58121E-03 ppm1 1.251 ppm2 0.130 CV 1
OR { 3990}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 9 and name HE1 ))
ASSI { 4010}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 54 and name HB2 ))
4.800 2.900 1.200 peak 4010 spectrum 1 weight 0.10000E+01 volume 0.60742E-03 ppm1 4.566 ppm2 0.749 CV 1
OR { 4010}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 43 and name HG1%)
OR { 4010}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 55 and name HG2%)
ASSI { 4011}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HB2 ))
4.000 2.000 2.000 peak 4011 spectrum 1 weight 0.10000E+01 volume 0.12535E-02 ppm1 4.560 ppm2 1.716 CV 1
OR { 4011}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 54 and name HG ))
ASSI { 4012}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HB3 ))
3.500 1.500 1.500 peak 4012 spectrum 1 weight 0.10000E+01 volume 0.90063E-03 ppm1 4.559 ppm2 1.833 CV 1
OR { 4012}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 44 and name HB2 ))
ASSI { 4020}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 7 and name HG3 ))
3.800 1.800 1.800 peak 4020 spectrum 1 weight 0.10000E+01 volume 0.32195E-02 ppm1 1.338 ppm2 1.945 CV 1
OR { 4020}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 44 and name HG3 ))
OR { 4020}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 7 and name HG2 ))
ASSI { 4023}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 45 and name HD3 ))
4.100 2.100 1.900 peak 4023 spectrum 1 weight 0.10000E+01 volume 0.70020E-03 ppm1 1.337 ppm2 2.860 CV 1
OR { 4023}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 9 and name HB3 ))
ASSI { 4024}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 5 and name HD3 ))
2.600 2.600 3.400 peak 4024 spectrum 1 weight 0.10000E+01 volume 0.73442E-03 ppm1 1.338 ppm2 3.202 CV 1
OR { 4024}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 5 and name HD2 ))
OR { 4024}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 4 and name HD2 ))
OR { 4024}
( segid " " and resid 6 and name HB% )
(( segid " " and resid 47 and name HD3 ))
ASSI { 4037}
( segid " " and resid 118 and name HD1%)
( segid " " and resid 88 and name HE% )
4.400 2.400 1.600 peak 4037 spectrum 1 weight 0.10000E+01 volume 0.11182E-02 ppm1 0.504 ppm2 7.200 CV 1
OR { 4037}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 85 and name HE22))
ASSI { 4039}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 85 and name HE21))
4.800 2.800 1.200 peak 4039 spectrum 1 weight 0.10000E+01 volume 0.56955E-03 ppm1 0.506 ppm2 6.799 CV 1
OR { 4039}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 124 and name H ))
ASSI { 4040}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 88 and name H ))
3.100 3.100 2.900 peak 4040 spectrum 1 weight 0.10000E+01 volume 0.72038E-03 ppm1 0.503 ppm2 8.887 CV 1
OR { 4040}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 125 and name H ))
ASSI { 4042}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 121 and name H ))
3.900 1.900 1.900 peak 4042 spectrum 1 weight 0.10000E+01 volume 0.11265E-02 ppm1 0.505 ppm2 8.138 CV 1
OR { 4042}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 120 and name H ))
ASSI { 4043}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 119 and name H ))
4.300 2.300 1.700 peak 4043 spectrum 1 weight 0.10000E+01 volume 0.77529E-03 ppm1 0.505 ppm2 7.871 CV 1
OR { 4043}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 122 and name H ))
ASSI { 4047}
( segid " " and resid 118 and name HD2%)
(( segid " " and resid 117 and name H ))
4.900 2.900 1.100 peak 4047 spectrum 1 weight 0.10000E+01 volume 0.63953E-03 ppm1 0.760 ppm2 7.543 CV 1
OR { 4047}
( segid " " and resid 118 and name HD2%)
(( segid " " and resid 123 and name H ))
ASSI { 4049}
( segid " " and resid 118 and name HD2%)
(( segid " " and resid 115 and name H ))
4.200 2.200 1.800 peak 4049 spectrum 1 weight 0.10000E+01 volume 0.64270E-03 ppm1 0.758 ppm2 8.560 CV 1
OR { 4049}
( segid " " and resid 118 and name HD2%)
(( segid " " and resid 98 and name H ))
ASSI { 4051}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 73 and name HA ))
4.200 2.300 1.800 peak 4051 spectrum 1 weight 0.10000E+01 volume 0.85640E-03 ppm1 0.504 ppm2 4.130 CV 1
OR { 4051}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 119 and name HA ))
OR { 4051}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 121 and name HA ))
ASSI { 4060}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 84 and name HG ))
3.100 1.200 1.200 peak 4060 spectrum 1 weight 0.10000E+01 volume 0.34435E-02 ppm1 0.503 ppm2 1.463 CV 1
OR { 4060}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 121 and name HB3 ))
ASSI { 4061}
( segid " " and resid 118 and name HD1%)
(( segid " " and resid 123 and name HB2 ))
2.300 0.600 0.600 peak 4061 spectrum 1 weight 0.10000E+01 volume 0.77549E-02 ppm1 0.503 ppm2 1.051 CV 1
OR { 4061}
( segid " " and resid 118 and name HD1%)
( segid " " and resid 84 and name HD1%)
ASSI { 4062}
( segid " " and resid 118 and name HD1%)
( segid " " and resid 114 and name HG2%)
2.300 0.600 0.600 peak 4062 spectrum 1 weight 0.10000E+01 volume 0.89511E-02 ppm1 0.504 ppm2 0.955 CV 1
OR { 4062}
( segid " " and resid 118 and name HD1%)
( segid " " and resid 130 and name HD2%)
ASSI { 4063}
( segid " " and resid 118 and name HD1%)
( segid " " and resid 118 and name HD2%)
2.000 0.500 0.500 peak 4063 spectrum 1 weight 0.10000E+01 volume 0.10676E-01 ppm1 0.503 ppm2 0.770 CV 1
OR { 4063}
( segid " " and resid 118 and name HD1%)
( segid " " and resid 121 and name HD1%)
OR { 4063}
( segid " " and resid 118 and name HD1%)
( segid " " and resid 123 and name HD1%)
ASSI { 4064}
( segid " " and resid 118 and name HD2%)
( segid " " and resid 114 and name HG2%)
1.900 0.500 0.500 peak 4064 spectrum 1 weight 0.10000E+01 volume 0.18323E-01 ppm1 0.753 ppm2 0.963 CV 1
OR { 4064}
( segid " " and resid 118 and name HD2%)
( segid " " and resid 130 and name HD2%)
ASSI { 4065}
( segid " " and resid 118 and name HD2%)
( segid " " and resid 118 and name HD1%)
2.100 0.600 0.600 peak 4065 spectrum 1 weight 0.10000E+01 volume 0.10297E-01 ppm1 0.755 ppm2 0.514 CV 1
OR { 4065}
( segid " " and resid 118 and name HD2%)
( segid " " and resid 124 and name HG1%)
ASSI { 4067}
(( segid " " and resid 118 and name HG ))
( segid " " and resid 118 and name HD1%)
2.600 0.900 0.900 peak 4067 spectrum 1 weight 0.10000E+01 volume 0.17765E-02 ppm1 1.889 ppm2 0.517 CV 1
OR { 4067}
(( segid " " and resid 118 and name HG ))
( segid " " and resid 124 and name HG1%)
ASSI { 4068}
(( segid " " and resid 118 and name HG ))
( segid " " and resid 118 and name HD2%)
2.500 0.800 0.800 peak 4068 spectrum 1 weight 0.10000E+01 volume 0.32125E-02 ppm1 1.881 ppm2 0.760 CV 1
OR { 4068}
(( segid " " and resid 118 and name HG ))
( segid " " and resid 123 and name HD1%)
ASSI { 4073}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB3 ))
2.800 1.000 1.000 peak 4073 spectrum 1 weight 0.10000E+01 volume 0.25268E-02 ppm1 4.265 ppm2 1.479 CV 1
OR { 4073}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 90 and name HB3 ))
ASSI { 4074}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 87 and name HD1%)
4.000 2.000 2.000 peak 4074 spectrum 1 weight 0.10000E+01 volume 0.56998E-03 ppm1 2.215 ppm2 1.085 CV 1
OR { 4074}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 84 and name HD1%)
ASSI { 4075}
(( segid " " and resid 87 and name HB3 ))
( segid " " and resid 101 and name HD1%)
3.200 1.300 1.300 peak 4075 spectrum 1 weight 0.10000E+01 volume 0.14769E-02 ppm1 1.516 ppm2 1.020 CV 1
OR { 4075}
(( segid " " and resid 87 and name HB3 ))
( segid " " and resid 101 and name HG2%)
OR { 4075}
(( segid " " and resid 87 and name HB3 ))
( segid " " and resid 87 and name HD2%)
ASSI { 4079}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HB3 ))
2.700 0.900 0.900 peak 4079 spectrum 1 weight 0.10000E+01 volume 0.47924E-02 ppm1 1.090 ppm2 2.027 CV 1
OR { 4079}
( segid " " and resid 115 and name HG1%)
(( segid " " and resid 118 and name HB2 ))
ASSI { 4080}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HA ))
3.100 1.200 1.200 peak 4080 spectrum 1 weight 0.10000E+01 volume 0.19318E-02 ppm1 1.031 ppm2 4.236 CV 1
OR { 4080}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 105 and name HA ))
ASSI { 4084}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 83 and name HB2 ))
2.700 0.900 0.900 peak 4084 spectrum 1 weight 0.10000E+01 volume 0.13806E-02 ppm1 1.032 ppm2 2.420 CV 1
OR { 4084}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 83 and name HG3 ))
OR { 4084}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 89 and name HG2 ))
OR { 4084}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 109 and name HD3 ))
ASSI { 4088}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 84 and name H ))
3.800 1.800 1.800 peak 4088 spectrum 1 weight 0.10000E+01 volume 0.10983E-02 ppm1 1.031 ppm2 8.074 CV 1
OR { 4088}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 105 and name H ))
ASSI { 4094}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 24 and name H ))
4.200 2.200 1.800 peak 4094 spectrum 1 weight 0.10000E+01 volume 0.49925E-03 ppm1 3.955 ppm2 7.280 CV 1
OR { 4094}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 16 and name HD2 ))
ASSI { 4101}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 53 and name HB2 ))
3.200 1.300 1.300 peak 4101 spectrum 1 weight 0.10000E+01 volume 0.14203E-02 ppm1 5.765 ppm2 2.174 CV 1
OR { 4101}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 14 and name HG3 ))
ASSI { 4102}
(( segid " " and resid 53 and name HD2 ))
( segid " " and resid 57 and name HE% )
2.400 2.400 3.600 peak 4102 spectrum 1 weight 0.10000E+01 volume 0.88520E-03 ppm1 5.764 ppm2 1.986 CV 1
OR { 4102}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 57 and name HG2 ))
OR { 4102}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 11 and name HB3 ))
ASSI { 4104}
(( segid " " and resid 53 and name HD2 ))
( segid " " and resid 40 and name HD1%)
2.700 2.700 3.300 peak 4104 spectrum 1 weight 0.10000E+01 volume 0.43515E-03 ppm1 5.768 ppm2 0.945 CV 1
OR { 4104}
(( segid " " and resid 53 and name HD2 ))
( segid " " and resid 40 and name HD2%)
OR { 4104}
(( segid " " and resid 53 and name HD2 ))
( segid " " and resid 50 and name HG2%)
OR { 4104}
(( segid " " and resid 53 and name HD2 ))
( segid " " and resid 36 and name HG2%)
ASSI { 4106}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 17 and name HG ))
3.000 3.000 3.000 peak 4106 spectrum 1 weight 0.10000E+01 volume 0.23013E-03 ppm1 5.761 ppm2 1.484 CV 1
OR { 4106}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 45 and name HG2 ))
ASSI { 4110}
(( segid " " and resid 117 and name HD3 ))
(( segid " " and resid 73 and name H ))
2.600 2.600 3.400 peak 4110 spectrum 1 weight 0.10000E+01 volume 0.55657E-03 ppm1 0.559 ppm2 8.142 CV 1
OR { 4110}
(( segid " " and resid 117 and name HD3 ))
(( segid " " and resid 116 and name H ))
OR { 4110}
(( segid " " and resid 117 and name HD3 ))
(( segid " " and resid 120 and name H ))
OR { 4110}
(( segid " " and resid 117 and name HD3 ))
(( segid " " and resid 114 and name H ))
ASSI { 4114}
(( segid " " and resid 117 and name HD2 ))
(( segid " " and resid 117 and name HD3 ))
2.100 0.600 0.600 peak 4114 spectrum 1 weight 0.10000E+01 volume 0.28036E-02 ppm1 1.169 ppm2 0.583 CV 1
OR { 4114}
(( segid " " and resid 73 and name HG12))
( segid " " and resid 121 and name HD2%)
ASSI { 4122}
(( segid " " and resid 76 and name HH2 ))
( segid " " and resid 105 and name HD1%)
3.300 1.400 1.400 peak 4122 spectrum 1 weight 0.10000E+01 volume 0.81840E-03 ppm1 6.884 ppm2 1.065 CV 1
OR { 4122}
(( segid " " and resid 76 and name HH2 ))
( segid " " and resid 84 and name HD1%)
ASSI { 4123}
(( segid " " and resid 76 and name HH2 ))
(( segid " " and resid 84 and name HG ))
4.400 2.500 1.600 peak 4123 spectrum 1 weight 0.10000E+01 volume 0.21587E-03 ppm1 6.898 ppm2 1.467 CV 1
OR { 4123}
(( segid " " and resid 76 and name HH2 ))
(( segid " " and resid 109 and name HG3 ))
ASSI { 4128}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 88 and name H ))
6.000 4.900 0.000 peak 4128 spectrum 1 weight 0.10000E+01 volume 0.14846E-03 ppm1 7.201 ppm2 8.902 CV 1
OR { 4128}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 125 and name H ))
ASSI { 4129}
(( segid " " and resid 53 and name HE1 ))
(( segid " " and resid 49 and name HB3 ))
4.600 2.700 1.400 peak 4129 spectrum 1 weight 0.10000E+01 volume 0.25653E-03 ppm1 7.950 ppm2 2.156 CV 1
OR { 4129}
(( segid " " and resid 53 and name HE1 ))
(( segid " " and resid 53 and name HB2 ))
OR { 4129}
(( segid " " and resid 53 and name HE1 ))
(( segid " " and resid 56 and name HG3 ))
ASSI { 4137}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 130 and name H ))
5.000 3.200 1.000 peak 4137 spectrum 1 weight 0.10000E+01 volume 0.31689E-03 ppm1 7.188 ppm2 7.756 CV 1
OR { 4137}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 91 and name H ))
ASSI { 4139}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 130 and name HA ))
5.200 3.400 0.800 peak 4139 spectrum 1 weight 0.10000E+01 volume 0.14425E-03 ppm1 7.204 ppm2 4.274 CV 1
OR { 4139}
( segid " " and resid 88 and name HE% )
(( segid " " and resid 124 and name HA ))
ASSI { 4146}
(( segid " " and resid 76 and name HZ3 ))
( segid " " and resid 84 and name HD1%)
4.000 2.000 2.000 peak 4146 spectrum 1 weight 0.10000E+01 volume 0.56046E-03 ppm1 7.048 ppm2 1.068 CV 1
OR { 4146}
(( segid " " and resid 76 and name HZ3 ))
( segid " " and resid 105 and name HD1%)
ASSI { 4147}
(( segid " " and resid 76 and name HZ3 ))
( segid " " and resid 74 and name HG2%)
5.200 3.300 0.800 peak 4147 spectrum 1 weight 0.10000E+01 volume 0.24661E-03 ppm1 7.043 ppm2 0.952 CV 1
OR { 4147}
(( segid " " and resid 76 and name HZ3 ))
( segid " " and resid 114 and name HD1%)
OR { 4147}
(( segid " " and resid 76 and name HZ3 ))
( segid " " and resid 114 and name HG2%)
ASSI { 4149}
(( segid " " and resid 76 and name HZ3 ))
(( segid " " and resid 84 and name HG ))
4.900 3.000 1.100 peak 4149 spectrum 1 weight 0.10000E+01 volume 0.18581E-03 ppm1 7.043 ppm2 1.481 CV 1
OR { 4149}
(( segid " " and resid 76 and name HZ3 ))
(( segid " " and resid 109 and name HG3 ))
ASSI { 4152}
(( segid " " and resid 76 and name HZ3 ))
(( segid " " and resid 81 and name HA ))
5.000 3.100 1.000 peak 4152 spectrum 1 weight 0.10000E+01 volume 0.19102E-03 ppm1 7.040 ppm2 3.888 CV 1
OR { 4152}
(( segid " " and resid 76 and name HZ3 ))
(( segid " " and resid 114 and name HA ))
ASSI { 4153}
(( segid " " and resid 76 and name HE3 ))
(( segid " " and resid 81 and name H ))
4.600 2.700 1.400 peak 4153 spectrum 1 weight 0.10000E+01 volume 0.39447E-03 ppm1 7.370 ppm2 8.657 CV 1
OR { 4153}
(( segid " " and resid 76 and name HE3 ))
(( segid " " and resid 76 and name H ))
OR { 4153}
(( segid " " and resid 76 and name HE3 ))
(( segid " " and resid 77 and name H ))
ASSI { 4155}
(( segid " " and resid 76 and name HE3 ))
( segid " " and resid 74 and name HG2%)
4.400 2.400 1.600 peak 4155 spectrum 1 weight 0.10000E+01 volume 0.32619E-03 ppm1 7.366 ppm2 0.914 CV 1
OR { 4155}
(( segid " " and resid 76 and name HE3 ))
( segid " " and resid 74 and name HG1%)
OR { 4155}
(( segid " " and resid 76 and name HE3 ))
( segid " " and resid 114 and name HD1%)
ASSI { 4156}
(( segid " " and resid 76 and name HE3 ))
(( segid " " and resid 73 and name HB ))
4.500 2.500 1.500 peak 4156 spectrum 1 weight 0.10000E+01 volume 0.36054E-03 ppm1 7.368 ppm2 1.810 CV 1
OR { 4156}
(( segid " " and resid 76 and name HE3 ))
(( segid " " and resid 84 and name HB2 ))
OR { 4156}
(( segid " " and resid 76 and name HE3 ))
(( segid " " and resid 81 and name HB2 ))
ASSI { 4159}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 114 and name H ))
5.900 4.400 0.100 peak 4159 spectrum 1 weight 0.10000E+01 volume 0.15511E-03 ppm1 7.097 ppm2 8.105 CV 1
OR { 4159}
(( segid " " and resid 76 and name HZ2 ))
(( segid " " and resid 85 and name H ))
ASSI { 4160}
(( segid " " and resid 76 and name HH2 ))
(( segid " " and resid 114 and name H ))
6.000 5.700 0.000 peak 4160 spectrum 1 weight 0.10000E+01 volume 0.10907E-03 ppm1 6.896 ppm2 8.126 CV 1
OR { 4160}
(( segid " " and resid 76 and name HH2 ))
(( segid " " and resid 85 and name H ))
ASSI { 4165}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 110 and name H ))
5.600 4.000 0.400 peak 4165 spectrum 1 weight 0.10000E+01 volume 0.17245E-03 ppm1 2.779 ppm2 8.378 CV 1
OR { 4165}
(( segid " " and resid 109 and name HD2 ))
(( segid " " and resid 74 and name H ))
ASSI { 4167}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 128 and name H ))
2.700 2.700 3.300 peak 4167 spectrum 1 weight 0.10000E+01 volume 0.41015E-03 ppm1 6.742 ppm2 8.591 CV 1
OR { 4167}
( segid " " and resid 131 and name HE% )
(( segid " " and resid 115 and name H ))
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