NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
28009 |
2w84   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 11}
(( segid "PX14" and resid 44 and name HN ))
(( segid "PX14" and resid 45 and name HD1 ))
3.300 1.400 1.400 peak 11 spectrum 1 weight 0.10000E+01 volume 0.26894E-02 ppm1 7.712 ppm2 4.183 CV 1
ASSI { 16}
(( segid "PX14" and resid 48 and name HN ))
(( segid "PX14" and resid 45 and name HB2 ))
2.300 0.700 0.700 peak 16 spectrum 1 weight 0.10000E+01 volume 0.35816E-02 ppm1 7.330 ppm2 2.112 CV 1
ASSI { 19}
(( segid "PX14" and resid 50 and name HN ))
(( segid "PX14" and resid 49 and name HN ))
2.900 1.000 1.000 peak 19 spectrum 1 weight 0.10000E+01 volume 0.13833E-02 ppm1 8.538 ppm2 7.797 CV 1
ASSI { 20}
(( segid "PX14" and resid 50 and name HN ))
(( segid "PX14" and resid 50 and name HB1 ))
2.500 0.800 0.800 peak 20 spectrum 1 weight 0.10000E+01 volume 0.72038E-02 ppm1 8.538 ppm2 1.971 CV 1
ASSI { 21}
(( segid "PX14" and resid 50 and name HN ))
(( segid "PX14" and resid 50 and name HA ))
2.500 0.800 0.800 peak 21 spectrum 1 weight 0.10000E+01 volume 0.35176E-02 ppm1 8.538 ppm2 3.962 CV 1
ASSI { 22}
(( segid "PX14" and resid 53 and name HN ))
(( segid "PX14" and resid 54 and name HN ))
2.400 0.700 0.700 peak 22 spectrum 1 weight 0.10000E+01 volume 0.38637E-02 ppm1 7.479 ppm2 8.072 CV 1
ASSI { 27}
(( segid "PX14" and resid 53 and name HN ))
( segid "PX14" and resid 53 and name HD1%)
3.200 1.300 1.300 peak 27 spectrum 1 weight 0.10000E+01 volume 0.19707E-02 ppm1 7.488 ppm2 0.889 CV 1
ASSI { 29}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 62 and name HB1 ))
4.000 2.000 2.000 peak 29 spectrum 1 weight 0.10000E+01 volume 0.12668E-02 ppm1 9.156 ppm2 2.554 CV 1
ASSI { 31}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 58 and name HB1 ))
2.800 1.000 1.000 peak 31 spectrum 1 weight 0.10000E+01 volume 0.10503E-02 ppm1 9.156 ppm2 1.976 CV 1
ASSI { 35}
(( segid "PX14" and resid 65 and name HN ))
(( segid "PX14" and resid 63 and name HN ))
2.800 1.000 1.000 peak 35 spectrum 1 weight 0.10000E+01 volume 0.25499E-02 ppm1 8.063 ppm2 8.611 CV 1
ASSI { 40}
(( segid "PX14" and resid 68 and name HN ))
(( segid "PX14" and resid 67 and name HN ))
2.600 0.800 0.800 peak 40 spectrum 1 weight 0.10000E+01 volume 0.26345E-02 ppm1 8.288 ppm2 9.060 CV 1
ASSI { 41}
(( segid "PX14" and resid 68 and name HN ))
(( segid "PX14" and resid 69 and name HN ))
2.300 0.700 0.700 peak 41 spectrum 1 weight 0.10000E+01 volume 0.50820E-02 ppm1 8.281 ppm2 8.605 CV 1
ASSI { 51}
(( segid "PX14" and resid 72 and name HN ))
(( segid "PX14" and resid 73 and name HN ))
4.100 2.100 1.900 peak 51 spectrum 1 weight 0.10000E+01 volume 0.25889E-03 ppm1 7.917 ppm2 8.274 CV 1
ASSI { 62}
(( segid "PX14" and resid 76 and name HN ))
(( segid "PX14" and resid 75 and name HA ))
2.000 0.500 0.500 peak 62 spectrum 1 weight 0.10000E+01 volume 0.14075E-01 ppm1 8.114 ppm2 4.585 CV 1
ASSI { 64}
(( segid "PX14" and resid 71 and name HN ))
(( segid "PX14" and resid 69 and name HN ))
3.600 1.600 1.600 peak 64 spectrum 1 weight 0.10000E+01 volume 0.98439E-03 ppm1 7.610 ppm2 7.806 CV 1
ASSI { 65}
(( segid "PX14" and resid 50 and name HN ))
(( segid "PX14" and resid 49 and name HB2 ))
2.100 0.500 0.500 peak 65 spectrum 1 weight 0.10000E+01 volume 0.67173E-02 ppm1 8.544 ppm2 1.734 CV 1
ASSI { 70}
(( segid "PX14" and resid 60 and name HN ))
(( segid "PX14" and resid 61 and name HN ))
2.900 1.100 1.100 peak 70 spectrum 1 weight 0.10000E+01 volume 0.13315E-02 ppm1 8.861 ppm2 8.395 CV 1
ASSI { 74}
(( segid "PX14" and resid 51 and name HN ))
(( segid "PX14" and resid 50 and name HN ))
2.700 0.900 0.900 peak 74 spectrum 1 weight 0.10000E+01 volume 0.22366E-02 ppm1 8.043 ppm2 8.502 CV 1
ASSI { 76}
(( segid "PX14" and resid 67 and name HN ))
(( segid "PX14" and resid 66 and name HN ))
2.600 0.900 0.900 peak 76 spectrum 1 weight 0.10000E+01 volume 0.23721E-02 ppm1 9.044 ppm2 8.611 CV 1
ASSI { 77}
(( segid "PX14" and resid 33 and name HN ))
(( segid "PX14" and resid 34 and name HN ))
2.600 0.900 0.900 peak 77 spectrum 1 weight 0.10000E+01 volume 0.20899E-02 ppm1 8.887 ppm2 7.112 CV 1
ASSI { 78}
(( segid "PX14" and resid 33 and name HN ))
(( segid "PX14" and resid 32 and name HN ))
2.700 0.900 0.900 peak 78 spectrum 1 weight 0.10000E+01 volume 0.17137E-02 ppm1 8.883 ppm2 8.240 CV 1
ASSI { 92}
(( segid "PX14" and resid 42 and name HN ))
(( segid "PX14" and resid 43 and name HN ))
2.900 1.000 1.000 peak 92 spectrum 1 weight 0.10000E+01 volume 0.11888E-02 ppm1 7.959 ppm2 7.028 CV 1
ASSI { 94}
(( segid "PX14" and resid 31 and name HN ))
(( segid "PX14" and resid 30 and name HN ))
6.000 4.700 0.000 peak 94 spectrum 1 weight 0.10000E+01 volume 0.14351E-04 ppm1 7.522 ppm2 8.240 CV 1
ASSI { 99}
(( segid "PX14" and resid 35 and name HN ))
(( segid "PX14" and resid 34 and name HN ))
2.700 0.900 0.900 peak 99 spectrum 1 weight 0.10000E+01 volume 0.18007E-02 ppm1 8.005 ppm2 7.096 CV 1
ASSI { 105}
(( segid "PX14" and resid 63 and name HN ))
(( segid "PX14" and resid 64 and name HN ))
2.700 0.900 0.900 peak 105 spectrum 1 weight 0.10000E+01 volume 0.18825E-02 ppm1 8.564 ppm2 8.338 CV 1
ASSI { 108}
(( segid "PX14" and resid 61 and name HN ))
(( segid "PX14" and resid 59 and name HB ))
3.900 1.900 1.900 peak 108 spectrum 1 weight 0.10000E+01 volume 0.24518E-03 ppm1 8.370 ppm2 4.745 CV 1
ASSI { 109}
(( segid "PX14" and resid 61 and name HN ))
(( segid "PX14" and resid 61 and name HA ))
3.000 1.100 1.100 peak 109 spectrum 1 weight 0.10000E+01 volume 0.13033E-02 ppm1 8.374 ppm2 4.157 CV 1
ASSI { 110}
(( segid "PX14" and resid 61 and name HN ))
(( segid "PX14" and resid 60 and name HB2 ))
3.400 1.500 1.500 peak 110 spectrum 1 weight 0.10000E+01 volume 0.10838E-02 ppm1 8.372 ppm2 2.547 CV 1
ASSI { 116}
(( segid "PX14" and resid 58 and name HN ))
(( segid "PX14" and resid 58 and name HB1 ))
4.700 2.700 1.300 peak 116 spectrum 1 weight 0.10000E+01 volume 0.27540E-03 ppm1 7.400 ppm2 1.981 CV 1
ASSI { 140}
(( segid "PX14" and resid 36 and name HN ))
(( segid "PX14" and resid 36 and name HG ))
2.700 2.700 3.300 peak 140 spectrum 1 weight 0.10000E+01 volume 0.18087E-02 ppm1 8.342 ppm2 2.106 CV 1
ASSI { 143}
(( segid "PX14" and resid 42 and name HN ))
(( segid "PX14" and resid 42 and name HA ))
3.000 1.100 1.100 peak 143 spectrum 1 weight 0.10000E+01 volume 0.11339E-02 ppm1 7.960 ppm2 3.895 CV 1
ASSI { 145}
(( segid "PX14" and resid 42 and name HN ))
( segid "PX14" and resid 41 and name HG2%)
6.000 5.000 0.000 peak 145 spectrum 1 weight 0.10000E+01 volume 0.43335E-04 ppm1 7.957 ppm2 -0.327 CV 1
ASSI { 162}
(( segid "PX14" and resid 72 and name HN ))
(( segid "PX14" and resid 71 and name HN ))
3.000 1.200 1.200 peak 162 spectrum 1 weight 0.10000E+01 volume 0.89026E-03 ppm1 7.910 ppm2 7.600 CV 1
ASSI { 189}
(( segid "PX14" and resid 25 and name HN ))
(( segid "PX14" and resid 26 and name HN ))
4.500 2.500 1.500 peak 189 spectrum 1 weight 0.10000E+01 volume 0.20148E-03 ppm1 9.498 ppm2 8.799 CV 1
ASSI { 202}
(( segid "PX14" and resid 80 and name HN ))
(( segid "PX14" and resid 81 and name HN ))
2.800 1.000 1.000 peak 202 spectrum 1 weight 0.10000E+01 volume 0.21299E-02 ppm1 7.960 ppm2 7.410 CV 1
ASSI { 204}
(( segid "PX14" and resid 80 and name HN ))
(( segid "PX14" and resid 78 and name HA ))
2.700 0.900 0.900 peak 204 spectrum 1 weight 0.10000E+01 volume 0.41667E-02 ppm1 7.960 ppm2 4.324 CV 1
ASSI { 205}
(( segid "PX14" and resid 80 and name HN ))
(( segid "PX14" and resid 78 and name HB2 ))
4.100 2.100 1.900 peak 205 spectrum 1 weight 0.10000E+01 volume 0.36037E-03 ppm1 7.955 ppm2 3.733 CV 1
ASSI { 211}
(( segid "PX14" and resid 49 and name HN ))
(( segid "PX14" and resid 48 and name HN ))
2.600 0.900 0.900 peak 211 spectrum 1 weight 0.10000E+01 volume 0.21502E-02 ppm1 7.791 ppm2 7.328 CV 1
ASSI { 216}
(( segid "PX14" and resid 55 and name HN ))
(( segid "PX14" and resid 56 and name HN ))
2.600 0.800 0.800 peak 216 spectrum 1 weight 0.10000E+01 volume 0.23495E-02 ppm1 7.708 ppm2 6.969 CV 1
ASSI { 240}
(( segid "PX14" and resid 73 and name HN ))
(( segid "PX14" and resid 74 and name HN ))
3.500 1.500 1.500 peak 240 spectrum 1 weight 0.10000E+01 volume 0.61611E-03 ppm1 8.277 ppm2 7.990 CV 1
ASSI { 247}
(( segid "PX14" and resid 23 and name HN ))
(( segid "PX14" and resid 23 and name HA ))
2.700 0.900 0.900 peak 247 spectrum 1 weight 0.10000E+01 volume 0.21040E-02 ppm1 8.224 ppm2 4.602 CV 1
ASSI { 252}
(( segid "PX14" and resid 57 and name HN ))
(( segid "PX14" and resid 56 and name HN ))
2.600 0.900 0.900 peak 252 spectrum 1 weight 0.10000E+01 volume 0.22188E-02 ppm1 7.497 ppm2 6.970 CV 1
ASSI { 262}
(( segid "PX14" and resid 21 and name HN ))
(( segid "PX14" and resid 22 and name HN ))
5.300 3.500 0.700 peak 262 spectrum 1 weight 0.10000E+01 volume 0.61656E-04 ppm1 8.336 ppm2 8.066 CV 1
ASSI { 263}
(( segid "PX14" and resid 31 and name HN ))
(( segid "PX14" and resid 32 and name HN ))
2.400 0.700 0.700 peak 263 spectrum 1 weight 0.10000E+01 volume 0.39744E-02 ppm1 7.700 ppm2 8.222 CV 1
ASSI { 264}
(( segid "PX14" and resid 44 and name HN ))
(( segid "PX14" and resid 43 and name HN ))
2.600 0.800 0.800 peak 264 spectrum 1 weight 0.10000E+01 volume 0.27956E-02 ppm1 7.708 ppm2 6.985 CV 1
ASSI { 266}
(( segid "PX14" and resid 16 and name HN ))
(( segid "PX14" and resid 16 and name HA ))
2.700 0.900 0.900 peak 266 spectrum 1 weight 0.10000E+01 volume 0.23599E-02 ppm1 8.192 ppm2 4.718 CV 1
ASSI { 267}
(( segid "PX14" and resid 16 and name HN ))
(( segid "PX14" and resid 15 and name HA ))
3.200 1.300 1.300 peak 267 spectrum 1 weight 0.10000E+01 volume 0.85295E-03 ppm1 8.196 ppm2 4.321 CV 1
ASSI { 278}
(( segid "PX14" and resid 29 and name HN ))
(( segid "PX14" and resid 28 and name HN ))
2.400 0.700 0.700 peak 278 spectrum 1 weight 0.10000E+01 volume 0.32231E-02 ppm1 7.853 ppm2 6.834 CV 1
ASSI { 282}
(( segid "PX14" and resid 30 and name HN ))
(( segid "PX14" and resid 29 and name HN ))
2.300 0.700 0.700 peak 282 spectrum 1 weight 0.10000E+01 volume 0.43799E-02 ppm1 8.235 ppm2 7.811 CV 1
ASSI { 302}
(( segid "PX14" and resid 35 and name HN ))
(( segid "PX14" and resid 36 and name HN ))
2.900 1.000 1.000 peak 302 spectrum 1 weight 0.10000E+01 volume 0.13823E-02 ppm1 8.001 ppm2 8.354 CV 1
ASSI { 304}
(( segid "PX14" and resid 36 and name HN ))
(( segid "PX14" and resid 37 and name HN ))
2.700 0.900 0.900 peak 304 spectrum 1 weight 0.10000E+01 volume 0.20372E-02 ppm1 8.365 ppm2 7.328 CV 1
ASSI { 314}
(( segid "PX14" and resid 46 and name HN ))
(( segid "PX14" and resid 46 and name HG ))
3.900 1.900 1.900 peak 314 spectrum 1 weight 0.10000E+01 volume 0.36197E-03 ppm1 9.118 ppm2 1.603 CV 1
ASSI { 317}
(( segid "PX14" and resid 47 and name HN ))
(( segid "PX14" and resid 48 and name HN ))
3.200 1.300 1.300 peak 317 spectrum 1 weight 0.10000E+01 volume 0.80706E-03 ppm1 9.140 ppm2 7.338 CV 1
ASSI { 327}
(( segid "PX14" and resid 52 and name HN ))
(( segid "PX14" and resid 53 and name HN ))
2.600 0.800 0.800 peak 327 spectrum 1 weight 0.10000E+01 volume 0.27275E-02 ppm1 7.972 ppm2 7.493 CV 1
ASSI { 328}
(( segid "PX14" and resid 54 and name HN ))
(( segid "PX14" and resid 55 and name HN ))
2.400 0.700 0.700 peak 328 spectrum 1 weight 0.10000E+01 volume 0.44514E-02 ppm1 8.108 ppm2 7.709 CV 1
ASSI { 350}
(( segid "PX14" and resid 58 and name HN ))
(( segid "PX14" and resid 56 and name HN ))
3.700 1.700 1.700 peak 350 spectrum 1 weight 0.10000E+01 volume 0.67435E-03 ppm1 7.414 ppm2 6.966 CV 1
ASSI { 352}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 58 and name HN ))
4.900 2.900 1.100 peak 352 spectrum 1 weight 0.10000E+01 volume 0.19284E-03 ppm1 9.184 ppm2 7.415 CV 1
ASSI { 353}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 62 and name HN ))
3.800 1.800 1.800 peak 353 spectrum 1 weight 0.10000E+01 volume 0.47802E-03 ppm1 9.184 ppm2 7.758 CV 1
ASSI { 354}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 60 and name HN ))
4.800 2.900 1.200 peak 354 spectrum 1 weight 0.10000E+01 volume 0.14071E-03 ppm1 9.189 ppm2 8.880 CV 1
ASSI { 363}
(( segid "PX14" and resid 60 and name HN ))
(( segid "PX14" and resid 62 and name HN ))
5.400 3.700 0.600 peak 363 spectrum 1 weight 0.10000E+01 volume 0.59273E-04 ppm1 8.855 ppm2 7.755 CV 1
ASSI { 383}
(( segid "PX14" and resid 62 and name HN ))
(( segid "PX14" and resid 61 and name HN ))
2.400 0.700 0.700 peak 383 spectrum 1 weight 0.10000E+01 volume 0.38546E-02 ppm1 7.763 ppm2 8.401 CV 1
ASSI { 384}
(( segid "PX14" and resid 62 and name HN ))
(( segid "PX14" and resid 63 and name HN ))
2.700 0.900 0.900 peak 384 spectrum 1 weight 0.10000E+01 volume 0.18165E-02 ppm1 7.763 ppm2 8.554 CV 1
ASSI { 392}
(( segid "PX14" and resid 64 and name HN ))
(( segid "PX14" and resid 65 and name HN ))
2.100 0.500 0.500 peak 392 spectrum 1 weight 0.10000E+01 volume 0.94017E-02 ppm1 8.336 ppm2 8.108 CV 1
ASSI { 394}
(( segid "PX14" and resid 66 and name HN ))
(( segid "PX14" and resid 65 and name HN ))
2.600 0.800 0.800 peak 394 spectrum 1 weight 0.10000E+01 volume 0.24200E-02 ppm1 8.583 ppm2 8.062 CV 1
ASSI { 402}
(( segid "PX14" and resid 66 and name HN ))
(( segid "PX14" and resid 65 and name HA ))
2.700 0.900 0.900 peak 402 spectrum 1 weight 0.10000E+01 volume 0.26834E-02 ppm1 8.584 ppm2 4.039 CV 1
ASSI { 403}
(( segid "PX14" and resid 70 and name HN ))
(( segid "PX14" and resid 69 and name HN ))
2.200 0.600 0.600 peak 403 spectrum 1 weight 0.10000E+01 volume 0.67120E-02 ppm1 8.035 ppm2 8.617 CV 1
ASSI { 406}
(( segid "PX14" and resid 71 and name HN ))
(( segid "PX14" and resid 70 and name HN ))
2.500 0.800 0.800 peak 406 spectrum 1 weight 0.10000E+01 volume 0.29691E-02 ppm1 7.648 ppm2 7.994 CV 1
ASSI { 412}
(( segid "PX14" and resid 78 and name HN ))
(( segid "PX14" and resid 78 and name HA ))
2.500 0.800 0.800 peak 412 spectrum 1 weight 0.10000E+01 volume 0.33739E-02 ppm1 8.255 ppm2 4.343 CV 1
ASSI { 416}
(( segid "PX14" and resid 79 and name HN ))
(( segid "PX14" and resid 78 and name HB2 ))
4.300 2.300 1.700 peak 416 spectrum 1 weight 0.10000E+01 volume 0.43745E-03 ppm1 8.164 ppm2 3.737 CV 1
ASSI { 1}
(( segid "PX14" and resid 15 and name HA ))
( segid "PX14" and resid 15 and name HB% )
1.900 1.900 4.100 peak 1 spectrum 2 weight 0.11000E+01 volume 0.29802E-01 ppm1 4.212 ppm2 1.297 CV 1
ASSI { 5}
( segid "PX14" and resid 30 and name HB% )
(( segid "PX14" and resid 30 and name HA ))
2.100 2.100 3.900 peak 5 spectrum 2 weight 0.11000E+01 volume 0.18434E-01 ppm1 1.333 ppm2 3.962 CV 1
ASSI { 9}
(( segid "PX14" and resid 32 and name HA ))
( segid "PX14" and resid 32 and name HB% )
2.200 2.200 3.800 peak 9 spectrum 2 weight 0.11000E+01 volume 0.85550E-02 ppm1 4.185 ppm2 1.599 CV 1
ASSI { 12}
(( segid "PX14" and resid 47 and name HA ))
( segid "PX14" and resid 47 and name HB% )
2.500 2.500 3.500 peak 12 spectrum 2 weight 0.11000E+01 volume 0.64007E-02 ppm1 4.049 ppm2 1.467 CV 1
ASSI { 18}
(( segid "PX14" and resid 51 and name HA ))
( segid "PX14" and resid 51 and name HB% )
2.000 2.000 4.000 peak 18 spectrum 2 weight 0.11000E+01 volume 0.20080E-01 ppm1 4.027 ppm2 1.544 CV 1
ASSI { 19}
(( segid "PX14" and resid 66 and name HA ))
( segid "PX14" and resid 66 and name HB% )
2.100 2.100 3.900 peak 19 spectrum 2 weight 0.11000E+01 volume 0.13415E-01 ppm1 3.851 ppm2 1.320 CV 1
ASSI { 23}
(( segid "PX14" and resid 73 and name HA ))
( segid "PX14" and resid 73 and name HB% )
2.600 2.600 3.400 peak 23 spectrum 2 weight 0.11000E+01 volume 0.52775E-02 ppm1 4.171 ppm2 1.323 CV 1
ASSI { 26}
(( segid "PX14" and resid 74 and name HA ))
( segid "PX14" and resid 74 and name HB% )
2.200 2.200 3.800 peak 26 spectrum 2 weight 0.11000E+01 volume 0.13485E-01 ppm1 4.216 ppm2 1.318 CV 1
ASSI { 35}
(( segid "PX14" and resid 31 and name HA ))
( segid "PX14" and resid 31 and name HG2%)
2.700 2.700 3.300 peak 35 spectrum 2 weight 0.11000E+01 volume 0.37354E-02 ppm1 3.522 ppm2 -0.097 CV 1
ASSI { 36}
(( segid "PX14" and resid 31 and name HB ))
( segid "PX14" and resid 31 and name HG2%)
2.600 0.900 0.900 peak 36 spectrum 2 weight 0.11000E+01 volume 0.36813E-02 ppm1 3.850 ppm2 -0.092 CV 1
ASSI { 38}
(( segid "PX14" and resid 31 and name HB ))
(( segid "PX14" and resid 31 and name HA ))
3.200 3.200 2.800 peak 38 spectrum 2 weight 0.11000E+01 volume 0.15713E-02 ppm1 3.823 ppm2 3.523 CV 1
ASSI { 42}
(( segid "PX14" and resid 72 and name HB ))
( segid "PX14" and resid 72 and name HG2%)
2.100 2.100 3.900 peak 42 spectrum 2 weight 0.11000E+01 volume 0.12234E-01 ppm1 4.165 ppm2 0.905 CV 1
ASSI { 46}
(( segid "PX14" and resid 48 and name HA ))
( segid "PX14" and resid 48 and name HG2%)
2.500 2.500 3.500 peak 46 spectrum 2 weight 0.11000E+01 volume 0.69817E-02 ppm1 4.232 ppm2 1.402 CV 1
ASSI { 50}
(( segid "PX14" and resid 17 and name HA ))
(( segid "PX14" and resid 17 and name HB2 ))
3.500 3.500 2.500 peak 50 spectrum 2 weight 0.11000E+01 volume 0.11223E-02 ppm1 4.317 ppm2 1.909 CV 1
ASSI { 51}
(( segid "PX14" and resid 17 and name HA ))
(( segid "PX14" and resid 17 and name HG1 ))
3.400 3.400 2.600 peak 51 spectrum 2 weight 0.11000E+01 volume 0.31450E-02 ppm1 4.323 ppm2 2.245 CV 1
ASSI { 54}
(( segid "PX14" and resid 17 and name HG1 ))
(( segid "PX14" and resid 17 and name HD1 ))
2.000 0.500 0.500 peak 54 spectrum 2 weight 0.11000E+01 volume 0.12699E-01 ppm1 1.940 ppm2 2.273 CV 1
ASSI { 56}
(( segid "PX14" and resid 17 and name HA ))
(( segid "PX14" and resid 17 and name HB1 ))
4.800 4.800 1.200 peak 56 spectrum 2 weight 0.11000E+01 volume 0.84698E-04 ppm1 4.322 ppm2 2.079 CV 1
ASSI { 57}
(( segid "PX14" and resid 17 and name HB2 ))
(( segid "PX14" and resid 17 and name HG1 ))
1.500 1.500 4.500 peak 57 spectrum 2 weight 0.11000E+01 volume 0.16151E+00 ppm1 1.981 ppm2 2.022 CV 1
ASSI { 60}
(( segid "PX14" and resid 17 and name HD1 ))
(( segid "PX14" and resid 17 and name HB2 ))
3.000 3.000 3.000 peak 60 spectrum 2 weight 0.11000E+01 volume 0.76587E-02 ppm1 3.769 ppm2 1.962 CV 1
ASSI { 61}
(( segid "PX14" and resid 17 and name HD1 ))
(( segid "PX14" and resid 17 and name HB1 ))
2.300 2.300 3.700 peak 61 spectrum 2 weight 0.11000E+01 volume 0.94232E-02 ppm1 3.760 ppm2 2.052 CV 1
ASSI { 65}
(( segid "PX14" and resid 27 and name HB1 ))
(( segid "PX14" and resid 27 and name HG2 ))
2.400 2.400 3.600 peak 65 spectrum 2 weight 0.11000E+01 volume 0.10785E-01 ppm1 2.257 ppm2 1.971 CV 1
ASSI { 66}
(( segid "PX14" and resid 27 and name HB1 ))
(( segid "PX14" and resid 27 and name HB2 ))
2.100 2.100 3.900 peak 66 spectrum 2 weight 0.11000E+01 volume 0.65254E-02 ppm1 2.328 ppm2 1.781 CV 1
ASSI { 68}
(( segid "PX14" and resid 27 and name HB2 ))
(( segid "PX14" and resid 27 and name HG2 ))
2.400 2.400 3.600 peak 68 spectrum 2 weight 0.11000E+01 volume 0.42100E-02 ppm1 1.768 ppm2 1.974 CV 1
ASSI { 69}
(( segid "PX14" and resid 27 and name HB1 ))
(( segid "PX14" and resid 27 and name HA ))
2.300 2.300 3.700 peak 69 spectrum 2 weight 0.11000E+01 volume 0.72957E-02 ppm1 2.293 ppm2 4.323 CV 1
ASSI { 70}
(( segid "PX14" and resid 27 and name HB2 ))
(( segid "PX14" and resid 27 and name HA ))
3.300 3.300 2.700 peak 70 spectrum 2 weight 0.11000E+01 volume 0.22447E-02 ppm1 1.764 ppm2 4.319 CV 1
ASSI { 74}
(( segid "PX14" and resid 48 and name HA ))
(( segid "PX14" and resid 48 and name HB ))
2.700 2.700 3.300 peak 74 spectrum 2 weight 0.11000E+01 volume 0.31873E-02 ppm1 4.226 ppm2 4.452 CV 1
ASSI { 75}
(( segid "PX14" and resid 59 and name HA ))
( segid "PX14" and resid 59 and name HG2%)
2.800 2.800 3.200 peak 75 spectrum 2 weight 0.11000E+01 volume 0.35895E-02 ppm1 4.253 ppm2 1.214 CV 1
ASSI { 77}
(( segid "PX14" and resid 59 and name HB ))
(( segid "PX14" and resid 59 and name HA ))
2.700 2.700 3.300 peak 77 spectrum 2 weight 0.11000E+01 volume 0.36046E-02 ppm1 4.660 ppm2 4.277 CV 1
ASSI { 81}
(( segid "PX14" and resid 72 and name HB ))
(( segid "PX14" and resid 72 and name HA ))
3.200 3.200 2.800 peak 81 spectrum 2 weight 0.11000E+01 volume 0.11704E-02 ppm1 4.101 ppm2 4.306 CV 1
ASSI { 84}
( segid "PX14" and resid 72 and name HG2%)
(( segid "PX14" and resid 72 and name HA ))
2.600 2.600 3.400 peak 84 spectrum 2 weight 0.11000E+01 volume 0.44889E-02 ppm1 0.871 ppm2 4.306 CV 1
ASSI { 86}
(( segid "PX14" and resid 78 and name HB1 ))
(( segid "PX14" and resid 78 and name HA ))
3.500 3.500 2.500 peak 86 spectrum 2 weight 0.11000E+01 volume 0.68589E-03 ppm1 3.735 ppm2 4.185 CV 1
ASSI { 88}
(( segid "PX14" and resid 79 and name HB1 ))
(( segid "PX14" and resid 79 and name HA ))
2.800 2.800 3.200 peak 88 spectrum 2 weight 0.11000E+01 volume 0.28679E-02 ppm1 3.699 ppm2 4.314 CV 1
ASSI { 90}
(( segid "PX14" and resid 35 and name HA ))
(( segid "PX14" and resid 35 and name HB1 ))
3.600 3.600 2.400 peak 90 spectrum 2 weight 0.11000E+01 volume 0.11227E-02 ppm1 4.229 ppm2 3.572 CV 1
ASSI { 94}
(( segid "PX14" and resid 52 and name HB2 ))
(( segid "PX14" and resid 52 and name HB1 ))
1.900 1.900 4.100 peak 94 spectrum 2 weight 0.11000E+01 volume 0.88751E-02 ppm1 2.999 ppm2 3.505 CV 1
ASSI { 98}
(( segid "PX14" and resid 52 and name HA ))
(( segid "PX14" and resid 52 and name HB1 ))
2.600 2.600 3.400 peak 98 spectrum 2 weight 0.11000E+01 volume 0.71300E-02 ppm1 4.059 ppm2 3.504 CV 1
ASSI { 99}
(( segid "PX14" and resid 52 and name HA ))
(( segid "PX14" and resid 52 and name HB2 ))
3.100 3.100 2.900 peak 99 spectrum 2 weight 0.11000E+01 volume 0.12061E-02 ppm1 4.066 ppm2 3.001 CV 1
ASSI { 101}
(( segid "PX14" and resid 67 and name HA ))
(( segid "PX14" and resid 67 and name HB1 ))
2.600 2.600 3.400 peak 101 spectrum 2 weight 0.11000E+01 volume 0.30125E-02 ppm1 3.921 ppm2 3.271 CV 1
ASSI { 102}
(( segid "PX14" and resid 67 and name HA ))
(( segid "PX14" and resid 67 and name HB2 ))
3.300 3.300 2.700 peak 102 spectrum 2 weight 0.11000E+01 volume 0.18101E-02 ppm1 3.927 ppm2 3.017 CV 1
ASSI { 106}
(( segid "PX14" and resid 67 and name HB2 ))
(( segid "PX14" and resid 67 and name HB1 ))
1.900 1.900 4.100 peak 106 spectrum 2 weight 0.11000E+01 volume 0.10649E-01 ppm1 2.964 ppm2 3.286 CV 1
ASSI { 110}
(( segid "PX14" and resid 70 and name HA ))
(( segid "PX14" and resid 70 and name HB1 ))
3.500 3.500 2.500 peak 110 spectrum 2 weight 0.11000E+01 volume 0.71327E-03 ppm1 4.263 ppm2 4.046 CV 1
ASSI { 111}
(( segid "PX14" and resid 70 and name HA ))
(( segid "PX14" and resid 70 and name HB2 ))
2.400 2.400 3.600 peak 111 spectrum 2 weight 0.11000E+01 volume 0.77372E-02 ppm1 4.239 ppm2 3.845 CV 1
ASSI { 119}
(( segid "PX14" and resid 24 and name HB2 ))
(( segid "PX14" and resid 24 and name HB1 ))
2.000 2.000 4.000 peak 119 spectrum 2 weight 0.11000E+01 volume 0.75258E-02 ppm1 1.776 ppm2 2.179 CV 1
ASSI { 123}
(( segid "PX14" and resid 24 and name HB1 ))
(( segid "PX14" and resid 24 and name HA ))
3.200 3.200 2.800 peak 123 spectrum 2 weight 0.11000E+01 volume 0.89354E-03 ppm1 2.144 ppm2 4.459 CV 1
ASSI { 124}
(( segid "PX14" and resid 24 and name HB2 ))
(( segid "PX14" and resid 24 and name HA ))
3.200 3.200 2.800 peak 124 spectrum 2 weight 0.11000E+01 volume 0.21398E-02 ppm1 1.758 ppm2 4.455 CV 1
ASSI { 127}
(( segid "PX14" and resid 24 and name HG1 ))
(( segid "PX14" and resid 24 and name HA ))
4.300 4.300 1.700 peak 127 spectrum 2 weight 0.11000E+01 volume 0.46128E-03 ppm1 1.997 ppm2 4.444 CV 1
ASSI { 128}
(( segid "PX14" and resid 24 and name HG2 ))
(( segid "PX14" and resid 24 and name HA ))
4.200 4.200 1.800 peak 128 spectrum 2 weight 0.11000E+01 volume 0.70414E-03 ppm1 1.871 ppm2 4.439 CV 1
ASSI { 133}
(( segid "PX14" and resid 27 and name HG1 ))
(( segid "PX14" and resid 27 and name HB1 ))
2.600 2.600 3.400 peak 133 spectrum 2 weight 0.11000E+01 volume 0.29273E-02 ppm1 2.032 ppm2 2.320 CV 1
ASSI { 134}
(( segid "PX14" and resid 27 and name HG1 ))
(( segid "PX14" and resid 27 and name HA ))
3.900 3.900 2.100 peak 134 spectrum 2 weight 0.11000E+01 volume 0.50612E-03 ppm1 2.033 ppm2 4.345 CV 1
ASSI { 135}
(( segid "PX14" and resid 27 and name HG2 ))
(( segid "PX14" and resid 27 and name HA ))
4.100 4.100 1.900 peak 135 spectrum 2 weight 0.11000E+01 volume 0.10766E-02 ppm1 1.918 ppm2 4.343 CV 1
ASSI { 136}
(( segid "PX14" and resid 27 and name HG1 ))
(( segid "PX14" and resid 27 and name HB2 ))
3.200 3.200 2.800 peak 136 spectrum 2 weight 0.11000E+01 volume 0.30818E-02 ppm1 2.027 ppm2 1.805 CV 1
ASSI { 138}
(( segid "PX14" and resid 27 and name HD2 ))
(( segid "PX14" and resid 27 and name HD1 ))
1.900 1.900 4.100 peak 138 spectrum 2 weight 0.11000E+01 volume 0.99506E-02 ppm1 3.489 ppm2 3.822 CV 1
ASSI { 140}
(( segid "PX14" and resid 27 and name HD2 ))
(( segid "PX14" and resid 27 and name HB2 ))
2.700 2.700 3.300 peak 140 spectrum 2 weight 0.11000E+01 volume 0.37410E-02 ppm1 3.496 ppm2 1.807 CV 1
ASSI { 141}
(( segid "PX14" and resid 27 and name HD2 ))
(( segid "PX14" and resid 27 and name HG1 ))
2.700 2.700 3.300 peak 141 spectrum 2 weight 0.11000E+01 volume 0.77284E-02 ppm1 3.487 ppm2 2.054 CV 1
ASSI { 143}
(( segid "PX14" and resid 27 and name HD1 ))
(( segid "PX14" and resid 27 and name HG1 ))
2.300 2.300 3.700 peak 143 spectrum 2 weight 0.11000E+01 volume 0.50757E-02 ppm1 3.797 ppm2 2.053 CV 1
ASSI { 144}
(( segid "PX14" and resid 27 and name HD1 ))
(( segid "PX14" and resid 27 and name HB1 ))
5.600 5.600 0.400 peak 144 spectrum 2 weight 0.11000E+01 volume 0.14134E-03 ppm1 3.796 ppm2 2.328 CV 1
ASSI { 145}
(( segid "PX14" and resid 27 and name HD2 ))
(( segid "PX14" and resid 27 and name HB1 ))
6.000 6.000 0.000 peak 145 spectrum 2 weight 0.11000E+01 volume 0.10108E-03 ppm1 3.489 ppm2 2.332 CV 1
ASSI { 146}
(( segid "PX14" and resid 27 and name HD2 ))
(( segid "PX14" and resid 27 and name HG2 ))
2.400 2.400 3.600 peak 146 spectrum 2 weight 0.11000E+01 volume 0.41513E-02 ppm1 3.491 ppm2 1.954 CV 1
ASSI { 151}
(( segid "PX14" and resid 27 and name HA ))
(( segid "PX14" and resid 27 and name HD1 ))
4.600 4.600 1.400 peak 151 spectrum 2 weight 0.11000E+01 volume 0.16813E-03 ppm1 4.324 ppm2 3.836 CV 1
ASSI { 152}
(( segid "PX14" and resid 27 and name HA ))
(( segid "PX14" and resid 27 and name HD2 ))
4.300 4.300 1.700 peak 152 spectrum 2 weight 0.11000E+01 volume 0.43061E-03 ppm1 4.319 ppm2 3.516 CV 1
ASSI { 158}
(( segid "PX14" and resid 27 and name HG2 ))
(( segid "PX14" and resid 27 and name HD1 ))
2.700 2.700 3.300 peak 158 spectrum 2 weight 0.11000E+01 volume 0.51788E-02 ppm1 1.927 ppm2 3.819 CV 1
ASSI { 161}
(( segid "PX14" and resid 45 and name HA ))
(( segid "PX14" and resid 45 and name HB1 ))
2.800 2.800 3.200 peak 161 spectrum 2 weight 0.11000E+01 volume 0.17656E-02 ppm1 4.469 ppm2 2.529 CV 1
ASSI { 162}
(( segid "PX14" and resid 45 and name HB1 ))
(( segid "PX14" and resid 45 and name HB2 ))
1.900 1.900 4.100 peak 162 spectrum 2 weight 0.11000E+01 volume 0.11549E-01 ppm1 2.531 ppm2 2.053 CV 1
ASSI { 166}
(( segid "PX14" and resid 45 and name HB2 ))
(( segid "PX14" and resid 45 and name HA ))
6.000 6.000 0.000 peak 166 spectrum 2 weight 0.11000E+01 volume 0.24073E-04 ppm1 1.998 ppm2 4.532 CV 1
ASSI { 168}
(( segid "PX14" and resid 45 and name HG1 ))
(( segid "PX14" and resid 45 and name HA ))
4.500 4.500 1.500 peak 168 spectrum 2 weight 0.11000E+01 volume 0.24184E-03 ppm1 2.208 ppm2 4.495 CV 1
ASSI { 169}
(( segid "PX14" and resid 45 and name HG1 ))
(( segid "PX14" and resid 45 and name HD1 ))
2.200 2.200 3.800 peak 169 spectrum 2 weight 0.11000E+01 volume 0.68851E-02 ppm1 2.217 ppm2 4.090 CV 1
ASSI { 170}
(( segid "PX14" and resid 45 and name HG1 ))
(( segid "PX14" and resid 45 and name HD2 ))
3.800 3.800 2.200 peak 170 spectrum 2 weight 0.11000E+01 volume 0.79304E-03 ppm1 2.194 ppm2 3.651 CV 1
ASSI { 171}
(( segid "PX14" and resid 45 and name HG1 ))
(( segid "PX14" and resid 45 and name HB1 ))
2.200 2.200 3.800 peak 171 spectrum 2 weight 0.11000E+01 volume 0.68837E-02 ppm1 2.225 ppm2 2.500 CV 1
ASSI { 174}
(( segid "PX14" and resid 45 and name HD2 ))
(( segid "PX14" and resid 45 and name HD1 ))
2.100 2.100 3.900 peak 174 spectrum 2 weight 0.11000E+01 volume 0.50429E-02 ppm1 3.611 ppm2 4.036 CV 1
ASSI { 177}
(( segid "PX14" and resid 45 and name HB1 ))
(( segid "PX14" and resid 45 and name HD1 ))
3.400 3.400 2.600 peak 177 spectrum 2 weight 0.11000E+01 volume 0.17600E-02 ppm1 2.474 ppm2 4.091 CV 1
ASSI { 178}
(( segid "PX14" and resid 45 and name HB2 ))
(( segid "PX14" and resid 45 and name HD1 ))
3.800 3.800 2.200 peak 178 spectrum 2 weight 0.11000E+01 volume 0.12075E-02 ppm1 2.049 ppm2 4.094 CV 1
ASSI { 185}
(( segid "PX14" and resid 22 and name HB ))
( segid "PX14" and resid 22 and name HG1%)
2.600 2.600 3.400 peak 185 spectrum 2 weight 0.11000E+01 volume 0.49166E-02 ppm1 1.981 ppm2 0.880 CV 1
ASSI { 186}
(( segid "PX14" and resid 22 and name HB ))
(( segid "PX14" and resid 22 and name HA ))
4.300 4.300 1.700 peak 186 spectrum 2 weight 0.11000E+01 volume 0.22307E-03 ppm1 2.005 ppm2 4.095 CV 1
ASSI { 187}
( segid "PX14" and resid 22 and name HG1%)
(( segid "PX14" and resid 22 and name HA ))
2.600 2.600 3.400 peak 187 spectrum 2 weight 0.11000E+01 volume 0.68166E-02 ppm1 0.844 ppm2 4.082 CV 1
ASSI { 192}
(( segid "PX14" and resid 33 and name HA ))
( segid "PX14" and resid 33 and name HG2%)
2.700 2.700 3.300 peak 192 spectrum 2 weight 0.11000E+01 volume 0.62226E-02 ppm1 3.282 ppm2 0.653 CV 1
ASSI { 193}
(( segid "PX14" and resid 33 and name HA ))
( segid "PX14" and resid 33 and name HG1%)
2.800 2.800 3.200 peak 193 spectrum 2 weight 0.11000E+01 volume 0.28541E-02 ppm1 3.293 ppm2 1.135 CV 1
ASSI { 194}
(( segid "PX14" and resid 33 and name HA ))
(( segid "PX14" and resid 33 and name HB ))
2.900 2.900 3.100 peak 194 spectrum 2 weight 0.11000E+01 volume 0.19955E-02 ppm1 3.288 ppm2 2.128 CV 1
ASSI { 197}
( segid "PX14" and resid 33 and name HG2%)
( segid "PX14" and resid 33 and name HG1%)
2.900 2.900 3.100 peak 197 spectrum 2 weight 0.11000E+01 volume 0.25486E-02 ppm1 0.628 ppm2 1.130 CV 1
ASSI { 199}
( segid "PX14" and resid 33 and name HG2%)
(( segid "PX14" and resid 33 and name HB ))
2.200 2.200 3.800 peak 199 spectrum 2 weight 0.11000E+01 volume 0.94433E-02 ppm1 0.628 ppm2 2.122 CV 1
ASSI { 200}
( segid "PX14" and resid 33 and name HG1%)
(( segid "PX14" and resid 33 and name HB ))
2.300 2.300 3.700 peak 200 spectrum 2 weight 0.11000E+01 volume 0.76533E-02 ppm1 1.109 ppm2 2.117 CV 1
ASSI { 202}
(( segid "PX14" and resid 41 and name HB ))
( segid "PX14" and resid 41 and name HG1%)
2.400 2.400 3.600 peak 202 spectrum 2 weight 0.11000E+01 volume 0.63202E-02 ppm1 1.904 ppm2 0.485 CV 1
ASSI { 203}
(( segid "PX14" and resid 41 and name HB ))
( segid "PX14" and resid 41 and name HG2%)
2.500 2.500 3.500 peak 203 spectrum 2 weight 0.11000E+01 volume 0.49399E-02 ppm1 1.918 ppm2 -0.381 CV 1
ASSI { 204}
(( segid "PX14" and resid 41 and name HB ))
(( segid "PX14" and resid 41 and name HA ))
3.400 3.400 2.600 peak 204 spectrum 2 weight 0.11000E+01 volume 0.90629E-03 ppm1 1.914 ppm2 3.294 CV 1
ASSI { 208}
( segid "PX14" and resid 41 and name HG2%)
( segid "PX14" and resid 41 and name HG1%)
2.400 2.400 3.600 peak 208 spectrum 2 weight 0.11000E+01 volume 0.75855E-02 ppm1 -0.413 ppm2 0.479 CV 1
ASSI { 210}
( segid "PX14" and resid 41 and name HG2%)
(( segid "PX14" and resid 41 and name HA ))
2.600 2.600 3.400 peak 210 spectrum 2 weight 0.11000E+01 volume 0.49409E-02 ppm1 -0.403 ppm2 3.314 CV 1
ASSI { 214}
( segid "PX14" and resid 41 and name HG1%)
(( segid "PX14" and resid 41 and name HA ))
2.300 2.300 3.700 peak 214 spectrum 2 weight 0.11000E+01 volume 0.85926E-02 ppm1 0.457 ppm2 3.319 CV 1
ASSI { 216}
(( segid "PX14" and resid 29 and name HB ))
(( segid "PX14" and resid 29 and name HA ))
5.000 5.000 1.000 peak 216 spectrum 2 weight 0.11000E+01 volume 0.90797E-04 ppm1 1.825 ppm2 3.414 CV 1
ASSI { 218}
(( segid "PX14" and resid 29 and name HG12))
( segid "PX14" and resid 29 and name HD1%)
2.500 2.500 3.500 peak 218 spectrum 2 weight 0.11000E+01 volume 0.40663E-02 ppm1 1.027 ppm2 0.886 CV 1
ASSI { 219}
(( segid "PX14" and resid 29 and name HG12))
(( segid "PX14" and resid 29 and name HB ))
4.100 4.100 1.900 peak 219 spectrum 2 weight 0.11000E+01 volume 0.37870E-03 ppm1 1.015 ppm2 1.810 CV 1
ASSI { 220}
(( segid "PX14" and resid 29 and name HG11))
( segid "PX14" and resid 29 and name HD1%)
2.800 2.800 3.200 peak 220 spectrum 2 weight 0.11000E+01 volume 0.22288E-02 ppm1 1.617 ppm2 0.893 CV 1
ASSI { 222}
( segid "PX14" and resid 29 and name HG2%)
(( segid "PX14" and resid 29 and name HG11))
3.000 3.000 3.000 peak 222 spectrum 2 weight 0.11000E+01 volume 0.46710E-02 ppm1 0.727 ppm2 1.631 CV 1
ASSI { 224}
(( segid "PX14" and resid 29 and name HA ))
( segid "PX14" and resid 29 and name HG2%)
3.000 3.000 3.000 peak 224 spectrum 2 weight 0.11000E+01 volume 0.17649E-02 ppm1 3.360 ppm2 0.728 CV 1
ASSI { 225}
(( segid "PX14" and resid 29 and name HA ))
( segid "PX14" and resid 29 and name HD1%)
3.700 3.700 2.300 peak 225 spectrum 2 weight 0.11000E+01 volume 0.18438E-02 ppm1 3.365 ppm2 0.884 CV 1
ASSI { 228}
(( segid "PX14" and resid 29 and name HG12))
( segid "PX14" and resid 29 and name HG2%)
2.800 2.800 3.200 peak 228 spectrum 2 weight 0.11000E+01 volume 0.23377E-02 ppm1 1.017 ppm2 0.753 CV 1
ASSI { 230}
(( segid "PX14" and resid 29 and name HG11))
(( segid "PX14" and resid 29 and name HG12))
2.000 2.000 4.000 peak 230 spectrum 2 weight 0.11000E+01 volume 0.52926E-02 ppm1 1.612 ppm2 1.065 CV 1
ASSI { 231}
(( segid "PX14" and resid 29 and name HA ))
(( segid "PX14" and resid 29 and name HG12))
2.700 2.700 3.300 peak 231 spectrum 2 weight 0.11000E+01 volume 0.26151E-02 ppm1 3.365 ppm2 1.035 CV 1
ASSI { 233}
(( segid "PX14" and resid 29 and name HG11))
(( segid "PX14" and resid 29 and name HA ))
3.400 3.400 2.600 peak 233 spectrum 2 weight 0.11000E+01 volume 0.12824E-02 ppm1 1.619 ppm2 3.382 CV 1
ASSI { 235}
(( segid "PX14" and resid 29 and name HB ))
(( segid "PX14" and resid 29 and name HG11))
2.800 2.800 3.200 peak 235 spectrum 2 weight 0.11000E+01 volume 0.16917E-02 ppm1 1.826 ppm2 1.655 CV 1
ASSI { 237}
(( segid "PX14" and resid 29 and name HB ))
( segid "PX14" and resid 29 and name HD1%)
4.300 4.300 1.700 peak 237 spectrum 2 weight 0.11000E+01 volume 0.21941E-03 ppm1 1.826 ppm2 0.890 CV 1
ASSI { 238}
(( segid "PX14" and resid 29 and name HB ))
( segid "PX14" and resid 29 and name HG2%)
2.800 2.800 3.200 peak 238 spectrum 2 weight 0.11000E+01 volume 0.24192E-02 ppm1 1.824 ppm2 0.766 CV 1
ASSI { 239}
( segid "PX14" and resid 29 and name HD1%)
( segid "PX14" and resid 29 and name HG2%)
3.000 3.000 3.000 peak 239 spectrum 2 weight 0.11000E+01 volume 0.16412E-02 ppm1 0.852 ppm2 0.745 CV 1
ASSI { 244}
(( segid "PX14" and resid 65 and name HG1 ))
(( segid "PX14" and resid 65 and name HB1 ))
2.300 2.300 3.700 peak 244 spectrum 2 weight 0.11000E+01 volume 0.14081E-01 ppm1 2.770 ppm2 2.524 CV 1
ASSI { 248}
(( segid "PX14" and resid 65 and name HB1 ))
(( segid "PX14" and resid 65 and name HA ))
3.300 3.300 2.700 peak 248 spectrum 2 weight 0.11000E+01 volume 0.13121E-02 ppm1 2.094 ppm2 4.092 CV 1
ASSI { 251}
(( segid "PX14" and resid 65 and name HA ))
(( segid "PX14" and resid 65 and name HB2 ))
2.300 2.300 3.700 peak 251 spectrum 2 weight 0.11000E+01 volume 0.73728E-02 ppm1 4.052 ppm2 2.111 CV 1
ASSI { 252}
(( segid "PX14" and resid 65 and name HA ))
(( segid "PX14" and resid 65 and name HG1 ))
6.000 4.600 0.000 peak 252 spectrum 2 weight 0.11000E+01 volume 0.31656E-04 ppm1 4.054 ppm2 2.825 CV 1
ASSI { 253}
( segid "PX14" and resid 65 and name HE% )
(( segid "PX14" and resid 65 and name HG1 ))
5.400 5.400 0.600 peak 253 spectrum 2 weight 0.11000E+01 volume 0.57882E-04 ppm1 1.996 ppm2 2.817 CV 1
ASSI { 254}
( segid "PX14" and resid 65 and name HE% )
(( segid "PX14" and resid 65 and name HA ))
5.300 5.300 0.700 peak 254 spectrum 2 weight 0.11000E+01 volume 0.31793E-04 ppm1 1.989 ppm2 4.083 CV 1
ASSI { 256}
(( segid "PX14" and resid 28 and name HA ))
(( segid "PX14" and resid 28 and name HB1 ))
2.800 2.800 3.200 peak 256 spectrum 2 weight 0.11000E+01 volume 0.24051E-02 ppm1 4.110 ppm2 1.717 CV 1
ASSI { 258}
(( segid "PX14" and resid 28 and name HB1 ))
( segid "PX14" and resid 28 and name HD2%)
2.400 2.400 3.600 peak 258 spectrum 2 weight 0.11000E+01 volume 0.61625E-02 ppm1 1.678 ppm2 0.909 CV 1
ASSI { 259}
(( segid "PX14" and resid 28 and name HB1 ))
( segid "PX14" and resid 28 and name HD1%)
3.300 3.300 2.700 peak 259 spectrum 2 weight 0.11000E+01 volume 0.18467E-02 ppm1 1.678 ppm2 1.003 CV 1
ASSI { 261}
(( segid "PX14" and resid 28 and name HA ))
( segid "PX14" and resid 28 and name HD1%)
3.100 3.100 2.900 peak 261 spectrum 2 weight 0.11000E+01 volume 0.23485E-02 ppm1 4.112 ppm2 1.006 CV 1
ASSI { 262}
(( segid "PX14" and resid 28 and name HA ))
( segid "PX14" and resid 28 and name HD2%)
3.200 3.200 2.800 peak 262 spectrum 2 weight 0.11000E+01 volume 0.18927E-02 ppm1 4.112 ppm2 0.913 CV 1
ASSI { 264}
(( segid "PX14" and resid 28 and name HG ))
( segid "PX14" and resid 28 and name HD2%)
2.300 2.300 3.700 peak 264 spectrum 2 weight 0.11000E+01 volume 0.84041E-02 ppm1 1.592 ppm2 0.921 CV 1
ASSI { 265}
(( segid "PX14" and resid 28 and name HA ))
(( segid "PX14" and resid 28 and name HG ))
4.400 4.400 1.600 peak 265 spectrum 2 weight 0.11000E+01 volume 0.20709E-03 ppm1 4.115 ppm2 1.641 CV 1
ASSI { 271}
( segid "PX14" and resid 28 and name HD1%)
(( segid "PX14" and resid 28 and name HG ))
3.000 3.000 3.000 peak 271 spectrum 2 weight 0.11000E+01 volume 0.16983E-02 ppm1 0.972 ppm2 1.623 CV 1
ASSI { 273}
(( segid "PX14" and resid 46 and name HG ))
( segid "PX14" and resid 46 and name HD1%)
4.500 4.500 1.500 peak 273 spectrum 2 weight 0.11000E+01 volume 0.14537E-03 ppm1 1.475 ppm2 0.733 CV 1
ASSI { 274}
(( segid "PX14" and resid 46 and name HG ))
( segid "PX14" and resid 46 and name HD2%)
3.400 3.400 2.600 peak 274 spectrum 2 weight 0.11000E+01 volume 0.82518E-03 ppm1 1.478 ppm2 0.684 CV 1
ASSI { 275}
(( segid "PX14" and resid 46 and name HG ))
(( segid "PX14" and resid 46 and name HA ))
6.000 6.000 0.000 peak 275 spectrum 2 weight 0.11000E+01 volume 0.21423E-04 ppm1 1.485 ppm2 3.916 CV 1
ASSI { 277}
(( segid "PX14" and resid 46 and name HB1 ))
( segid "PX14" and resid 46 and name HD1%)
3.000 3.000 3.000 peak 277 spectrum 2 weight 0.11000E+01 volume 0.35379E-02 ppm1 1.592 ppm2 0.688 CV 1
ASSI { 278}
(( segid "PX14" and resid 46 and name HB1 ))
( segid "PX14" and resid 46 and name HD2%)
3.900 3.900 2.100 peak 278 spectrum 2 weight 0.11000E+01 volume 0.38646E-03 ppm1 1.596 ppm2 0.612 CV 1
ASSI { 282}
( segid "PX14" and resid 46 and name HD1%)
(( segid "PX14" and resid 46 and name HA ))
2.600 2.600 3.400 peak 282 spectrum 2 weight 0.11000E+01 volume 0.51550E-02 ppm1 0.611 ppm2 3.875 CV 1
ASSI { 284}
(( segid "PX14" and resid 46 and name HA ))
(( segid "PX14" and resid 46 and name HB1 ))
2.700 2.700 3.300 peak 284 spectrum 2 weight 0.11000E+01 volume 0.34303E-02 ppm1 3.850 ppm2 1.605 CV 1
ASSI { 286}
(( segid "PX14" and resid 46 and name HA ))
( segid "PX14" and resid 46 and name HD2%)
3.200 3.200 2.800 peak 286 spectrum 2 weight 0.11000E+01 volume 0.23664E-02 ppm1 3.850 ppm2 0.613 CV 1
ASSI { 296}
(( segid "PX14" and resid 34 and name HB1 ))
(( segid "PX14" and resid 34 and name HA ))
2.600 2.600 3.400 peak 296 spectrum 2 weight 0.11000E+01 volume 0.36150E-02 ppm1 1.842 ppm2 4.025 CV 1
ASSI { 297}
(( segid "PX14" and resid 34 and name HB1 ))
(( segid "PX14" and resid 34 and name HG2 ))
2.500 2.500 3.500 peak 297 spectrum 2 weight 0.11000E+01 volume 0.41773E-02 ppm1 1.837 ppm2 1.455 CV 1
ASSI { 298}
(( segid "PX14" and resid 34 and name HB1 ))
(( segid "PX14" and resid 34 and name HG1 ))
3.400 3.400 2.600 peak 298 spectrum 2 weight 0.11000E+01 volume 0.12203E-02 ppm1 1.835 ppm2 1.612 CV 1
ASSI { 300}
(( segid "PX14" and resid 34 and name HA ))
(( segid "PX14" and resid 34 and name HG1 ))
3.700 3.700 2.300 peak 300 spectrum 2 weight 0.11000E+01 volume 0.58207E-03 ppm1 3.998 ppm2 1.455 CV 1
ASSI { 303}
(( segid "PX14" and resid 34 and name HG1 ))
(( segid "PX14" and resid 34 and name HE1 ))
2.800 2.800 3.200 peak 303 spectrum 2 weight 0.11000E+01 volume 0.29683E-02 ppm1 1.453 ppm2 2.870 CV 1
ASSI { 305}
(( segid "PX14" and resid 34 and name HG2 ))
(( segid "PX14" and resid 34 and name HA ))
3.100 3.100 2.900 peak 305 spectrum 2 weight 0.11000E+01 volume 0.16348E-02 ppm1 1.380 ppm2 3.995 CV 1
ASSI { 306}
(( segid "PX14" and resid 34 and name HD1 ))
(( segid "PX14" and resid 34 and name HA ))
3.000 3.000 3.000 peak 306 spectrum 2 weight 0.11000E+01 volume 0.42294E-02 ppm1 1.600 ppm2 4.031 CV 1
ASSI { 308}
(( segid "PX14" and resid 34 and name HE1 ))
(( segid "PX14" and resid 34 and name HD1 ))
2.400 2.400 3.600 peak 308 spectrum 2 weight 0.11000E+01 volume 0.68334E-02 ppm1 2.857 ppm2 1.633 CV 1
ASSI { 310}
(( segid "PX14" and resid 34 and name HE1 ))
(( segid "PX14" and resid 34 and name HG2 ))
3.600 3.600 2.400 peak 310 spectrum 2 weight 0.11000E+01 volume 0.11885E-02 ppm1 2.860 ppm2 1.356 CV 1
ASSI { 311}
(( segid "PX14" and resid 34 and name HE1 ))
(( segid "PX14" and resid 34 and name HA ))
5.400 5.400 0.600 peak 311 spectrum 2 weight 0.11000E+01 volume 0.11866E-03 ppm1 2.853 ppm2 4.044 CV 1
ASSI { 317}
(( segid "PX14" and resid 36 and name HB1 ))
(( segid "PX14" and resid 36 and name HA ))
4.600 4.600 1.400 peak 317 spectrum 2 weight 0.11000E+01 volume 0.11122E-03 ppm1 1.800 ppm2 3.394 CV 1
ASSI { 319}
(( segid "PX14" and resid 36 and name HG ))
(( segid "PX14" and resid 36 and name HB2 ))
3.800 3.800 2.200 peak 319 spectrum 2 weight 0.11000E+01 volume 0.40821E-03 ppm1 2.024 ppm2 1.232 CV 1
ASSI { 320}
(( segid "PX14" and resid 36 and name HG ))
( segid "PX14" and resid 36 and name HD1%)
2.800 2.800 3.200 peak 320 spectrum 2 weight 0.11000E+01 volume 0.23355E-02 ppm1 2.013 ppm2 0.560 CV 1
ASSI { 321}
(( segid "PX14" and resid 36 and name HG ))
(( segid "PX14" and resid 36 and name HA ))
3.300 3.300 2.700 peak 321 spectrum 2 weight 0.11000E+01 volume 0.11171E-02 ppm1 2.020 ppm2 3.393 CV 1
ASSI { 322}
(( segid "PX14" and resid 36 and name HB1 ))
(( segid "PX14" and resid 36 and name HG ))
3.200 3.200 2.800 peak 322 spectrum 2 weight 0.11000E+01 volume 0.12761E-02 ppm1 1.718 ppm2 2.061 CV 1
ASSI { 323}
(( segid "PX14" and resid 53 and name HB2 ))
(( segid "PX14" and resid 53 and name HB1 ))
1.900 1.900 4.100 peak 323 spectrum 2 weight 0.11000E+01 volume 0.74634E-02 ppm1 1.201 ppm2 2.023 CV 1
ASSI { 324}
(( segid "PX14" and resid 36 and name HB1 ))
( segid "PX14" and resid 36 and name HD1%)
3.900 3.900 2.100 peak 324 spectrum 2 weight 0.11000E+01 volume 0.56390E-03 ppm1 1.781 ppm2 0.556 CV 1
ASSI { 325}
(( segid "PX14" and resid 36 and name HB2 ))
( segid "PX14" and resid 36 and name HD1%)
2.500 2.500 3.500 peak 325 spectrum 2 weight 0.11000E+01 volume 0.41157E-02 ppm1 1.194 ppm2 0.552 CV 1
ASSI { 326}
(( segid "PX14" and resid 36 and name HB2 ))
( segid "PX14" and resid 36 and name HD2%)
3.200 3.200 2.800 peak 326 spectrum 2 weight 0.11000E+01 volume 0.24686E-02 ppm1 1.201 ppm2 0.178 CV 1
ASSI { 327}
(( segid "PX14" and resid 36 and name HB1 ))
( segid "PX14" and resid 36 and name HD2%)
2.700 2.700 3.300 peak 327 spectrum 2 weight 0.11000E+01 volume 0.27203E-02 ppm1 1.785 ppm2 0.182 CV 1
ASSI { 330}
( segid "PX14" and resid 36 and name HD1%)
( segid "PX14" and resid 36 and name HD2%)
2.300 2.300 3.700 peak 330 spectrum 2 weight 0.11000E+01 volume 0.92166E-02 ppm1 0.524 ppm2 0.187 CV 1
ASSI { 332}
( segid "PX14" and resid 36 and name HD2%)
(( segid "PX14" and resid 36 and name HG ))
2.500 2.500 3.500 peak 332 spectrum 2 weight 0.11000E+01 volume 0.39692E-02 ppm1 0.151 ppm2 2.043 CV 1
ASSI { 333}
( segid "PX14" and resid 36 and name HD2%)
(( segid "PX14" and resid 36 and name HA ))
4.600 4.600 1.400 peak 333 spectrum 2 weight 0.11000E+01 volume 0.16143E-03 ppm1 0.167 ppm2 3.399 CV 1
ASSI { 335}
(( segid "PX14" and resid 36 and name HA ))
( segid "PX14" and resid 36 and name HD1%)
2.700 2.700 3.300 peak 335 spectrum 2 weight 0.11000E+01 volume 0.69864E-02 ppm1 3.360 ppm2 0.561 CV 1
ASSI { 341}
(( segid "PX14" and resid 58 and name HB1 ))
(( segid "PX14" and resid 58 and name HA ))
2.800 2.800 3.200 peak 341 spectrum 2 weight 0.11000E+01 volume 0.21292E-02 ppm1 1.873 ppm2 4.407 CV 1
ASSI { 342}
(( segid "PX14" and resid 58 and name HB2 ))
(( segid "PX14" and resid 58 and name HA ))
3.200 3.200 2.800 peak 342 spectrum 2 weight 0.11000E+01 volume 0.17747E-02 ppm1 1.081 ppm2 4.401 CV 1
ASSI { 344}
(( segid "PX14" and resid 58 and name HB2 ))
(( segid "PX14" and resid 58 and name HB1 ))
1.900 1.900 4.100 peak 344 spectrum 2 weight 0.11000E+01 volume 0.69414E-02 ppm1 1.092 ppm2 1.904 CV 1
ASSI { 348}
(( segid "PX14" and resid 58 and name HA ))
(( segid "PX14" and resid 58 and name HG ))
2.600 2.600 3.400 peak 348 spectrum 2 weight 0.11000E+01 volume 0.39137E-02 ppm1 4.381 ppm2 1.665 CV 1
ASSI { 350}
(( segid "PX14" and resid 58 and name HG ))
( segid "PX14" and resid 58 and name HD2%)
2.900 2.900 3.100 peak 350 spectrum 2 weight 0.11000E+01 volume 0.19160E-02 ppm1 1.660 ppm2 0.903 CV 1
ASSI { 351}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX14" and resid 58 and name HB2 ))
2.500 2.500 3.500 peak 351 spectrum 2 weight 0.11000E+01 volume 0.41645E-02 ppm1 0.690 ppm2 1.122 CV 1
ASSI { 352}
( segid "PX14" and resid 58 and name HD1%)
( segid "PX14" and resid 58 and name HD2%)
2.700 2.700 3.300 peak 352 spectrum 2 weight 0.11000E+01 volume 0.38032E-02 ppm1 0.687 ppm2 0.899 CV 1
ASSI { 353}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX14" and resid 58 and name HG ))
2.200 2.200 3.800 peak 353 spectrum 2 weight 0.11000E+01 volume 0.10091E-01 ppm1 0.689 ppm2 1.692 CV 1
ASSI { 354}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX14" and resid 58 and name HA ))
4.100 4.100 1.900 peak 354 spectrum 2 weight 0.11000E+01 volume 0.62731E-03 ppm1 0.690 ppm2 4.407 CV 1
ASSI { 357}
( segid "PX14" and resid 58 and name HD2%)
(( segid "PX14" and resid 58 and name HA ))
2.900 2.900 3.100 peak 357 spectrum 2 weight 0.11000E+01 volume 0.27055E-02 ppm1 0.890 ppm2 4.399 CV 1
ASSI { 360}
(( segid "PX14" and resid 58 and name HB1 ))
( segid "PX14" and resid 58 and name HD2%)
3.100 3.100 2.900 peak 360 spectrum 2 weight 0.11000E+01 volume 0.10631E-02 ppm1 1.878 ppm2 0.924 CV 1
ASSI { 361}
(( segid "PX14" and resid 58 and name HB2 ))
( segid "PX14" and resid 58 and name HD2%)
3.500 3.500 2.500 peak 361 spectrum 2 weight 0.11000E+01 volume 0.15394E-02 ppm1 1.109 ppm2 0.881 CV 1
ASSI { 362}
(( segid "PX14" and resid 58 and name HB1 ))
( segid "PX14" and resid 58 and name HD1%)
3.100 3.100 2.900 peak 362 spectrum 2 weight 0.11000E+01 volume 0.20250E-02 ppm1 1.873 ppm2 0.707 CV 1
ASSI { 368}
(( segid "PX14" and resid 53 and name HB1 ))
(( segid "PX14" and resid 53 and name HA ))
3.800 3.800 2.200 peak 368 spectrum 2 weight 0.11000E+01 volume 0.28962E-03 ppm1 1.997 ppm2 3.472 CV 1
ASSI { 372}
(( segid "PX14" and resid 54 and name HD1 ))
(( segid "PX14" and resid 54 and name HE1 ))
2.300 2.300 3.700 peak 372 spectrum 2 weight 0.11000E+01 volume 0.10819E-01 ppm1 1.606 ppm2 2.859 CV 1
ASSI { 373}
(( segid "PX14" and resid 54 and name HD1 ))
(( segid "PX14" and resid 54 and name HA ))
3.100 3.100 2.900 peak 373 spectrum 2 weight 0.11000E+01 volume 0.36134E-02 ppm1 1.602 ppm2 4.036 CV 1
ASSI { 374}
(( segid "PX14" and resid 54 and name HD1 ))
(( segid "PX14" and resid 54 and name HG2 ))
2.300 2.300 3.700 peak 374 spectrum 2 weight 0.11000E+01 volume 0.52112E-02 ppm1 1.599 ppm2 1.400 CV 1
ASSI { 376}
(( segid "PX14" and resid 54 and name HB1 ))
(( segid "PX14" and resid 54 and name HE1 ))
3.500 3.500 2.500 peak 376 spectrum 2 weight 0.11000E+01 volume 0.18525E-02 ppm1 1.769 ppm2 2.870 CV 1
ASSI { 377}
(( segid "PX14" and resid 54 and name HB1 ))
(( segid "PX14" and resid 54 and name HA ))
2.300 2.300 3.700 peak 377 spectrum 2 weight 0.11000E+01 volume 0.10501E-01 ppm1 1.768 ppm2 4.136 CV 1
ASSI { 378}
(( segid "PX14" and resid 54 and name HB1 ))
(( segid "PX14" and resid 54 and name HG1 ))
2.200 2.200 3.800 peak 378 spectrum 2 weight 0.11000E+01 volume 0.17707E-01 ppm1 1.761 ppm2 1.493 CV 1
ASSI { 382}
(( segid "PX14" and resid 54 and name HA ))
(( segid "PX14" and resid 54 and name HG1 ))
4.800 4.800 1.200 peak 382 spectrum 2 weight 0.11000E+01 volume 0.11285E-03 ppm1 4.106 ppm2 1.483 CV 1
ASSI { 383}
(( segid "PX14" and resid 54 and name HG2 ))
(( segid "PX14" and resid 54 and name HE1 ))
4.300 4.300 1.700 peak 383 spectrum 2 weight 0.11000E+01 volume 0.37033E-03 ppm1 1.296 ppm2 2.871 CV 1
ASSI { 384}
(( segid "PX14" and resid 54 and name HG1 ))
(( segid "PX14" and resid 54 and name HE1 ))
3.200 3.200 2.800 peak 384 spectrum 2 weight 0.11000E+01 volume 0.16027E-02 ppm1 1.435 ppm2 2.871 CV 1
ASSI { 390}
(( segid "PX14" and resid 62 and name HB2 ))
(( segid "PX14" and resid 62 and name HB1 ))
1.900 1.900 4.100 peak 390 spectrum 2 weight 0.11000E+01 volume 0.81518E-02 ppm1 1.659 ppm2 2.486 CV 1
ASSI { 397}
(( segid "PX14" and resid 56 and name HG2 ))
(( segid "PX14" and resid 56 and name HB1 ))
3.000 3.000 3.000 peak 397 spectrum 2 weight 0.11000E+01 volume 0.15313E-02 ppm1 -1.197 ppm2 1.094 CV 1
ASSI { 398}
(( segid "PX14" and resid 56 and name HG1 ))
(( segid "PX14" and resid 56 and name HB1 ))
2.800 2.800 3.200 peak 398 spectrum 2 weight 0.11000E+01 volume 0.18827E-02 ppm1 -0.128 ppm2 1.091 CV 1
ASSI { 399}
(( segid "PX14" and resid 56 and name HG1 ))
(( segid "PX14" and resid 56 and name HA ))
4.800 4.800 1.200 peak 399 spectrum 2 weight 0.11000E+01 volume 0.17582E-03 ppm1 -0.134 ppm2 3.761 CV 1
ASSI { 403}
(( segid "PX14" and resid 56 and name HD1 ))
(( segid "PX14" and resid 56 and name HA ))
2.100 2.100 3.900 peak 403 spectrum 2 weight 0.11000E+01 volume 0.66862E-02 ppm1 0.772 ppm2 3.776 CV 1
ASSI { 404}
(( segid "PX14" and resid 56 and name HD2 ))
(( segid "PX14" and resid 56 and name HA ))
4.500 4.500 1.500 peak 404 spectrum 2 weight 0.11000E+01 volume 0.10239E-02 ppm1 0.572 ppm2 3.766 CV 1
ASSI { 405}
(( segid "PX14" and resid 56 and name HB1 ))
(( segid "PX14" and resid 56 and name HD2 ))
4.200 4.200 1.800 peak 405 spectrum 2 weight 0.11000E+01 volume 0.53140E-03 ppm1 1.171 ppm2 0.583 CV 1
ASSI { 408}
(( segid "PX14" and resid 56 and name HA ))
(( segid "PX14" and resid 56 and name HB1 ))
2.800 2.800 3.200 peak 408 spectrum 2 weight 0.11000E+01 volume 0.28940E-02 ppm1 3.725 ppm2 1.207 CV 1
ASSI { 412}
(( segid "PX14" and resid 50 and name HG1 ))
(( segid "PX14" and resid 50 and name HB2 ))
3.400 3.400 2.600 peak 412 spectrum 2 weight 0.11000E+01 volume 0.52349E-03 ppm1 1.485 ppm2 1.756 CV 1
ASSI { 414}
(( segid "PX14" and resid 20 and name HG1 ))
(( segid "PX14" and resid 20 and name HB1 ))
2.000 2.000 4.000 peak 414 spectrum 2 weight 0.11000E+01 volume 0.33255E-01 ppm1 2.205 ppm2 2.024 CV 1
ASSI { 415}
(( segid "PX14" and resid 20 and name HG1 ))
(( segid "PX14" and resid 20 and name HB2 ))
2.200 2.200 3.800 peak 415 spectrum 2 weight 0.11000E+01 volume 0.11801E-01 ppm1 2.202 ppm2 1.880 CV 1
ASSI { 416}
(( segid "PX14" and resid 20 and name HG1 ))
(( segid "PX14" and resid 20 and name HA ))
6.000 6.000 0.000 peak 416 spectrum 2 weight 0.11000E+01 volume 0.40679E-04 ppm1 2.199 ppm2 4.263 CV 1
ASSI { 419}
(( segid "PX14" and resid 20 and name HB1 ))
(( segid "PX14" and resid 20 and name HA ))
3.500 3.500 2.500 peak 419 spectrum 2 weight 0.11000E+01 volume 0.76788E-03 ppm1 1.985 ppm2 4.264 CV 1
ASSI { 420}
(( segid "PX14" and resid 20 and name HB2 ))
(( segid "PX14" and resid 20 and name HA ))
4.300 4.300 1.700 peak 420 spectrum 2 weight 0.11000E+01 volume 0.30142E-03 ppm1 1.869 ppm2 4.262 CV 1
ASSI { 425}
(( segid "PX14" and resid 21 and name HA ))
(( segid "PX14" and resid 21 and name HB1 ))
3.500 3.500 2.500 peak 425 spectrum 2 weight 0.11000E+01 volume 0.76741E-03 ppm1 4.657 ppm2 2.769 CV 1
ASSI { 432}
(( segid "PX14" and resid 37 and name HB1 ))
(( segid "PX14" and resid 37 and name HG1 ))
2.300 2.300 3.700 peak 432 spectrum 2 weight 0.11000E+01 volume 0.15287E-01 ppm1 2.022 ppm2 2.356 CV 1
ASSI { 434}
(( segid "PX14" and resid 37 and name HB1 ))
(( segid "PX14" and resid 37 and name HA ))
2.600 2.600 3.400 peak 434 spectrum 2 weight 0.11000E+01 volume 0.39342E-02 ppm1 2.032 ppm2 3.962 CV 1
ASSI { 436}
(( segid "PX14" and resid 37 and name HA ))
(( segid "PX14" and resid 37 and name HB2 ))
2.900 2.900 3.100 peak 436 spectrum 2 weight 0.11000E+01 volume 0.37470E-02 ppm1 3.941 ppm2 2.048 CV 1
ASSI { 437}
(( segid "PX14" and resid 37 and name HA ))
(( segid "PX14" and resid 37 and name HG2 ))
2.600 2.600 3.400 peak 437 spectrum 2 weight 0.11000E+01 volume 0.40113E-02 ppm1 3.941 ppm2 2.214 CV 1
ASSI { 438}
(( segid "PX14" and resid 37 and name HA ))
(( segid "PX14" and resid 37 and name HG1 ))
4.100 4.100 1.900 peak 438 spectrum 2 weight 0.11000E+01 volume 0.55607E-03 ppm1 3.938 ppm2 2.723 CV 1
ASSI { 441}
(( segid "PX14" and resid 37 and name HG1 ))
(( segid "PX14" and resid 37 and name HG2 ))
1.900 1.900 4.100 peak 441 spectrum 2 weight 0.11000E+01 volume 0.11514E-01 ppm1 2.701 ppm2 2.222 CV 1
ASSI { 450}
(( segid "PX14" and resid 43 and name HG1 ))
(( segid "PX14" and resid 43 and name HB2 ))
2.500 2.500 3.500 peak 450 spectrum 2 weight 0.11000E+01 volume 0.45301E-02 ppm1 2.530 ppm2 2.039 CV 1
ASSI { 451}
(( segid "PX14" and resid 43 and name HG2 ))
(( segid "PX14" and resid 43 and name HB2 ))
2.600 2.600 3.400 peak 451 spectrum 2 weight 0.11000E+01 volume 0.71736E-02 ppm1 2.332 ppm2 2.019 CV 1
ASSI { 452}
(( segid "PX14" and resid 43 and name HG2 ))
(( segid "PX14" and resid 43 and name HA ))
3.000 3.000 3.000 peak 452 spectrum 2 weight 0.11000E+01 volume 0.27198E-02 ppm1 2.332 ppm2 4.278 CV 1
ASSI { 453}
(( segid "PX14" and resid 43 and name HG1 ))
(( segid "PX14" and resid 43 and name HA ))
3.800 3.800 2.200 peak 453 spectrum 2 weight 0.11000E+01 volume 0.57342E-03 ppm1 2.524 ppm2 4.283 CV 1
ASSI { 455}
(( segid "PX14" and resid 43 and name HB1 ))
(( segid "PX14" and resid 43 and name HB2 ))
1.700 1.700 4.300 peak 455 spectrum 2 weight 0.11000E+01 volume 0.21213E-01 ppm1 2.237 ppm2 2.032 CV 1
ASSI { 456}
(( segid "PX14" and resid 43 and name HB1 ))
(( segid "PX14" and resid 43 and name HG1 ))
2.600 2.600 3.400 peak 456 spectrum 2 weight 0.11000E+01 volume 0.74245E-02 ppm1 2.235 ppm2 2.536 CV 1
ASSI { 459}
(( segid "PX14" and resid 43 and name HB1 ))
(( segid "PX14" and resid 43 and name HA ))
4.100 4.100 1.900 peak 459 spectrum 2 weight 0.11000E+01 volume 0.29146E-03 ppm1 2.249 ppm2 4.283 CV 1
ASSI { 467}
(( segid "PX14" and resid 60 and name HB2 ))
(( segid "PX14" and resid 60 and name HB1 ))
1.900 1.900 4.100 peak 467 spectrum 2 weight 0.11000E+01 volume 0.15915E-01 ppm1 2.434 ppm2 2.642 CV 1
ASSI { 468}
(( segid "PX14" and resid 60 and name HB2 ))
(( segid "PX14" and resid 60 and name HA ))
3.800 3.800 2.200 peak 468 spectrum 2 weight 0.11000E+01 volume 0.38719E-03 ppm1 2.430 ppm2 4.182 CV 1
ASSI { 469}
(( segid "PX14" and resid 60 and name HB1 ))
(( segid "PX14" and resid 60 and name HA ))
3.400 3.400 2.600 peak 469 spectrum 2 weight 0.11000E+01 volume 0.12073E-02 ppm1 2.616 ppm2 4.185 CV 1
ASSI { 474}
(( segid "PX14" and resid 62 and name HB2 ))
(( segid "PX14" and resid 62 and name HA ))
3.100 3.100 2.900 peak 474 spectrum 2 weight 0.11000E+01 volume 0.23996E-02 ppm1 1.657 ppm2 3.841 CV 1
ASSI { 475}
(( segid "PX14" and resid 62 and name HB1 ))
(( segid "PX14" and resid 62 and name HA ))
5.100 5.100 0.900 peak 475 spectrum 2 weight 0.11000E+01 volume 0.52784E-04 ppm1 2.464 ppm2 3.842 CV 1
ASSI { 476}
(( segid "PX14" and resid 62 and name HB2 ))
(( segid "PX14" and resid 62 and name HG2 ))
3.300 3.300 2.700 peak 476 spectrum 2 weight 0.11000E+01 volume 0.14310E-02 ppm1 1.651 ppm2 2.149 CV 1
ASSI { 477}
(( segid "PX14" and resid 62 and name HB1 ))
(( segid "PX14" and resid 62 and name HG2 ))
3.000 3.000 3.000 peak 477 spectrum 2 weight 0.11000E+01 volume 0.12746E-02 ppm1 2.448 ppm2 2.153 CV 1
ASSI { 479}
(( segid "PX14" and resid 62 and name HG2 ))
(( segid "PX14" and resid 62 and name HG1 ))
2.000 2.000 4.000 peak 479 spectrum 2 weight 0.11000E+01 volume 0.81780E-02 ppm1 2.104 ppm2 2.455 CV 1
ASSI { 482}
(( segid "PX14" and resid 62 and name HG1 ))
(( segid "PX14" and resid 62 and name HB2 ))
2.900 2.900 3.100 peak 482 spectrum 2 weight 0.11000E+01 volume 0.11564E-02 ppm1 2.406 ppm2 1.655 CV 1
ASSI { 484}
(( segid "PX14" and resid 62 and name HG1 ))
(( segid "PX14" and resid 62 and name HA ))
3.500 3.500 2.500 peak 484 spectrum 2 weight 0.11000E+01 volume 0.13474E-02 ppm1 2.417 ppm2 3.808 CV 1
ASSI { 485}
(( segid "PX14" and resid 62 and name HG2 ))
(( segid "PX14" and resid 62 and name HA ))
2.900 2.900 3.100 peak 485 spectrum 2 weight 0.11000E+01 volume 0.20131E-02 ppm1 2.109 ppm2 3.833 CV 1
ASSI { 490}
(( segid "PX14" and resid 64 and name HA ))
(( segid "PX14" and resid 64 and name HB2 ))
2.700 2.700 3.300 peak 490 spectrum 2 weight 0.11000E+01 volume 0.31400E-02 ppm1 4.389 ppm2 2.625 CV 1
ASSI { 496}
(( segid "PX14" and resid 64 and name HB2 ))
(( segid "PX14" and resid 64 and name HB1 ))
1.900 1.900 4.100 peak 496 spectrum 2 weight 0.11000E+01 volume 0.13971E-01 ppm1 2.603 ppm2 2.831 CV 1
ASSI { 498}
(( segid "PX14" and resid 69 and name HG2 ))
(( segid "PX14" and resid 69 and name HA ))
2.500 2.500 3.500 peak 498 spectrum 2 weight 0.11000E+01 volume 0.60242E-02 ppm1 2.308 ppm2 4.061 CV 1
ASSI { 499}
(( segid "PX14" and resid 69 and name HG1 ))
(( segid "PX14" and resid 69 and name HA ))
3.000 3.000 3.000 peak 499 spectrum 2 weight 0.11000E+01 volume 0.34225E-02 ppm1 2.539 ppm2 4.052 CV 1
ASSI { 504}
(( segid "PX14" and resid 69 and name HG1 ))
(( segid "PX14" and resid 69 and name HB1 ))
2.800 2.800 3.200 peak 504 spectrum 2 weight 0.11000E+01 volume 0.32743E-02 ppm1 2.556 ppm2 2.061 CV 1
ASSI { 505}
(( segid "PX14" and resid 69 and name HG2 ))
(( segid "PX14" and resid 69 and name HB1 ))
2.800 2.800 3.200 peak 505 spectrum 2 weight 0.11000E+01 volume 0.34958E-02 ppm1 2.297 ppm2 2.069 CV 1
ASSI { 506}
(( segid "PX14" and resid 69 and name HG1 ))
(( segid "PX14" and resid 69 and name HB2 ))
3.000 3.000 3.000 peak 506 spectrum 2 weight 0.11000E+01 volume 0.13227E-02 ppm1 2.556 ppm2 1.880 CV 1
ASSI { 507}
(( segid "PX14" and resid 69 and name HG2 ))
(( segid "PX14" and resid 69 and name HB2 ))
3.000 3.000 3.000 peak 507 spectrum 2 weight 0.11000E+01 volume 0.21744E-02 ppm1 2.299 ppm2 1.906 CV 1
ASSI { 508}
(( segid "PX14" and resid 25 and name HB2 ))
(( segid "PX14" and resid 25 and name HA ))
3.100 3.100 2.900 peak 508 spectrum 2 weight 0.11000E+01 volume 0.20048E-02 ppm1 1.792 ppm2 4.352 CV 1
ASSI { 509}
(( segid "PX14" and resid 25 and name HB1 ))
(( segid "PX14" and resid 25 and name HA ))
3.000 3.000 3.000 peak 509 spectrum 2 weight 0.11000E+01 volume 0.14014E-02 ppm1 2.004 ppm2 4.348 CV 1
ASSI { 510}
(( segid "PX14" and resid 25 and name HB2 ))
(( segid "PX14" and resid 25 and name HD1 ))
4.600 4.600 1.400 peak 510 spectrum 2 weight 0.11000E+01 volume 0.21715E-03 ppm1 1.787 ppm2 3.254 CV 1
ASSI { 511}
(( segid "PX14" and resid 25 and name HB1 ))
(( segid "PX14" and resid 25 and name HD2 ))
4.800 4.800 1.200 peak 511 spectrum 2 weight 0.11000E+01 volume 0.16887E-03 ppm1 2.004 ppm2 3.048 CV 1
ASSI { 512}
(( segid "PX14" and resid 25 and name HB1 ))
(( segid "PX14" and resid 25 and name HD1 ))
6.000 6.000 0.000 peak 512 spectrum 2 weight 0.11000E+01 volume 0.13229E-04 ppm1 2.018 ppm2 3.257 CV 1
ASSI { 515}
(( segid "PX14" and resid 75 and name HB2 ))
(( segid "PX14" and resid 75 and name HA ))
3.400 3.400 2.600 peak 515 spectrum 2 weight 0.11000E+01 volume 0.90985E-03 ppm1 2.505 ppm2 4.502 CV 1
ASSI { 516}
(( segid "PX14" and resid 75 and name HB1 ))
(( segid "PX14" and resid 75 and name HA ))
3.300 3.300 2.700 peak 516 spectrum 2 weight 0.11000E+01 volume 0.14304E-02 ppm1 2.623 ppm2 4.502 CV 1
ASSI { 522}
(( segid "PX14" and resid 25 and name HD2 ))
(( segid "PX14" and resid 25 and name HA ))
3.700 3.700 2.300 peak 522 spectrum 2 weight 0.11000E+01 volume 0.10560E-02 ppm1 3.031 ppm2 4.350 CV 1
ASSI { 525}
(( segid "PX14" and resid 25 and name HD2 ))
(( segid "PX14" and resid 25 and name HD1 ))
1.900 1.900 4.100 peak 525 spectrum 2 weight 0.11000E+01 volume 0.89838E-02 ppm1 3.030 ppm2 3.261 CV 1
ASSI { 527}
(( segid "PX14" and resid 25 and name HA ))
(( segid "PX14" and resid 25 and name HG1 ))
2.600 2.600 3.400 peak 527 spectrum 2 weight 0.11000E+01 volume 0.63438E-02 ppm1 4.331 ppm2 1.823 CV 1
ASSI { 531}
(( segid "PX14" and resid 25 and name HB2 ))
(( segid "PX14" and resid 25 and name HD2 ))
2.900 2.900 3.100 peak 531 spectrum 2 weight 0.11000E+01 volume 0.27177E-02 ppm1 1.773 ppm2 3.061 CV 1
ASSI { 532}
(( segid "PX14" and resid 25 and name HG1 ))
(( segid "PX14" and resid 25 and name HB1 ))
2.600 2.600 3.400 peak 532 spectrum 2 weight 0.11000E+01 volume 0.45331E-02 ppm1 1.793 ppm2 2.058 CV 1
ASSI { 536}
(( segid "PX14" and resid 69 and name HA ))
(( segid "PX14" and resid 69 and name HB1 ))
2.500 2.500 3.500 peak 536 spectrum 2 weight 0.11000E+01 volume 0.57099E-02 ppm1 4.035 ppm2 2.074 CV 1
ASSI { 537}
(( segid "PX14" and resid 69 and name HA ))
(( segid "PX14" and resid 69 and name HB2 ))
3.100 3.100 2.900 peak 537 spectrum 2 weight 0.11000E+01 volume 0.21719E-02 ppm1 4.031 ppm2 1.877 CV 1
ASSI { 541}
(( segid "PX14" and resid 49 and name HD1 ))
(( segid "PX14" and resid 49 and name HD2 ))
1.900 1.900 4.100 peak 541 spectrum 2 weight 0.11000E+01 volume 0.98157E-02 ppm1 3.234 ppm2 2.665 CV 1
ASSI { 542}
(( segid "PX14" and resid 49 and name HD1 ))
(( segid "PX14" and resid 49 and name HB1 ))
4.500 4.500 1.500 peak 542 spectrum 2 weight 0.11000E+01 volume 0.26555E-03 ppm1 3.193 ppm2 2.416 CV 1
ASSI { 543}
(( segid "PX14" and resid 49 and name HD2 ))
(( segid "PX14" and resid 49 and name HB1 ))
3.800 3.800 2.200 peak 543 spectrum 2 weight 0.11000E+01 volume 0.36001E-03 ppm1 2.613 ppm2 2.423 CV 1
ASSI { 544}
(( segid "PX14" and resid 49 and name HD1 ))
(( segid "PX14" and resid 49 and name HB2 ))
2.900 2.900 3.100 peak 544 spectrum 2 weight 0.11000E+01 volume 0.24655E-02 ppm1 3.214 ppm2 1.614 CV 1
ASSI { 545}
(( segid "PX14" and resid 49 and name HD2 ))
(( segid "PX14" and resid 49 and name HB2 ))
3.700 3.700 2.300 peak 545 spectrum 2 weight 0.11000E+01 volume 0.76620E-03 ppm1 2.625 ppm2 1.652 CV 1
ASSI { 546}
(( segid "PX14" and resid 49 and name HD1 ))
(( segid "PX14" and resid 49 and name HG1 ))
3.100 3.100 2.900 peak 546 spectrum 2 weight 0.11000E+01 volume 0.86818E-03 ppm1 3.234 ppm2 1.198 CV 1
ASSI { 547}
(( segid "PX14" and resid 49 and name HD2 ))
(( segid "PX14" and resid 49 and name HG1 ))
3.700 3.700 2.300 peak 547 spectrum 2 weight 0.11000E+01 volume 0.57338E-03 ppm1 2.660 ppm2 1.190 CV 1
ASSI { 548}
(( segid "PX14" and resid 49 and name HG1 ))
(( segid "PX14" and resid 49 and name HG2 ))
2.500 2.500 3.500 peak 548 spectrum 2 weight 0.11000E+01 volume 0.16424E-02 ppm1 1.686 ppm2 1.207 CV 1
ASSI { 550}
(( segid "PX14" and resid 49 and name HG1 ))
(( segid "PX14" and resid 49 and name HB1 ))
4.800 4.800 1.200 peak 550 spectrum 2 weight 0.11000E+01 volume 0.20192E-03 ppm1 1.161 ppm2 2.391 CV 1
ASSI { 552}
(( segid "PX14" and resid 49 and name HG1 ))
(( segid "PX14" and resid 49 and name HA ))
4.100 4.100 1.900 peak 552 spectrum 2 weight 0.11000E+01 volume 0.35664E-03 ppm1 1.161 ppm2 3.964 CV 1
ASSI { 553}
(( segid "PX14" and resid 49 and name HD1 ))
(( segid "PX14" and resid 49 and name HA ))
6.000 6.000 0.000 peak 553 spectrum 2 weight 0.11000E+01 volume 0.60820E-04 ppm1 3.197 ppm2 3.979 CV 1
ASSI { 554}
(( segid "PX14" and resid 49 and name HD2 ))
(( segid "PX14" and resid 49 and name HA ))
6.000 6.000 0.000 peak 554 spectrum 2 weight 0.11000E+01 volume 0.40758E-05 ppm1 2.646 ppm2 3.982 CV 1
ASSI { 555}
(( segid "PX14" and resid 49 and name HB1 ))
(( segid "PX14" and resid 49 and name HB2 ))
1.900 1.900 4.100 peak 555 spectrum 2 weight 0.11000E+01 volume 0.82934E-02 ppm1 2.375 ppm2 1.673 CV 1
ASSI { 560}
(( segid "PX14" and resid 49 and name HB1 ))
(( segid "PX14" and resid 49 and name HA ))
3.200 3.200 2.800 peak 560 spectrum 2 weight 0.11000E+01 volume 0.95098E-03 ppm1 2.389 ppm2 3.949 CV 1
ASSI { 561}
(( segid "PX14" and resid 49 and name HB2 ))
(( segid "PX14" and resid 49 and name HA ))
3.400 3.400 2.600 peak 561 spectrum 2 weight 0.11000E+01 volume 0.10611E-02 ppm1 1.612 ppm2 3.972 CV 1
ASSI { 571}
(( segid "PX14" and resid 50 and name HD1 ))
(( segid "PX14" and resid 50 and name HB1 ))
3.000 3.000 3.000 peak 571 spectrum 2 weight 0.11000E+01 volume 0.20907E-02 ppm1 3.129 ppm2 1.879 CV 1
ASSI { 573}
(( segid "PX14" and resid 50 and name HG1 ))
(( segid "PX14" and resid 50 and name HD1 ))
3.500 3.500 2.500 peak 573 spectrum 2 weight 0.11000E+01 volume 0.53231E-03 ppm1 1.499 ppm2 3.151 CV 1
ASSI { 574}
(( segid "PX14" and resid 40 and name HB1 ))
(( segid "PX14" and resid 40 and name HD2 ))
3.000 3.000 3.000 peak 574 spectrum 2 weight 0.11000E+01 volume 0.22034E-02 ppm1 1.856 ppm2 3.135 CV 1
ASSI { 575}
(( segid "PX14" and resid 50 and name HB2 ))
(( segid "PX14" and resid 50 and name HA ))
2.900 2.900 3.100 peak 575 spectrum 2 weight 0.11000E+01 volume 0.26718E-02 ppm1 1.691 ppm2 3.886 CV 1
ASSI { 576}
(( segid "PX14" and resid 50 and name HG1 ))
(( segid "PX14" and resid 50 and name HA ))
3.900 3.900 2.100 peak 576 spectrum 2 weight 0.11000E+01 volume 0.38881E-03 ppm1 1.476 ppm2 3.886 CV 1
ASSI { 578}
(( segid "PX14" and resid 50 and name HB1 ))
(( segid "PX14" and resid 50 and name HA ))
2.800 2.800 3.200 peak 578 spectrum 2 weight 0.11000E+01 volume 0.23964E-02 ppm1 1.876 ppm2 3.918 CV 1
ASSI { 579}
(( segid "PX14" and resid 50 and name HG1 ))
(( segid "PX14" and resid 50 and name HB1 ))
2.900 2.900 3.100 peak 579 spectrum 2 weight 0.11000E+01 volume 0.44520E-02 ppm1 1.485 ppm2 1.873 CV 1
ASSI { 587}
( segid "PX14" and resid 53 and name HD1%)
(( segid "PX14" and resid 53 and name HB1 ))
2.700 2.700 3.300 peak 587 spectrum 2 weight 0.11000E+01 volume 0.35004E-02 ppm1 0.706 ppm2 2.027 CV 1
ASSI { 589}
( segid "PX14" and resid 53 and name HD2%)
(( segid "PX14" and resid 53 and name HA ))
3.800 3.800 2.200 peak 589 spectrum 2 weight 0.11000E+01 volume 0.36793E-03 ppm1 0.908 ppm2 3.458 CV 1
ASSI { 590}
( segid "PX14" and resid 53 and name HD2%)
(( segid "PX14" and resid 53 and name HB2 ))
6.000 6.000 0.000 peak 590 spectrum 2 weight 0.11000E+01 volume 0.25377E-04 ppm1 0.910 ppm2 1.345 CV 1
ASSI { 591}
(( segid "PX14" and resid 53 and name HB1 ))
( segid "PX14" and resid 53 and name HD2%)
2.800 1.000 1.000 peak 591 spectrum 2 weight 0.11000E+01 volume 0.23500E-02 ppm1 1.984 ppm2 0.943 CV 1
ASSI { 599}
(( segid "PX14" and resid 53 and name HA ))
( segid "PX14" and resid 53 and name HD1%)
3.100 3.100 2.900 peak 599 spectrum 2 weight 0.11000E+01 volume 0.37367E-02 ppm1 3.456 ppm2 0.733 CV 1
ASSI { 600}
(( segid "PX14" and resid 42 and name HG2 ))
(( segid "PX14" and resid 42 and name HD1 ))
3.200 3.200 2.800 peak 600 spectrum 2 weight 0.11000E+01 volume 0.99727E-03 ppm1 1.615 ppm2 3.026 CV 1
ASSI { 601}
(( segid "PX14" and resid 42 and name HG1 ))
(( segid "PX14" and resid 42 and name HD1 ))
2.600 2.600 3.400 peak 601 spectrum 2 weight 0.11000E+01 volume 0.47999E-02 ppm1 1.706 ppm2 3.035 CV 1
ASSI { 602}
(( segid "PX14" and resid 42 and name HG2 ))
(( segid "PX14" and resid 42 and name HA ))
3.300 3.300 2.700 peak 602 spectrum 2 weight 0.11000E+01 volume 0.14259E-02 ppm1 1.603 ppm2 3.828 CV 1
ASSI { 603}
(( segid "PX14" and resid 42 and name HG1 ))
(( segid "PX14" and resid 42 and name HA ))
3.300 3.300 2.700 peak 603 spectrum 2 weight 0.11000E+01 volume 0.87637E-03 ppm1 1.703 ppm2 3.829 CV 1
ASSI { 604}
(( segid "PX14" and resid 42 and name HB1 ))
(( segid "PX14" and resid 42 and name HA ))
3.600 3.600 2.400 peak 604 spectrum 2 weight 0.11000E+01 volume 0.95453E-03 ppm1 1.864 ppm2 3.826 CV 1
ASSI { 605}
(( segid "PX14" and resid 42 and name HB2 ))
(( segid "PX14" and resid 42 and name HA ))
3.200 3.200 2.800 peak 605 spectrum 2 weight 0.11000E+01 volume 0.99586E-03 ppm1 1.742 ppm2 3.832 CV 1
ASSI { 607}
(( segid "PX14" and resid 42 and name HD1 ))
(( segid "PX14" and resid 42 and name HB1 ))
2.800 2.800 3.200 peak 607 spectrum 2 weight 0.11000E+01 volume 0.23146E-02 ppm1 2.999 ppm2 1.895 CV 1
ASSI { 610}
(( segid "PX14" and resid 42 and name HD1 ))
(( segid "PX14" and resid 42 and name HA ))
3.300 3.300 2.700 peak 610 spectrum 2 weight 0.11000E+01 volume 0.36066E-02 ppm1 2.999 ppm2 3.811 CV 1
ASSI { 611}
(( segid "PX14" and resid 42 and name HG2 ))
(( segid "PX14" and resid 42 and name HB1 ))
2.200 2.200 3.800 peak 611 spectrum 2 weight 0.11000E+01 volume 0.84356E-02 ppm1 1.558 ppm2 1.867 CV 1
ASSI { 616}
(( segid "PX14" and resid 55 and name HB1 ))
(( segid "PX14" and resid 55 and name HG1 ))
3.300 3.300 2.700 peak 616 spectrum 2 weight 0.11000E+01 volume 0.14067E-02 ppm1 1.673 ppm2 1.158 CV 1
ASSI { 617}
(( segid "PX14" and resid 55 and name HB1 ))
(( segid "PX14" and resid 55 and name HA ))
2.200 2.200 3.800 peak 617 spectrum 2 weight 0.11000E+01 volume 0.13158E-01 ppm1 1.686 ppm2 3.873 CV 1
ASSI { 619}
(( segid "PX14" and resid 55 and name HG1 ))
(( segid "PX14" and resid 55 and name HE1 ))
4.100 4.100 1.900 peak 619 spectrum 2 weight 0.11000E+01 volume 0.29874E-03 ppm1 1.125 ppm2 2.789 CV 1
ASSI { 620}
(( segid "PX14" and resid 55 and name HG1 ))
(( segid "PX14" and resid 55 and name HA ))
2.400 2.400 3.600 peak 620 spectrum 2 weight 0.11000E+01 volume 0.78955E-02 ppm1 1.139 ppm2 3.883 CV 1
ASSI { 621}
(( segid "PX14" and resid 55 and name HB1 ))
(( segid "PX14" and resid 55 and name HD1 ))
2.500 2.500 3.500 peak 621 spectrum 2 weight 0.11000E+01 volume 0.52946E-02 ppm1 1.704 ppm2 1.379 CV 1
ASSI { 622}
(( segid "PX14" and resid 55 and name HG1 ))
(( segid "PX14" and resid 55 and name HD1 ))
3.100 3.100 2.900 peak 622 spectrum 2 weight 0.11000E+01 volume 0.29047E-02 ppm1 1.145 ppm2 1.358 CV 1
ASSI { 624}
(( segid "PX14" and resid 55 and name HE1 ))
(( segid "PX14" and resid 55 and name HA ))
4.400 4.400 1.600 peak 624 spectrum 2 weight 0.11000E+01 volume 0.95118E-04 ppm1 2.755 ppm2 3.943 CV 1
ASSI { 626}
(( segid "PX14" and resid 55 and name HA ))
(( segid "PX14" and resid 55 and name HD1 ))
3.300 3.300 2.700 peak 626 spectrum 2 weight 0.11000E+01 volume 0.19326E-02 ppm1 3.861 ppm2 1.349 CV 1
ASSI { 629}
(( segid "PX14" and resid 24 and name HD2 ))
(( segid "PX14" and resid 24 and name HG2 ))
2.300 2.300 3.700 peak 629 spectrum 2 weight 0.11000E+01 volume 0.57767E-02 ppm1 3.549 ppm2 1.918 CV 1
ASSI { 630}
(( segid "PX14" and resid 24 and name HD1 ))
(( segid "PX14" and resid 24 and name HG2 ))
3.900 3.900 2.100 peak 630 spectrum 2 weight 0.11000E+01 volume 0.67650E-03 ppm1 3.874 ppm2 1.911 CV 1
ASSI { 631}
(( segid "PX14" and resid 24 and name HD1 ))
(( segid "PX14" and resid 24 and name HB1 ))
4.300 4.300 1.700 peak 631 spectrum 2 weight 0.11000E+01 volume 0.37554E-03 ppm1 3.891 ppm2 2.157 CV 1
ASSI { 634}
(( segid "PX14" and resid 26 and name HG1 ))
(( segid "PX14" and resid 26 and name HA ))
3.500 3.500 2.500 peak 634 spectrum 2 weight 0.11000E+01 volume 0.11219E-02 ppm1 2.330 ppm2 4.042 CV 1
ASSI { 643}
( segid "PX14" and resid 72 and name HG2%)
( segid "PX14" and resid 67 and name HE% )
5.400 5.400 0.600 peak 643 spectrum 2 weight 0.11000E+01 volume 0.26853E-04 ppm1 0.904 ppm2 7.044 CV 1
ASSI { 644}
( segid "PX14" and resid 72 and name HG2%)
( segid "PX14" and resid 67 and name HD% )
4.400 4.400 1.600 peak 644 spectrum 2 weight 0.11000E+01 volume 0.29440E-03 ppm1 0.895 ppm2 7.262 CV 1
ASSI { 646}
(( segid "PX14" and resid 52 and name HA ))
( segid "PX05" and resid 107 and name HD% )
4.400 4.400 1.600 peak 646 spectrum 2 weight 0.11000E+01 volume 0.45987E-03 ppm1 4.059 ppm2 6.766 CV 1
ASSI { 647}
(( segid "PX14" and resid 52 and name HA ))
( segid "PX14" and resid 51 and name HB% )
4.300 4.300 1.700 peak 647 spectrum 2 weight 0.11000E+01 volume 0.31975E-03 ppm1 4.052 ppm2 1.533 CV 1
ASSI { 648}
(( segid "PX14" and resid 24 and name HA ))
( segid "PX14" and resid 29 and name HD1%)
3.700 3.700 2.300 peak 648 spectrum 2 weight 0.11000E+01 volume 0.80223E-03 ppm1 4.427 ppm2 0.888 CV 1
ASSI { 649}
(( segid "PX14" and resid 24 and name HA ))
(( segid "PX14" and resid 62 and name HG1 ))
3.600 3.600 2.400 peak 649 spectrum 2 weight 0.11000E+01 volume 0.87630E-03 ppm1 4.408 ppm2 2.421 CV 1
ASSI { 650}
(( segid "PX14" and resid 24 and name HB1 ))
(( segid "PX14" and resid 62 and name HA ))
3.300 3.300 2.700 peak 650 spectrum 2 weight 0.11000E+01 volume 0.13323E-02 ppm1 2.112 ppm2 3.844 CV 1
ASSI { 652}
(( segid "PX14" and resid 48 and name HA ))
( segid "PX05" and resid 107 and name HE% )
3.700 3.700 2.300 peak 652 spectrum 2 weight 0.11000E+01 volume 0.92857E-03 ppm1 4.428 ppm2 7.247 CV 1
ASSI { 654}
(( segid "PX14" and resid 48 and name HB ))
( segid "PX14" and resid 48 and name HG2%)
2.300 2.300 3.700 peak 654 spectrum 2 weight 0.11000E+01 volume 0.92031E-02 ppm1 4.470 ppm2 1.399 CV 1
ASSI { 655}
(( segid "PX14" and resid 31 and name HB ))
(( segid "PX14" and resid 28 and name HA ))
3.600 3.600 2.400 peak 655 spectrum 2 weight 0.11000E+01 volume 0.63982E-03 ppm1 3.835 ppm2 4.123 CV 1
ASSI { 656}
(( segid "PX14" and resid 33 and name HA ))
( segid "PX14" and resid 36 and name HD2%)
3.700 3.700 2.300 peak 656 spectrum 2 weight 0.11000E+01 volume 0.11054E-02 ppm1 3.288 ppm2 0.177 CV 1
ASSI { 658}
(( segid "PX14" and resid 63 and name HA ))
( segid "PX14" and resid 66 and name HB% )
2.800 2.800 3.200 peak 658 spectrum 2 weight 0.11000E+01 volume 0.25932E-02 ppm1 3.243 ppm2 1.307 CV 1
ASSI { 659}
(( segid "PX14" and resid 48 and name HA ))
( segid "PX14" and resid 51 and name HB% )
2.700 2.700 3.300 peak 659 spectrum 2 weight 0.11000E+01 volume 0.33676E-02 ppm1 4.228 ppm2 1.544 CV 1
ASSI { 660}
(( segid "PX14" and resid 29 and name HA ))
( segid "PX14" and resid 66 and name HB% )
3.200 3.200 2.800 peak 660 spectrum 2 weight 0.11000E+01 volume 0.17973E-02 ppm1 3.373 ppm2 1.311 CV 1
ASSI { 662}
(( segid "PX14" and resid 70 and name HB1 ))
(( segid "PX14" and resid 33 and name HA ))
3.300 3.300 2.700 peak 662 spectrum 2 weight 0.11000E+01 volume 0.10199E-02 ppm1 4.051 ppm2 3.285 CV 1
ASSI { 663}
(( segid "PX14" and resid 70 and name HB1 ))
( segid "PX14" and resid 33 and name HG1%)
3.700 3.700 2.300 peak 663 spectrum 2 weight 0.11000E+01 volume 0.25178E-03 ppm1 4.051 ppm2 1.127 CV 1
ASSI { 664}
(( segid "PX14" and resid 70 and name HB1 ))
( segid "PX14" and resid 33 and name HG2%)
2.400 2.400 3.600 peak 664 spectrum 2 weight 0.11000E+01 volume 0.33453E-02 ppm1 4.051 ppm2 0.640 CV 1
ASSI { 665}
(( segid "PX14" and resid 70 and name HB2 ))
( segid "PX14" and resid 33 and name HG2%)
3.000 3.000 3.000 peak 665 spectrum 2 weight 0.11000E+01 volume 0.92541E-03 ppm1 3.821 ppm2 0.640 CV 1
ASSI { 667}
(( segid "PX14" and resid 78 and name HB2 ))
(( segid "PX14" and resid 78 and name HA ))
4.400 4.400 1.600 peak 667 spectrum 2 weight 0.11000E+01 volume 0.22219E-03 ppm1 3.626 ppm2 4.180 CV 1
ASSI { 670}
(( segid "PX14" and resid 44 and name HB1 ))
( segid "PX05" and resid 107 and name HE% )
2.800 2.800 3.200 peak 670 spectrum 2 weight 0.11000E+01 volume 0.42994E-02 ppm1 4.124 ppm2 7.278 CV 1
ASSI { 671}
(( segid "PX14" and resid 44 and name HB1 ))
(( segid "PX14" and resid 44 and name HA ))
2.200 2.200 3.800 peak 671 spectrum 2 weight 0.11000E+01 volume 0.99056E-02 ppm1 4.100 ppm2 4.807 CV 1
ASSI { 677}
(( segid "PX14" and resid 67 and name HA ))
( segid "PX14" and resid 36 and name HD2%)
3.100 3.100 2.900 peak 677 spectrum 2 weight 0.11000E+01 volume 0.20129E-02 ppm1 3.927 ppm2 0.167 CV 1
ASSI { 680}
(( segid "PX14" and resid 26 and name HA ))
(( segid "PX14" and resid 26 and name HB1 ))
2.600 2.600 3.400 peak 680 spectrum 2 weight 0.11000E+01 volume 0.34676E-02 ppm1 4.007 ppm2 2.086 CV 1
ASSI { 682}
(( segid "PX14" and resid 35 and name HA ))
( segid "PX14" and resid 35 and name HD% )
2.900 2.900 3.100 peak 682 spectrum 2 weight 0.11000E+01 volume 0.21995E-02 ppm1 4.226 ppm2 7.204 CV 1
ASSI { 683}
(( segid "PX14" and resid 61 and name HA ))
(( segid "PX14" and resid 64 and name HB2 ))
3.500 3.500 2.500 peak 683 spectrum 2 weight 0.11000E+01 volume 0.11296E-02 ppm1 4.029 ppm2 2.631 CV 1
ASSI { 684}
(( segid "PX14" and resid 70 and name HA ))
( segid "PX14" and resid 33 and name HG2%)
2.400 2.400 3.600 peak 684 spectrum 2 weight 0.11000E+01 volume 0.33548E-02 ppm1 4.242 ppm2 0.644 CV 1
ASSI { 685}
(( segid "PX14" and resid 68 and name HA ))
(( segid "PX14" and resid 68 and name HG1 ))
2.900 2.900 3.100 peak 685 spectrum 2 weight 0.11000E+01 volume 0.34792E-02 ppm1 4.056 ppm2 2.519 CV 1
ASSI { 686}
(( segid "PX14" and resid 68 and name HA ))
(( segid "PX14" and resid 68 and name HB1 ))
2.100 2.100 3.900 peak 686 spectrum 2 weight 0.11000E+01 volume 0.17939E-01 ppm1 4.041 ppm2 2.250 CV 1
ASSI { 687}
(( segid "PX14" and resid 68 and name HA ))
( segid "PX14" and resid 73 and name HB% )
3.500 3.500 2.500 peak 687 spectrum 2 weight 0.11000E+01 volume 0.90723E-03 ppm1 4.041 ppm2 1.307 CV 1
ASSI { 689}
(( segid "PX14" and resid 62 and name HA ))
( segid "PX14" and resid 29 and name HD1%)
3.600 3.600 2.400 peak 689 spectrum 2 weight 0.11000E+01 volume 0.67153E-03 ppm1 3.810 ppm2 0.893 CV 1
ASSI { 693}
(( segid "PX14" and resid 42 and name HA ))
(( segid "PX14" and resid 49 and name HD1 ))
3.600 3.600 2.400 peak 693 spectrum 2 weight 0.11000E+01 volume 0.86973E-03 ppm1 3.799 ppm2 3.242 CV 1
ASSI { 697}
(( segid "PX14" and resid 40 and name HA ))
(( segid "PX14" and resid 40 and name HB1 ))
2.100 2.100 3.900 peak 697 spectrum 2 weight 0.11000E+01 volume 0.11768E-01 ppm1 4.173 ppm2 1.876 CV 1
ASSI { 700}
(( segid "PX14" and resid 37 and name HA ))
( segid "PX14" and resid 72 and name HG2%)
5.700 5.700 0.300 peak 700 spectrum 2 weight 0.11000E+01 volume 0.50062E-04 ppm1 3.986 ppm2 0.904 CV 1
ASSI { 701}
(( segid "PX14" and resid 30 and name HA ))
(( segid "PX14" and resid 33 and name HB ))
3.100 3.100 2.900 peak 701 spectrum 2 weight 0.11000E+01 volume 0.37227E-02 ppm1 3.947 ppm2 2.129 CV 1
ASSI { 709}
(( segid "PX14" and resid 51 and name HA ))
(( segid "PX14" and resid 50 and name HB1 ))
3.600 3.600 2.400 peak 709 spectrum 2 weight 0.11000E+01 volume 0.69307E-03 ppm1 4.047 ppm2 1.890 CV 1
ASSI { 710}
(( segid "PX14" and resid 51 and name HA ))
(( segid "PX14" and resid 54 and name HB1 ))
2.700 2.700 3.300 peak 710 spectrum 2 weight 0.11000E+01 volume 0.44564E-02 ppm1 4.027 ppm2 1.781 CV 1
ASSI { 713}
(( segid "PX14" and resid 66 and name HA ))
(( segid "PX14" and resid 69 and name HB2 ))
3.200 3.200 2.800 peak 713 spectrum 2 weight 0.11000E+01 volume 0.99814E-03 ppm1 3.855 ppm2 1.895 CV 1
ASSI { 714}
(( segid "PX14" and resid 66 and name HA ))
( segid "PX14" and resid 33 and name HG1%)
2.600 2.600 3.400 peak 714 spectrum 2 weight 0.11000E+01 volume 0.40445E-02 ppm1 3.834 ppm2 1.129 CV 1
ASSI { 715}
(( segid "PX14" and resid 66 and name HA ))
( segid "PX14" and resid 29 and name HG2%)
2.500 2.500 3.500 peak 715 spectrum 2 weight 0.11000E+01 volume 0.55429E-02 ppm1 3.848 ppm2 0.732 CV 1
ASSI { 721}
(( segid "PX14" and resid 23 and name HA ))
(( segid "PX14" and resid 24 and name HD1 ))
2.700 0.900 0.900 peak 721 spectrum 2 weight 0.11000E+01 volume 0.21733E-02 ppm1 4.566 ppm2 3.923 CV 1
ASSI { 722}
(( segid "PX14" and resid 23 and name HA ))
(( segid "PX14" and resid 24 and name HD2 ))
3.500 1.600 1.600 peak 722 spectrum 2 weight 0.11000E+01 volume 0.78204E-03 ppm1 4.567 ppm2 3.602 CV 1
ASSI { 726}
(( segid "PX14" and resid 45 and name HD1 ))
(( segid "PX14" and resid 44 and name HA ))
3.000 3.000 3.000 peak 726 spectrum 2 weight 0.11000E+01 volume 0.13121E-02 ppm1 4.034 ppm2 4.828 CV 1
ASSI { 729}
(( segid "PX14" and resid 24 and name HD1 ))
( segid "PX14" and resid 23 and name HD1%)
6.000 6.000 0.000 peak 729 spectrum 2 weight 0.11000E+01 volume 0.20883E-05 ppm1 3.877 ppm2 0.896 CV 1
ASSI { 734}
(( segid "PX14" and resid 45 and name HD2 ))
(( segid "PX14" and resid 44 and name HA ))
3.000 3.000 3.000 peak 734 spectrum 2 weight 0.11000E+01 volume 0.21695E-02 ppm1 3.614 ppm2 4.823 CV 1
ASSI { 736}
(( segid "PX14" and resid 24 and name HD2 ))
(( segid "PX14" and resid 23 and name HB1 ))
4.500 4.500 1.500 peak 736 spectrum 2 weight 0.11000E+01 volume 0.21001E-03 ppm1 3.558 ppm2 1.509 CV 1
ASSI { 737}
(( segid "PX14" and resid 24 and name HD2 ))
( segid "PX14" and resid 23 and name HD1%)
4.600 4.600 1.400 peak 737 spectrum 2 weight 0.11000E+01 volume 0.16251E-03 ppm1 3.553 ppm2 0.897 CV 1
ASSI { 740}
(( segid "PX14" and resid 49 and name HD1 ))
( segid "PX14" and resid 41 and name HG2%)
3.000 3.000 3.000 peak 740 spectrum 2 weight 0.11000E+01 volume 0.10042E-02 ppm1 3.207 ppm2 -0.398 CV 1
ASSI { 741}
(( segid "PX14" and resid 42 and name HD1 ))
(( segid "PX14" and resid 37 and name HA ))
5.800 5.800 0.200 peak 741 spectrum 2 weight 0.11000E+01 volume 0.35804E-04 ppm1 3.009 ppm2 4.011 CV 1
ASSI { 742}
(( segid "PX14" and resid 42 and name HD1 ))
( segid "PX14" and resid 72 and name HG2%)
4.800 4.800 1.200 peak 742 spectrum 2 weight 0.11000E+01 volume 0.14875E-03 ppm1 3.012 ppm2 0.910 CV 1
ASSI { 744}
(( segid "PX14" and resid 40 and name HD2 ))
( segid "PX05" and resid 108 and name HD1%)
3.400 3.400 2.600 peak 744 spectrum 2 weight 0.11000E+01 volume 0.40774E-03 ppm1 3.113 ppm2 0.798 CV 1
ASSI { 745}
(( segid "PX14" and resid 25 and name HD1 ))
(( segid "PX14" and resid 25 and name HG1 ))
2.400 2.400 3.600 peak 745 spectrum 2 weight 0.11000E+01 volume 0.71904E-02 ppm1 3.247 ppm2 1.843 CV 1
ASSI { 746}
(( segid "PX14" and resid 50 and name HD1 ))
(( segid "PX14" and resid 47 and name HA ))
6.000 6.000 0.000 peak 746 spectrum 2 weight 0.11000E+01 volume 0.48391E-05 ppm1 3.106 ppm2 4.096 CV 1
ASSI { 748}
(( segid "PX14" and resid 50 and name HD1 ))
( segid "PX14" and resid 63 and name HD1%)
6.000 6.000 0.000 peak 748 spectrum 2 weight 0.11000E+01 volume 0.77412E-05 ppm1 3.101 ppm2 0.825 CV 1
ASSI { 749}
(( segid "PX14" and resid 50 and name HD1 ))
( segid "PX14" and resid 46 and name HD2%)
6.000 6.000 0.000 peak 749 spectrum 2 weight 0.11000E+01 volume 0.13077E-04 ppm1 3.104 ppm2 0.679 CV 1
ASSI { 750}
(( segid "PX14" and resid 58 and name HB1 ))
( segid "PX14" and resid 63 and name HG2%)
4.100 4.100 1.900 peak 750 spectrum 2 weight 0.11000E+01 volume 0.31969E-03 ppm1 1.867 ppm2 0.641 CV 1
ASSI { 752}
(( segid "PX14" and resid 58 and name HB2 ))
( segid "PX14" and resid 63 and name HG2%)
4.100 4.100 1.900 peak 752 spectrum 2 weight 0.11000E+01 volume 0.32476E-03 ppm1 1.103 ppm2 0.635 CV 1
ASSI { 755}
(( segid "PX14" and resid 53 and name HB1 ))
( segid "PX14" and resid 63 and name HG2%)
2.700 2.700 3.300 peak 755 spectrum 2 weight 0.11000E+01 volume 0.26574E-02 ppm1 1.999 ppm2 0.641 CV 1
ASSI { 756}
(( segid "PX14" and resid 36 and name HB1 ))
(( segid "PX14" and resid 33 and name HA ))
4.500 4.500 1.500 peak 756 spectrum 2 weight 0.11000E+01 volume 0.68737E-03 ppm1 1.784 ppm2 3.296 CV 1
ASSI { 758}
(( segid "PX14" and resid 23 and name HB1 ))
(( segid "PX14" and resid 23 and name HA ))
3.000 3.000 3.000 peak 758 spectrum 2 weight 0.11000E+01 volume 0.16639E-02 ppm1 1.523 ppm2 4.584 CV 1
ASSI { 760}
(( segid "PX14" and resid 56 and name HE1 ))
(( segid "PX14" and resid 56 and name HB1 ))
3.300 3.300 2.700 peak 760 spectrum 2 weight 0.11000E+01 volume 0.36729E-02 ppm1 1.398 ppm2 1.148 CV 1
ASSI { 761}
(( segid "PX14" and resid 53 and name HB2 ))
( segid "PX14" and resid 58 and name HD1%)
4.600 4.600 1.400 peak 761 spectrum 2 weight 0.11000E+01 volume 0.70991E-03 ppm1 1.205 ppm2 0.726 CV 1
ASSI { 762}
(( segid "PX14" and resid 53 and name HB2 ))
( segid "PX14" and resid 63 and name HG2%)
3.400 3.400 2.600 peak 762 spectrum 2 weight 0.11000E+01 volume 0.72528E-03 ppm1 1.197 ppm2 0.645 CV 1
ASSI { 764}
(( segid "PX14" and resid 56 and name HE1 ))
(( segid "PX14" and resid 56 and name HE2 ))
2.500 2.500 3.500 peak 764 spectrum 2 weight 0.11000E+01 volume 0.14877E-02 ppm1 1.423 ppm2 1.299 CV 1
ASSI { 765}
(( segid "PX14" and resid 36 and name HB2 ))
(( segid "PX14" and resid 33 and name HA ))
3.700 3.700 2.300 peak 765 spectrum 2 weight 0.11000E+01 volume 0.39975E-03 ppm1 1.228 ppm2 3.296 CV 1
ASSI { 767}
(( segid "PX14" and resid 52 and name HB1 ))
( segid "PX05" and resid 107 and name HE% )
3.500 3.500 2.500 peak 767 spectrum 2 weight 0.11000E+01 volume 0.11143E-02 ppm1 3.456 ppm2 7.266 CV 1
ASSI { 768}
(( segid "PX14" and resid 52 and name HB1 ))
( segid "PX05" and resid 107 and name HD% )
3.500 3.500 2.500 peak 768 spectrum 2 weight 0.11000E+01 volume 0.11615E-02 ppm1 3.472 ppm2 6.771 CV 1
ASSI { 769}
(( segid "PX14" and resid 52 and name HB2 ))
( segid "PX05" and resid 107 and name HD% )
3.400 3.400 2.600 peak 769 spectrum 2 weight 0.11000E+01 volume 0.51704E-03 ppm1 3.000 ppm2 6.766 CV 1
ASSI { 770}
(( segid "PX14" and resid 35 and name HB1 ))
(( segid "PX14" and resid 32 and name HA ))
2.800 2.800 3.200 peak 770 spectrum 2 weight 0.11000E+01 volume 0.13623E-02 ppm1 3.547 ppm2 4.212 CV 1
ASSI { 771}
(( segid "PX14" and resid 35 and name HB1 ))
( segid "PX14" and resid 35 and name HD% )
2.200 2.200 3.800 peak 771 spectrum 2 weight 0.11000E+01 volume 0.61537E-02 ppm1 3.541 ppm2 7.211 CV 1
ASSI { 778}
(( segid "PX14" and resid 67 and name HB1 ))
( segid "PX14" and resid 67 and name HD% )
5.000 5.000 1.000 peak 778 spectrum 2 weight 0.11000E+01 volume 0.10627E-03 ppm1 3.286 ppm2 7.292 CV 1
ASSI { 780}
(( segid "PX14" and resid 63 and name HB ))
(( segid "PX14" and resid 60 and name HA ))
2.800 2.800 3.200 peak 780 spectrum 2 weight 0.11000E+01 volume 0.37729E-02 ppm1 1.869 ppm2 4.183 CV 1
ASSI { 781}
(( segid "PX14" and resid 63 and name HB ))
( segid "PX14" and resid 63 and name HD1%)
2.600 2.600 3.400 peak 781 spectrum 2 weight 0.11000E+01 volume 0.43704E-02 ppm1 1.858 ppm2 0.772 CV 1
ASSI { 782}
(( segid "PX14" and resid 63 and name HB ))
( segid "PX14" and resid 63 and name HG2%)
2.800 2.800 3.200 peak 782 spectrum 2 weight 0.11000E+01 volume 0.24586E-02 ppm1 1.869 ppm2 0.627 CV 1
ASSI { 786}
(( segid "PX14" and resid 62 and name HG2 ))
( segid "PX14" and resid 29 and name HD1%)
6.000 6.000 0.000 peak 786 spectrum 2 weight 0.11000E+01 volume 0.97788E-05 ppm1 2.110 ppm2 0.893 CV 1
ASSI { 787}
(( segid "PX14" and resid 26 and name HG1 ))
(( segid "PX14" and resid 26 and name HB1 ))
2.300 2.300 3.700 peak 787 spectrum 2 weight 0.11000E+01 volume 0.11328E-01 ppm1 2.318 ppm2 2.097 CV 1
ASSI { 790}
(( segid "PX14" and resid 61 and name HG1 ))
(( segid "PX14" and resid 61 and name HA ))
2.500 2.500 3.500 peak 790 spectrum 2 weight 0.11000E+01 volume 0.55762E-02 ppm1 2.215 ppm2 4.072 CV 1
ASSI { 803}
(( segid "PX14" and resid 43 and name HG1 ))
(( segid "PX14" and resid 40 and name HA ))
4.100 4.100 1.900 peak 803 spectrum 2 weight 0.11000E+01 volume 0.38402E-03 ppm1 2.523 ppm2 4.194 CV 1
ASSI { 804}
(( segid "PX14" and resid 43 and name HG2 ))
(( segid "PX14" and resid 40 and name HA ))
6.000 6.000 0.000 peak 804 spectrum 2 weight 0.11000E+01 volume 0.00000E+00 ppm1 2.329 ppm2 4.190 CV 1
ASSI { 806}
(( segid "PX14" and resid 68 and name HG1 ))
(( segid "PX14" and resid 68 and name HB1 ))
2.300 0.600 0.600 peak 806 spectrum 2 weight 0.11000E+01 volume 0.14149E-01 ppm1 2.488 ppm2 2.269 CV 1
ASSI { 807}
(( segid "PX14" and resid 65 and name HB1 ))
( segid "PX14" and resid 29 and name HG2%)
3.600 3.600 2.400 peak 807 spectrum 2 weight 0.11000E+01 volume 0.50065E-03 ppm1 2.097 ppm2 0.764 CV 1
ASSI { 813}
(( segid "PX14" and resid 65 and name HB2 ))
(( segid "PX14" and resid 65 and name HB1 ))
2.000 2.000 4.000 peak 813 spectrum 2 weight 0.11000E+01 volume 0.73903E-02 ppm1 2.096 ppm2 2.520 CV 1
ASSI { 815}
(( segid "PX14" and resid 24 and name HB2 ))
(( segid "PX14" and resid 24 and name HD2 ))
6.000 6.000 0.000 peak 815 spectrum 2 weight 0.11000E+01 volume 0.42767E-04 ppm1 1.777 ppm2 3.598 CV 1
ASSI { 827}
(( segid "PX14" and resid 41 and name HB ))
(( segid "PX14" and resid 38 and name HB1 ))
2.200 2.200 3.800 peak 827 spectrum 2 weight 0.11000E+01 volume 0.72870E-02 ppm1 1.941 ppm2 2.721 CV 1
ASSI { 836}
(( segid "PX14" and resid 40 and name HB1 ))
(( segid "PX14" and resid 40 and name HG2 ))
2.100 2.100 3.900 peak 836 spectrum 2 weight 0.11000E+01 volume 0.10663E-01 ppm1 1.833 ppm2 1.608 CV 1
ASSI { 837}
(( segid "PX14" and resid 40 and name HB1 ))
( segid "PX05" and resid 108 and name HD1%)
3.200 3.200 2.800 peak 837 spectrum 2 weight 0.11000E+01 volume 0.22359E-02 ppm1 1.860 ppm2 0.819 CV 1
ASSI { 842}
(( segid "PX14" and resid 61 and name HB1 ))
(( segid "PX14" and resid 61 and name HA ))
2.200 2.200 3.800 peak 842 spectrum 2 weight 0.11000E+01 volume 0.13005E-01 ppm1 2.000 ppm2 4.077 CV 1
ASSI { 843}
(( segid "PX14" and resid 61 and name HB1 ))
(( segid "PX14" and resid 61 and name HG1 ))
2.500 2.500 3.500 peak 843 spectrum 2 weight 0.11000E+01 volume 0.94427E-02 ppm1 1.979 ppm2 2.244 CV 1
ASSI { 844}
(( segid "PX14" and resid 61 and name HB2 ))
(( segid "PX14" and resid 61 and name HA ))
2.500 2.500 3.500 peak 844 spectrum 2 weight 0.11000E+01 volume 0.62146E-02 ppm1 1.824 ppm2 4.078 CV 1
ASSI { 845}
(( segid "PX14" and resid 69 and name HB1 ))
( segid "PX14" and resid 33 and name HG1%)
3.000 3.000 3.000 peak 845 spectrum 2 weight 0.11000E+01 volume 0.18889E-02 ppm1 2.056 ppm2 1.128 CV 1
ASSI { 847}
(( segid "PX14" and resid 69 and name HB2 ))
( segid "PX14" and resid 33 and name HG1%)
3.000 3.000 3.000 peak 847 spectrum 2 weight 0.11000E+01 volume 0.15582E-02 ppm1 1.852 ppm2 1.128 CV 1
ASSI { 849}
(( segid "PX14" and resid 49 and name HG1 ))
( segid "PX05" and resid 107 and name HE% )
4.100 4.100 1.900 peak 849 spectrum 2 weight 0.11000E+01 volume 0.36846E-03 ppm1 1.665 ppm2 7.267 CV 1
ASSI { 852}
(( segid "PX14" and resid 34 and name HD1 ))
( segid "PX14" and resid 30 and name HB% )
2.300 2.300 3.700 peak 852 spectrum 2 weight 0.11000E+01 volume 0.46512E-02 ppm1 1.587 ppm2 1.338 CV 1
ASSI { 857}
(( segid "PX14" and resid 68 and name HB1 ))
(( segid "PX14" and resid 69 and name HG2 ))
2.300 2.300 3.700 peak 857 spectrum 2 weight 0.11000E+01 volume 0.10318E-01 ppm1 2.223 ppm2 2.407 CV 1
ASSI { 869}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 35 and name HD% )
3.200 3.200 2.800 peak 869 spectrum 2 weight 0.11000E+01 volume 0.94916E-03 ppm1 0.931 ppm2 7.049 CV 1
ASSI { 871}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX14" and resid 62 and name HB2 ))
2.500 2.500 3.500 peak 871 spectrum 2 weight 0.11000E+01 volume 0.14726E-01 ppm1 0.689 ppm2 1.629 CV 1
ASSI { 872}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 32 and name HB% )
2.500 2.500 3.500 peak 872 spectrum 2 weight 0.11000E+01 volume 0.44259E-02 ppm1 0.913 ppm2 1.623 CV 1
ASSI { 873}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 63 and name HD1%)
3.600 3.600 2.400 peak 873 spectrum 2 weight 0.11000E+01 volume 0.20626E-02 ppm1 0.919 ppm2 0.788 CV 1
ASSI { 874}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 63 and name HG2%)
3.200 3.200 2.800 peak 874 spectrum 2 weight 0.11000E+01 volume 0.28688E-02 ppm1 0.912 ppm2 0.656 CV 1
ASSI { 875}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 36 and name HD1%)
2.400 2.400 3.600 peak 875 spectrum 2 weight 0.11000E+01 volume 0.36325E-02 ppm1 0.916 ppm2 0.554 CV 1
ASSI { 876}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 36 and name HD2%)
3.000 3.000 3.000 peak 876 spectrum 2 weight 0.11000E+01 volume 0.88046E-03 ppm1 0.919 ppm2 0.176 CV 1
ASSI { 878}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX14" and resid 63 and name HA ))
2.900 2.900 3.100 peak 878 spectrum 2 weight 0.11000E+01 volume 0.29394E-02 ppm1 0.680 ppm2 3.290 CV 1
ASSI { 879}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX14" and resid 62 and name HB1 ))
3.500 3.500 2.500 peak 879 spectrum 2 weight 0.11000E+01 volume 0.12531E-02 ppm1 0.689 ppm2 2.483 CV 1
ASSI { 881}
(( segid "PX14" and resid 56 and name HD2 ))
(( segid "PX14" and resid 56 and name HD1 ))
2.300 2.300 3.700 peak 881 spectrum 2 weight 0.11000E+01 volume 0.28245E-02 ppm1 0.539 ppm2 0.824 CV 1
ASSI { 882}
( segid "PX14" and resid 58 and name HD2%)
(( segid "PX05" and resid 103 and name HH2 ))
2.200 2.200 3.800 peak 882 spectrum 2 weight 0.11000E+01 volume 0.13064E-01 ppm1 0.885 ppm2 6.861 CV 1
ASSI { 884}
( segid "PX14" and resid 36 and name HD2%)
( segid "PX14" and resid 67 and name HD% )
3.000 3.000 3.000 peak 884 spectrum 2 weight 0.11000E+01 volume 0.17430E-02 ppm1 0.148 ppm2 7.240 CV 1
ASSI { 885}
( segid "PX14" and resid 36 and name HD2%)
( segid "PX14" and resid 67 and name HE% )
3.400 3.400 2.600 peak 885 spectrum 2 weight 0.11000E+01 volume 0.65769E-03 ppm1 0.157 ppm2 7.049 CV 1
ASSI { 890}
( segid "PX14" and resid 46 and name HD1%)
(( segid "PX14" and resid 75 and name HB1 ))
3.800 3.800 2.200 peak 890 spectrum 2 weight 0.11000E+01 volume 0.22008E-03 ppm1 0.635 ppm2 2.603 CV 1
ASSI { 891}
(( segid "PX14" and resid 54 and name HG1 ))
( segid "PX14" and resid 63 and name HG2%)
2.800 2.800 3.200 peak 891 spectrum 2 weight 0.11000E+01 volume 0.35857E-02 ppm1 1.446 ppm2 0.641 CV 1
ASSI { 893}
( segid "PX14" and resid 33 and name HG1%)
(( segid "PX14" and resid 70 and name HA ))
6.000 6.000 0.000 peak 893 spectrum 2 weight 0.11000E+01 volume 0.89368E-05 ppm1 1.092 ppm2 4.298 CV 1
ASSI { 894}
( segid "PX14" and resid 33 and name HG1%)
(( segid "PX14" and resid 30 and name HA ))
3.400 3.400 2.600 peak 894 spectrum 2 weight 0.11000E+01 volume 0.10397E-02 ppm1 1.113 ppm2 3.965 CV 1
ASSI { 896}
( segid "PX14" and resid 33 and name HG1%)
( segid "PX14" and resid 66 and name HB% )
3.000 3.000 3.000 peak 896 spectrum 2 weight 0.11000E+01 volume 0.30297E-02 ppm1 1.101 ppm2 1.343 CV 1
ASSI { 897}
( segid "PX14" and resid 33 and name HG1%)
( segid "PX14" and resid 29 and name HG2%)
3.000 3.000 3.000 peak 897 spectrum 2 weight 0.11000E+01 volume 0.18039E-02 ppm1 1.097 ppm2 0.758 CV 1
ASSI { 902}
( segid "PX14" and resid 46 and name HD2%)
( segid "PX14" and resid 67 and name HD% )
3.300 3.300 2.700 peak 902 spectrum 2 weight 0.11000E+01 volume 0.56376E-03 ppm1 0.611 ppm2 7.251 CV 1
ASSI { 903}
( segid "PX14" and resid 46 and name HD2%)
( segid "PX14" and resid 67 and name HE% )
2.500 2.500 3.500 peak 903 spectrum 2 weight 0.11000E+01 volume 0.30137E-02 ppm1 0.611 ppm2 7.055 CV 1
ASSI { 904}
( segid "PX14" and resid 46 and name HD2%)
(( segid "PX14" and resid 67 and name HZ ))
2.800 2.800 3.200 peak 904 spectrum 2 weight 0.11000E+01 volume 0.12663E-02 ppm1 0.620 ppm2 6.917 CV 1
ASSI { 912}
( segid "PX14" and resid 46 and name HD2%)
(( segid "PX14" and resid 72 and name HB ))
2.800 2.800 3.200 peak 912 spectrum 2 weight 0.11000E+01 volume 0.13494E-02 ppm1 0.606 ppm2 4.181 CV 1
ASSI { 915}
( segid "PX14" and resid 28 and name HD1%)
(( segid "PX05" and resid 103 and name HZ2 ))
2.300 2.300 3.700 peak 915 spectrum 2 weight 0.11000E+01 volume 0.48241E-02 ppm1 0.988 ppm2 7.340 CV 1
ASSI { 916}
( segid "PX14" and resid 28 and name HD1%)
(( segid "PX05" and resid 103 and name HH2 ))
2.100 2.100 3.900 peak 916 spectrum 2 weight 0.11000E+01 volume 0.71112E-02 ppm1 0.992 ppm2 6.858 CV 1
ASSI { 917}
( segid "PX14" and resid 53 and name HD1%)
( segid "PX14" and resid 35 and name HD% )
2.700 2.700 3.300 peak 917 spectrum 2 weight 0.11000E+01 volume 0.33316E-02 ppm1 0.717 ppm2 7.214 CV 1
ASSI { 918}
( segid "PX14" and resid 53 and name HD1%)
(( segid "PX05" and resid 103 and name HE3 ))
4.100 4.100 1.900 peak 918 spectrum 2 weight 0.11000E+01 volume 0.63997E-03 ppm1 0.713 ppm2 6.865 CV 1
ASSI { 922}
( segid "PX14" and resid 48 and name HG2%)
( segid "PX05" and resid 107 and name HE% )
2.400 2.400 3.600 peak 922 spectrum 2 weight 0.11000E+01 volume 0.13355E-01 ppm1 1.377 ppm2 7.259 CV 1
ASSI { 924}
( segid "PX14" and resid 41 and name HG1%)
( segid "PX05" and resid 107 and name HE% )
2.500 2.500 3.500 peak 924 spectrum 2 weight 0.11000E+01 volume 0.56078E-02 ppm1 0.478 ppm2 7.232 CV 1
ASSI { 925}
( segid "PX14" and resid 36 and name HD1%)
(( segid "PX14" and resid 67 and name HZ ))
5.600 5.600 0.400 peak 925 spectrum 2 weight 0.11000E+01 volume 0.70864E-04 ppm1 0.528 ppm2 6.934 CV 1
OR { 925}
( segid "PX14" and resid 36 and name HD1%)
(( segid "PX14" and resid 67 and name HZ ))
ASSI { 926}
( segid "PX14" and resid 41 and name HG1%)
( segid "PX14" and resid 35 and name HE% )
2.600 2.600 3.400 peak 926 spectrum 2 weight 0.11000E+01 volume 0.45119E-02 ppm1 0.471 ppm2 6.605 CV 1
ASSI { 933}
( segid "PX14" and resid 41 and name HG2%)
(( segid "PX14" and resid 49 and name HG1 ))
3.900 3.900 2.100 peak 933 spectrum 2 weight 0.11000E+01 volume 0.88831E-03 ppm1 -0.432 ppm2 1.175 CV 1
ASSI { 935}
( segid "PX14" and resid 32 and name HB% )
(( segid "PX05" and resid 103 and name HZ3 ))
2.700 2.700 3.300 peak 935 spectrum 2 weight 0.11000E+01 volume 0.41396E-02 ppm1 1.572 ppm2 6.359 CV 1
ASSI { 937}
( segid "PX14" and resid 32 and name HB% )
( segid "PX14" and resid 58 and name HD1%)
2.300 2.300 3.700 peak 937 spectrum 2 weight 0.11000E+01 volume 0.90616E-02 ppm1 1.572 ppm2 0.718 CV 1
ASSI { 939}
( segid "PX14" and resid 32 and name HB% )
( segid "PX14" and resid 66 and name HB% )
2.200 2.200 3.800 peak 939 spectrum 2 weight 0.11000E+01 volume 0.99298E-02 ppm1 1.569 ppm2 1.317 CV 1
ASSI { 942}
( segid "PX14" and resid 73 and name HB% )
(( segid "PX14" and resid 67 and name HB2 ))
3.000 3.000 3.000 peak 942 spectrum 2 weight 0.11000E+01 volume 0.99331E-03 ppm1 1.294 ppm2 3.032 CV 1
ASSI { 945}
( segid "PX14" and resid 66 and name HB% )
( segid "PX14" and resid 67 and name HD% )
3.600 3.600 2.400 peak 945 spectrum 2 weight 0.11000E+01 volume 0.96480E-03 ppm1 1.291 ppm2 7.255 CV 1
ASSI { 948}
( segid "PX14" and resid 66 and name HB% )
( segid "PX14" and resid 63 and name HG2%)
3.300 3.300 2.700 peak 948 spectrum 2 weight 0.11000E+01 volume 0.16049E-02 ppm1 1.303 ppm2 0.663 CV 1
ASSI { 949}
( segid "PX14" and resid 66 and name HB% )
( segid "PX14" and resid 36 and name HD1%)
4.500 4.500 1.500 peak 949 spectrum 2 weight 0.11000E+01 volume 0.15276E-03 ppm1 1.291 ppm2 0.543 CV 1
ASSI { 950}
( segid "PX14" and resid 66 and name HB% )
( segid "PX14" and resid 36 and name HD2%)
2.700 2.700 3.300 peak 950 spectrum 2 weight 0.11000E+01 volume 0.41005E-02 ppm1 1.306 ppm2 0.196 CV 1
ASSI { 952}
( segid "PX14" and resid 30 and name HB% )
(( segid "PX14" and resid 27 and name HA ))
2.700 2.700 3.300 peak 952 spectrum 2 weight 0.11000E+01 volume 0.35510E-02 ppm1 1.330 ppm2 4.307 CV 1
ASSI { 954}
( segid "PX14" and resid 63 and name HD1%)
( segid "PX14" and resid 67 and name HD% )
3.100 3.100 2.900 peak 954 spectrum 2 weight 0.11000E+01 volume 0.31672E-02 ppm1 0.794 ppm2 7.279 CV 1
ASSI { 955}
( segid "PX14" and resid 63 and name HD1%)
( segid "PX14" and resid 67 and name HE% )
2.700 2.700 3.300 peak 955 spectrum 2 weight 0.11000E+01 volume 0.44704E-02 ppm1 0.794 ppm2 7.059 CV 1
ASSI { 956}
( segid "PX14" and resid 63 and name HD1%)
(( segid "PX14" and resid 63 and name HA ))
3.200 3.200 2.800 peak 956 spectrum 2 weight 0.11000E+01 volume 0.58633E-02 ppm1 0.779 ppm2 3.278 CV 1
ASSI { 960}
( segid "PX14" and resid 65 and name HE% )
( segid "PX14" and resid 29 and name HG2%)
3.200 3.200 2.800 peak 960 spectrum 2 weight 0.11000E+01 volume 0.62052E-03 ppm1 1.981 ppm2 0.751 CV 1
ASSI { 963}
( segid "PX14" and resid 29 and name HG2%)
(( segid "PX14" and resid 30 and name HA ))
4.100 4.100 1.900 peak 963 spectrum 2 weight 0.11000E+01 volume 0.31204E-03 ppm1 0.727 ppm2 3.964 CV 1
ASSI { 965}
( segid "PX14" and resid 29 and name HG2%)
(( segid "PX14" and resid 65 and name HB2 ))
3.300 3.300 2.700 peak 965 spectrum 2 weight 0.11000E+01 volume 0.23872E-02 ppm1 0.727 ppm2 2.122 CV 1
ASSI { 967}
( segid "PX14" and resid 29 and name HG2%)
( segid "PX14" and resid 66 and name HB% )
2.500 2.500 3.500 peak 967 spectrum 2 weight 0.11000E+01 volume 0.57062E-02 ppm1 0.717 ppm2 1.315 CV 1
ASSI { 972}
( segid "PX14" and resid 29 and name HD1%)
(( segid "PX14" and resid 62 and name HG1 ))
4.500 4.500 1.500 peak 972 spectrum 2 weight 0.11000E+01 volume 0.55235E-03 ppm1 0.852 ppm2 2.433 CV 1
ASSI { 974}
( segid "PX14" and resid 29 and name HD1%)
( segid "PX14" and resid 65 and name HE% )
3.400 3.400 2.600 peak 974 spectrum 2 weight 0.11000E+01 volume 0.10946E-02 ppm1 0.858 ppm2 2.049 CV 1
ASSI { 975}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 60 and name HA ))
4.700 4.700 1.300 peak 975 spectrum 2 weight 0.11000E+01 volume 0.33579E-03 ppm1 0.623 ppm2 4.289 CV 1
ASSI { 976}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 50 and name HA ))
3.700 3.700 2.300 peak 976 spectrum 2 weight 0.11000E+01 volume 0.48709E-03 ppm1 0.623 ppm2 3.894 CV 1
ASSI { 977}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 63 and name HA ))
3.000 3.000 3.000 peak 977 spectrum 2 weight 0.11000E+01 volume 0.15812E-02 ppm1 0.620 ppm2 3.280 CV 1
ASSI { 981}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 50 and name HG1 ))
3.900 3.900 2.100 peak 981 spectrum 2 weight 0.11000E+01 volume 0.66851E-03 ppm1 0.623 ppm2 1.486 CV 1
ASSI { 982}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 53 and name HG ))
3.700 3.700 2.300 peak 982 spectrum 2 weight 0.11000E+01 volume 0.91018E-03 ppm1 0.623 ppm2 1.227 CV 1
ASSI { 987}
(( segid "PX14" and resid 24 and name HD1 ))
(( segid "PX14" and resid 23 and name HB1 ))
5.700 5.700 0.300 peak 987 spectrum 2 weight 0.11000E+01 volume 0.11879E-03 ppm1 3.884 ppm2 1.503 CV 1
ASSI { 988}
(( segid "PX14" and resid 24 and name HD1 ))
(( segid "PX14" and resid 23 and name HB2 ))
6.000 6.000 0.000 peak 988 spectrum 2 weight 0.11000E+01 volume 0.29251E-04 ppm1 3.886 ppm2 1.553 CV 1
ASSI { 989}
(( segid "PX14" and resid 24 and name HD2 ))
(( segid "PX14" and resid 23 and name HB2 ))
4.300 4.300 1.700 peak 989 spectrum 2 weight 0.11000E+01 volume 0.57727E-03 ppm1 3.553 ppm2 1.567 CV 1
ASSI { 991}
(( segid "PX14" and resid 63 and name HB ))
(( segid "PX14" and resid 63 and name HA ))
4.000 4.000 2.000 peak 991 spectrum 2 weight 0.11000E+01 volume 0.28429E-03 ppm1 1.858 ppm2 3.264 CV 1
ASSI { 996}
( segid "PX14" and resid 63 and name HD1%)
( segid "PX14" and resid 63 and name HG2%)
2.300 2.300 3.700 peak 996 spectrum 2 weight 0.11000E+01 volume 0.90173E-02 ppm1 0.781 ppm2 0.637 CV 1
ASSI { 997}
( segid "PX14" and resid 41 and name HG2%)
(( segid "PX14" and resid 49 and name HD2 ))
3.600 3.600 2.400 peak 997 spectrum 2 weight 0.11000E+01 volume 0.12096E-02 ppm1 -0.400 ppm2 2.690 CV 1
ASSI { 999}
( segid "PX14" and resid 41 and name HG2%)
(( segid "PX14" and resid 36 and name HA ))
3.100 3.100 2.900 peak 999 spectrum 2 weight 0.11000E+01 volume 0.30994E-02 ppm1 -0.402 ppm2 3.398 CV 1
ASSI { 1001}
(( segid "PX14" and resid 37 and name HG1 ))
( segid "PX14" and resid 33 and name HG2%)
3.400 3.400 2.600 peak 1001 spectrum 2 weight 0.11000E+01 volume 0.96319E-03 ppm1 2.698 ppm2 0.643 CV 1
ASSI { 1002}
(( segid "PX14" and resid 37 and name HG2 ))
( segid "PX14" and resid 33 and name HG2%)
4.200 4.200 1.800 peak 1002 spectrum 2 weight 0.11000E+01 volume 0.46137E-03 ppm1 2.199 ppm2 0.653 CV 1
ASSI { 1003}
( segid "PX14" and resid 33 and name HG2%)
(( segid "PX14" and resid 69 and name HB2 ))
4.400 4.400 1.600 peak 1003 spectrum 2 weight 0.11000E+01 volume 0.31598E-03 ppm1 0.625 ppm2 1.885 CV 1
ASSI { 1006}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX14" and resid 62 and name HG2 ))
4.800 4.800 1.200 peak 1006 spectrum 2 weight 0.11000E+01 volume 0.33866E-03 ppm1 0.687 ppm2 2.000 CV 1
ASSI { 1012}
(( segid "PX14" and resid 50 and name HA ))
( segid "PX14" and resid 63 and name HD1%)
3.100 3.100 2.900 peak 1012 spectrum 2 weight 0.11000E+01 volume 0.15669E-02 ppm1 3.872 ppm2 0.800 CV 1
ASSI { 1014}
(( segid "PX14" and resid 70 and name HB1 ))
( segid "PX14" and resid 36 and name HD2%)
3.100 3.100 2.900 peak 1014 spectrum 2 weight 0.11000E+01 volume 0.80800E-03 ppm1 4.069 ppm2 0.177 CV 1
ASSI { 1015}
(( segid "PX14" and resid 70 and name HB2 ))
( segid "PX14" and resid 36 and name HD2%)
3.400 3.400 2.600 peak 1015 spectrum 2 weight 0.11000E+01 volume 0.47304E-03 ppm1 3.830 ppm2 0.181 CV 1
ASSI { 1017}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 54 and name HE1 ))
3.500 3.500 2.500 peak 1017 spectrum 2 weight 0.11000E+01 volume 0.35764E-03 ppm1 0.615 ppm2 2.863 CV 1
ASSI { 1026}
(( segid "PX14" and resid 81 and name HB2 ))
(( segid "PX14" and resid 81 and name HA ))
6.000 6.000 0.000 peak 1026 spectrum 2 weight 0.11000E+01 volume 0.25485E-04 ppm1 3.051 ppm2 4.489 CV 1
ASSI { 1029}
(( segid "PX14" and resid 81 and name HB2 ))
(( segid "PX14" and resid 81 and name HB1 ))
2.400 2.400 3.600 peak 1029 spectrum 2 weight 0.11000E+01 volume 0.34274E-02 ppm1 3.081 ppm2 3.295 CV 1
ASSI { 1033}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 67 and name HD% )
2.800 2.800 3.200 peak 1033 spectrum 2 weight 0.11000E+01 volume 0.15205E-02 ppm1 0.910 ppm2 7.220 CV 1
ASSI { 1034}
(( segid "PX14" and resid 67 and name HA ))
( segid "PX14" and resid 67 and name HD% )
2.500 2.500 3.500 peak 1034 spectrum 2 weight 0.11000E+01 volume 0.41161E-02 ppm1 3.921 ppm2 7.243 CV 1
ASSI { 1035}
(( segid "PX14" and resid 32 and name HA ))
( segid "PX14" and resid 35 and name HD% )
4.100 4.100 1.900 peak 1035 spectrum 2 weight 0.11000E+01 volume 0.39070E-03 ppm1 4.179 ppm2 7.191 CV 1
ASSI { 1038}
(( segid "PX14" and resid 49 and name HD2 ))
( segid "PX14" and resid 67 and name HD% )
4.800 4.800 1.200 peak 1038 spectrum 2 weight 0.11000E+01 volume 0.15048E-03 ppm1 2.623 ppm2 7.276 CV 1
ASSI { 1039}
(( segid "PX14" and resid 49 and name HD1 ))
( segid "PX14" and resid 67 and name HD% )
3.900 3.900 2.100 peak 1039 spectrum 2 weight 0.11000E+01 volume 0.77117E-03 ppm1 3.221 ppm2 7.274 CV 1
ASSI { 1040}
(( segid "PX14" and resid 50 and name HD1 ))
(( segid "PX14" and resid 67 and name HZ ))
5.800 5.800 0.200 peak 1040 spectrum 2 weight 0.11000E+01 volume 0.12253E-03 ppm1 3.103 ppm2 6.935 CV 1
ASSI { 1041}
(( segid "PX14" and resid 50 and name HD1 ))
( segid "PX14" and resid 67 and name HE% )
5.500 5.500 0.500 peak 1041 spectrum 2 weight 0.11000E+01 volume 0.13549E-03 ppm1 3.105 ppm2 7.081 CV 1
ASSI { 1042}
(( segid "PX14" and resid 72 and name HB ))
( segid "PX14" and resid 67 and name HD% )
3.700 3.700 2.300 peak 1042 spectrum 2 weight 0.11000E+01 volume 0.85121E-03 ppm1 4.165 ppm2 7.253 CV 1
ASSI { 1043}
( segid "PX14" and resid 32 and name HB% )
( segid "PX14" and resid 67 and name HE% )
4.400 4.400 1.600 peak 1043 spectrum 2 weight 0.11000E+01 volume 0.33392E-03 ppm1 1.579 ppm2 7.062 CV 1
ASSI { 1044}
( segid "PX14" and resid 63 and name HG2%)
( segid "PX14" and resid 67 and name HE% )
4.000 4.000 2.000 peak 1044 spectrum 2 weight 0.11000E+01 volume 0.28712E-03 ppm1 0.625 ppm2 7.057 CV 1
ASSI { 1045}
( segid "PX14" and resid 63 and name HG2%)
( segid "PX14" and resid 67 and name HD% )
4.600 4.600 1.400 peak 1045 spectrum 2 weight 0.11000E+01 volume 0.19375E-03 ppm1 0.627 ppm2 7.267 CV 1
ASSI { 1053}
(( segid "PX14" and resid 62 and name HG2 ))
(( segid "PX14" and resid 24 and name HA ))
5.000 5.000 1.000 peak 1053 spectrum 2 weight 0.11000E+01 volume 0.84846E-04 ppm1 2.111 ppm2 4.462 CV 1
ASSI { 1055}
(( segid "PX14" and resid 49 and name HB1 ))
(( segid "PX14" and resid 67 and name HZ ))
3.100 3.100 2.900 peak 1055 spectrum 2 weight 0.11000E+01 volume 0.10939E-02 ppm1 2.385 ppm2 6.923 CV 1
ASSI { 1056}
(( segid "PX14" and resid 49 and name HB2 ))
(( segid "PX14" and resid 67 and name HZ ))
3.700 3.700 2.300 peak 1056 spectrum 2 weight 0.11000E+01 volume 0.50822E-03 ppm1 1.591 ppm2 6.930 CV 1
ASSI { 1058}
(( segid "PX14" and resid 49 and name HB1 ))
( segid "PX14" and resid 67 and name HD% )
5.300 5.300 0.700 peak 1058 spectrum 2 weight 0.11000E+01 volume 0.15747E-03 ppm1 2.411 ppm2 7.266 CV 1
ASSI { 1059}
(( segid "PX14" and resid 49 and name HB1 ))
( segid "PX14" and resid 67 and name HE% )
4.600 4.600 1.400 peak 1059 spectrum 2 weight 0.11000E+01 volume 0.89838E-04 ppm1 2.398 ppm2 7.065 CV 1
ASSI { 1060}
(( segid "PX14" and resid 49 and name HB2 ))
( segid "PX14" and resid 67 and name HE% )
5.300 5.300 0.700 peak 1060 spectrum 2 weight 0.11000E+01 volume 0.73158E-04 ppm1 1.600 ppm2 7.065 CV 1
ASSI { 1061}
(( segid "PX14" and resid 49 and name HD1 ))
(( segid "PX14" and resid 67 and name HZ ))
6.000 6.000 0.000 peak 1061 spectrum 2 weight 0.11000E+01 volume 0.16563E-06 ppm1 3.224 ppm2 6.957 CV 1
ASSI { 1063}
(( segid "PX14" and resid 36 and name HB1 ))
( segid "PX14" and resid 67 and name HE% )
5.400 5.400 0.600 peak 1063 spectrum 2 weight 0.11000E+01 volume 0.12674E-03 ppm1 1.755 ppm2 7.105 CV 1
ASSI { 1064}
(( segid "PX14" and resid 36 and name HB2 ))
( segid "PX14" and resid 67 and name HE% )
5.600 5.600 0.400 peak 1064 spectrum 2 weight 0.11000E+01 volume 0.18666E-03 ppm1 1.192 ppm2 7.076 CV 1
ASSI { 1066}
(( segid "PX14" and resid 50 and name HB1 ))
(( segid "PX14" and resid 67 and name HZ ))
4.000 4.000 2.000 peak 1066 spectrum 2 weight 0.11000E+01 volume 0.10546E-02 ppm1 1.878 ppm2 6.942 CV 1
ASSI { 1070}
( segid "PX14" and resid 58 and name HD2%)
(( segid "PX05" and resid 103 and name HZ3 ))
3.200 3.200 2.800 peak 1070 spectrum 2 weight 0.11000E+01 volume 0.19779E-02 ppm1 0.886 ppm2 6.353 CV 1
ASSI { 1071}
( segid "PX14" and resid 58 and name HD2%)
(( segid "PX05" and resid 103 and name HZ2 ))
3.300 3.300 2.700 peak 1071 spectrum 2 weight 0.11000E+01 volume 0.19562E-02 ppm1 0.890 ppm2 7.335 CV 1
ASSI { 1072}
( segid "PX14" and resid 32 and name HB% )
(( segid "PX05" and resid 103 and name HH2 ))
4.000 4.000 2.000 peak 1072 spectrum 2 weight 0.11000E+01 volume 0.39033E-03 ppm1 1.569 ppm2 6.869 CV 1
ASSI { 1073}
( segid "PX14" and resid 32 and name HB% )
(( segid "PX05" and resid 103 and name HE3 ))
4.600 4.600 1.400 peak 1073 spectrum 2 weight 0.11000E+01 volume 0.55878E-03 ppm1 1.572 ppm2 6.632 CV 1
ASSI { 1074}
( segid "PX14" and resid 41 and name HG2%)
( segid "PX14" and resid 35 and name HE% )
3.700 3.700 2.300 peak 1074 spectrum 2 weight 0.11000E+01 volume 0.72581E-03 ppm1 -0.423 ppm2 6.609 CV 1
ASSI { 1075}
( segid "PX14" and resid 41 and name HG2%)
( segid "PX05" and resid 107 and name HD% )
3.500 3.500 2.500 peak 1075 spectrum 2 weight 0.11000E+01 volume 0.61236E-03 ppm1 -0.405 ppm2 6.769 CV 1
ASSI { 1076}
( segid "PX14" and resid 41 and name HG2%)
( segid "PX14" and resid 35 and name HD% )
4.500 4.500 1.500 peak 1076 spectrum 2 weight 0.11000E+01 volume 0.20616E-03 ppm1 -0.423 ppm2 7.185 CV 1
ASSI { 1077}
( segid "PX14" and resid 41 and name HG2%)
( segid "PX05" and resid 107 and name HE% )
2.700 2.700 3.300 peak 1077 spectrum 2 weight 0.11000E+01 volume 0.31130E-02 ppm1 -0.429 ppm2 7.271 CV 1
ASSI { 1078}
(( segid "PX14" and resid 52 and name HB2 ))
( segid "PX05" and resid 107 and name HE% )
2.900 2.900 3.100 peak 1078 spectrum 2 weight 0.11000E+01 volume 0.18166E-02 ppm1 2.977 ppm2 7.247 CV 1
ASSI { 1079}
(( segid "PX14" and resid 40 and name HD1 ))
(( segid "PX14" and resid 40 and name HB1 ))
2.300 2.300 3.700 peak 1079 spectrum 2 weight 0.11000E+01 volume 0.96218E-02 ppm1 3.200 ppm2 1.869 CV 1
ASSI { 1087}
(( segid "PX14" and resid 64 and name HB1 ))
(( segid "PX14" and resid 61 and name HA ))
2.900 2.900 3.100 peak 1087 spectrum 2 weight 0.11000E+01 volume 0.21307E-02 ppm1 2.811 ppm2 4.052 CV 1
ASSI { 1095}
(( segid "PX14" and resid 68 and name HA ))
(( segid "PX14" and resid 69 and name HB1 ))
2.900 2.900 3.100 peak 1095 spectrum 2 weight 0.11000E+01 volume 0.81853E-02 ppm1 4.038 ppm2 2.086 CV 1
ASSI { 1096}
(( segid "PX14" and resid 49 and name HB2 ))
( segid "PX14" and resid 36 and name HD1%)
5.600 5.600 0.400 peak 1096 spectrum 2 weight 0.11000E+01 volume 0.11291E-03 ppm1 1.608 ppm2 0.560 CV 1
ASSI { 1098}
(( segid "PX14" and resid 80 and name HA ))
( segid "PX14" and resid 80 and name HD2%)
4.800 4.800 1.200 peak 1098 spectrum 2 weight 0.11000E+01 volume 0.16112E-03 ppm1 4.166 ppm2 0.730 CV 1
ASSI { 1099}
(( segid "PX14" and resid 38 and name HA ))
(( segid "PX14" and resid 38 and name HB1 ))
2.600 2.600 3.400 peak 1099 spectrum 2 weight 0.11000E+01 volume 0.46946E-02 ppm1 4.301 ppm2 2.733 CV 1
ASSI { 1103}
(( segid "PX14" and resid 37 and name HG1 ))
(( segid "PX14" and resid 70 and name HB2 ))
3.700 3.700 2.300 peak 1103 spectrum 2 weight 0.11000E+01 volume 0.69347E-03 ppm1 2.708 ppm2 3.846 CV 1
ASSI { 1104}
(( segid "PX14" and resid 37 and name HG2 ))
(( segid "PX14" and resid 70 and name HB2 ))
3.700 3.700 2.300 peak 1104 spectrum 2 weight 0.11000E+01 volume 0.68153E-03 ppm1 2.192 ppm2 3.836 CV 1
ASSI { 1110}
( segid "PX14" and resid 33 and name HG1%)
(( segid "PX14" and resid 69 and name HG2 ))
4.900 4.900 1.100 peak 1110 spectrum 2 weight 0.11000E+01 volume 0.24901E-03 ppm1 1.109 ppm2 2.330 CV 1
ASSI { 1113}
(( segid "PX14" and resid 33 and name HA ))
(( segid "PX14" and resid 70 and name HB2 ))
3.200 3.200 2.800 peak 1113 spectrum 2 weight 0.11000E+01 volume 0.16490E-02 ppm1 3.271 ppm2 3.850 CV 1
ASSI { 1114}
( segid "PX14" and resid 53 and name HD2%)
(( segid "PX14" and resid 63 and name HA ))
3.400 3.400 2.600 peak 1114 spectrum 2 weight 0.11000E+01 volume 0.15107E-02 ppm1 0.919 ppm2 3.290 CV 1
ASSI { 1117}
(( segid "PX14" and resid 70 and name HB1 ))
(( segid "PX14" and resid 37 and name HG1 ))
4.100 4.100 1.900 peak 1117 spectrum 2 weight 0.11000E+01 volume 0.27897E-03 ppm1 4.069 ppm2 2.714 CV 1
ASSI { 1118}
(( segid "PX14" and resid 70 and name HB2 ))
( segid "PX14" and resid 33 and name HG1%)
3.500 3.500 2.500 peak 1118 spectrum 2 weight 0.11000E+01 volume 0.36712E-03 ppm1 3.803 ppm2 1.129 CV 1
ASSI { 1121}
(( segid "PX14" and resid 44 and name HB2 ))
(( segid "PX14" and resid 44 and name HA ))
2.500 2.500 3.500 peak 1121 spectrum 2 weight 0.11000E+01 volume 0.66474E-02 ppm1 4.032 ppm2 4.805 CV 1
ASSI { 1125}
( segid "PX14" and resid 53 and name HD2%)
(( segid "PX14" and resid 58 and name HB1 ))
4.200 4.200 1.800 peak 1125 spectrum 2 weight 0.11000E+01 volume 0.59432E-03 ppm1 0.914 ppm2 1.898 CV 1
ASSI { 1126}
(( segid "PX14" and resid 49 and name HA ))
( segid "PX05" and resid 107 and name HE% )
2.600 2.600 3.400 peak 1126 spectrum 2 weight 0.11000E+01 volume 0.33124E-02 ppm1 3.928 ppm2 7.271 CV 1
ASSI { 1127}
(( segid "PX14" and resid 35 and name HA ))
(( segid "PX14" and resid 38 and name HB1 ))
4.500 4.500 1.500 peak 1127 spectrum 2 weight 0.11000E+01 volume 0.29436E-03 ppm1 4.223 ppm2 2.718 CV 1
ASSI { 1130}
(( segid "PX14" and resid 53 and name HB1 ))
(( segid "PX14" and resid 50 and name HA ))
4.500 4.500 1.500 peak 1130 spectrum 2 weight 0.11000E+01 volume 0.63531E-03 ppm1 1.970 ppm2 3.884 CV 1
ASSI { 1132}
(( segid "PX14" and resid 34 and name HB1 ))
( segid "PX14" and resid 33 and name HG2%)
3.600 3.600 2.400 peak 1132 spectrum 2 weight 0.11000E+01 volume 0.21871E-02 ppm1 1.859 ppm2 0.639 CV 1
ASSI { 1135}
(( segid "PX14" and resid 72 and name HB ))
(( segid "PX14" and resid 67 and name HB2 ))
4.800 4.800 1.200 peak 1135 spectrum 2 weight 0.11000E+01 volume 0.54337E-03 ppm1 4.165 ppm2 3.009 CV 1
ASSI { 1140}
(( segid "PX14" and resid 70 and name HB1 ))
(( segid "PX14" and resid 36 and name HB1 ))
5.300 5.300 0.700 peak 1140 spectrum 2 weight 0.11000E+01 volume 0.90992E-04 ppm1 4.069 ppm2 1.796 CV 1
ASSI { 1141}
(( segid "PX14" and resid 70 and name HB2 ))
(( segid "PX14" and resid 36 and name HB1 ))
5.500 5.500 0.500 peak 1141 spectrum 2 weight 0.11000E+01 volume 0.70025E-04 ppm1 3.802 ppm2 1.795 CV 1
ASSI { 1144}
(( segid "PX14" and resid 36 and name HB2 ))
(( segid "PX14" and resid 70 and name HB2 ))
4.000 4.000 2.000 peak 1144 spectrum 2 weight 0.11000E+01 volume 0.30024E-03 ppm1 1.202 ppm2 3.837 CV 1
ASSI { 1145}
(( segid "PX14" and resid 67 and name HA ))
(( segid "PX14" and resid 70 and name HB2 ))
2.100 2.100 3.900 peak 1145 spectrum 2 weight 0.11000E+01 volume 0.13174E-01 ppm1 3.921 ppm2 3.808 CV 1
ASSI { 1148}
(( segid "PX14" and resid 24 and name HG1 ))
( segid "PX14" and resid 23 and name HD1%)
4.500 4.500 1.500 peak 1148 spectrum 2 weight 0.11000E+01 volume 0.67918E-03 ppm1 1.994 ppm2 0.894 CV 1
ASSI { 1149}
(( segid "PX14" and resid 38 and name HB1 ))
( segid "PX05" and resid 104 and name HB% )
3.700 3.700 2.300 peak 1149 spectrum 2 weight 0.11000E+01 volume 0.84980E-03 ppm1 2.713 ppm2 1.570 CV 1
ASSI { 1150}
(( segid "PX14" and resid 38 and name HB1 ))
( segid "PX14" and resid 41 and name HG1%)
3.200 3.200 2.800 peak 1150 spectrum 2 weight 0.11000E+01 volume 0.28525E-02 ppm1 2.705 ppm2 0.485 CV 1
ASSI { 1151}
(( segid "PX14" and resid 61 and name HB2 ))
(( segid "PX14" and resid 61 and name HG1 ))
2.500 2.500 3.500 peak 1151 spectrum 2 weight 0.11000E+01 volume 0.54173E-02 ppm1 1.840 ppm2 2.233 CV 1
ASSI { 1155}
(( segid "PX14" and resid 61 and name HA ))
(( segid "PX14" and resid 65 and name HB1 ))
3.500 3.500 2.500 peak 1155 spectrum 2 weight 0.11000E+01 volume 0.16080E-02 ppm1 4.027 ppm2 2.485 CV 1
ASSI { 1158}
(( segid "PX14" and resid 50 and name HA ))
( segid "PX14" and resid 67 and name HE% )
3.400 3.400 2.600 peak 1158 spectrum 2 weight 0.11000E+01 volume 0.93360E-03 ppm1 3.859 ppm2 7.046 CV 1
ASSI { 1159}
(( segid "PX14" and resid 50 and name HA ))
(( segid "PX14" and resid 67 and name HZ ))
3.100 3.100 2.900 peak 1159 spectrum 2 weight 0.11000E+01 volume 0.12680E-02 ppm1 3.865 ppm2 6.927 CV 1
ASSI { 1160}
(( segid "PX14" and resid 49 and name HG2 ))
( segid "PX05" and resid 107 and name HD% )
3.900 3.900 2.100 peak 1160 spectrum 2 weight 0.11000E+01 volume 0.58635E-03 ppm1 1.164 ppm2 7.268 CV 1
ASSI { 1162}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX05" and resid 103 and name HZ3 ))
3.900 3.900 2.100 peak 1162 spectrum 2 weight 0.11000E+01 volume 0.44242E-03 ppm1 0.701 ppm2 6.357 CV 1
ASSI { 1163}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX05" and resid 103 and name HH2 ))
4.100 4.100 1.900 peak 1163 spectrum 2 weight 0.11000E+01 volume 0.27045E-03 ppm1 0.689 ppm2 6.866 CV 1
ASSI { 1164}
(( segid "PX14" and resid 40 and name HD1 ))
( segid "PX05" and resid 108 and name HD2%)
2.900 2.900 3.100 peak 1164 spectrum 2 weight 0.11000E+01 volume 0.10387E-02 ppm1 3.198 ppm2 0.795 CV 1
ASSI { 1165}
(( segid "PX14" and resid 40 and name HB1 ))
( segid "PX05" and resid 108 and name HD2%)
3.000 3.000 3.000 peak 1165 spectrum 2 weight 0.11000E+01 volume 0.23422E-02 ppm1 1.856 ppm2 0.758 CV 1
ASSI { 1167}
(( segid "PX14" and resid 44 and name HB1 ))
(( segid "PX14" and resid 45 and name HD2 ))
2.500 2.500 3.500 peak 1167 spectrum 2 weight 0.11000E+01 volume 0.25097E-02 ppm1 4.104 ppm2 3.633 CV 1
ASSI { 1168}
(( segid "PX14" and resid 44 and name HB2 ))
(( segid "PX14" and resid 45 and name HD2 ))
3.600 3.600 2.400 peak 1168 spectrum 2 weight 0.11000E+01 volume 0.20239E-02 ppm1 4.002 ppm2 3.636 CV 1
ASSI { 1174}
(( segid "PX14" and resid 56 and name HB1 ))
(( segid "PX14" and resid 53 and name HA ))
3.500 3.500 2.500 peak 1174 spectrum 2 weight 0.11000E+01 volume 0.87422E-03 ppm1 1.188 ppm2 3.470 CV 1
ASSI { 1177}
(( segid "PX14" and resid 64 and name HA ))
( segid "PX14" and resid 63 and name HG2%)
6.000 6.000 0.000 peak 1177 spectrum 2 weight 0.11000E+01 volume 0.58689E-05 ppm1 4.386 ppm2 0.659 CV 1
ASSI { 1179}
( segid "PX14" and resid 46 and name HD1%)
(( segid "PX14" and resid 72 and name HB ))
3.900 3.900 2.100 peak 1179 spectrum 2 weight 0.11000E+01 volume 0.44810E-03 ppm1 0.597 ppm2 4.179 CV 1
ASSI { 1180}
(( segid "PX14" and resid 28 and name HB1 ))
(( segid "PX05" and resid 103 and name HH2 ))
3.500 3.500 2.500 peak 1180 spectrum 2 weight 0.11000E+01 volume 0.60241E-03 ppm1 1.675 ppm2 6.875 CV 1
ASSI { 1181}
(( segid "PX14" and resid 56 and name HB1 ))
(( segid "PX05" and resid 103 and name HH2 ))
4.700 4.700 1.300 peak 1181 spectrum 2 weight 0.11000E+01 volume 0.15770E-03 ppm1 1.159 ppm2 6.855 CV 1
ASSI { 1182}
(( segid "PX14" and resid 56 and name HB1 ))
(( segid "PX05" and resid 103 and name HZ2 ))
3.500 3.500 2.500 peak 1182 spectrum 2 weight 0.11000E+01 volume 0.13916E-02 ppm1 1.212 ppm2 7.342 CV 1
ASSI { 1183}
(( segid "PX14" and resid 40 and name HB1 ))
( segid "PX05" and resid 107 and name HE% )
3.800 3.800 2.200 peak 1183 spectrum 2 weight 0.11000E+01 volume 0.57904E-03 ppm1 1.697 ppm2 7.271 CV 1
ASSI { 1186}
( segid "PX14" and resid 41 and name HG2%)
(( segid "PX14" and resid 49 and name HB1 ))
5.100 5.100 0.900 peak 1186 spectrum 2 weight 0.11000E+01 volume 0.17426E-03 ppm1 -0.403 ppm2 1.708 CV 1
ASSI { 1187}
(( segid "PX14" and resid 52 and name HA ))
( segid "PX05" and resid 107 and name HE% )
4.500 4.500 1.500 peak 1187 spectrum 2 weight 0.11000E+01 volume 0.49631E-03 ppm1 4.086 ppm2 7.256 CV 1
ASSI { 1188}
(( segid "PX14" and resid 31 and name HA ))
(( segid "PX05" and resid 103 and name HZ2 ))
6.000 6.000 0.000 peak 1188 spectrum 2 weight 0.11000E+01 volume 0.51077E-04 ppm1 3.779 ppm2 6.869 CV 1
ASSI { 1189}
(( segid "PX14" and resid 35 and name HB2 ))
( segid "PX14" and resid 35 and name HD% )
3.500 3.500 2.500 peak 1189 spectrum 2 weight 0.11000E+01 volume 0.66564E-03 ppm1 3.343 ppm2 7.205 CV 1
ASSI { 1192}
( segid "PX14" and resid 32 and name HB% )
( segid "PX14" and resid 35 and name HD% )
4.800 4.800 1.200 peak 1192 spectrum 2 weight 0.11000E+01 volume 0.18678E-03 ppm1 1.586 ppm2 7.213 CV 1
ASSI { 1195}
(( segid "PX14" and resid 35 and name HA ))
(( segid "PX14" and resid 35 and name HB2 ))
3.300 3.300 2.700 peak 1195 spectrum 2 weight 0.11000E+01 volume 0.67771E-03 ppm1 4.223 ppm2 3.364 CV 1
ASSI { 1196}
(( segid "PX14" and resid 56 and name HE1 ))
(( segid "PX14" and resid 56 and name HG1 ))
4.000 4.000 2.000 peak 1196 spectrum 2 weight 0.11000E+01 volume 0.71930E-03 ppm1 1.429 ppm2 -0.107 CV 1
ASSI { 1197}
(( segid "PX14" and resid 56 and name HE1 ))
(( segid "PX14" and resid 56 and name HG2 ))
3.300 3.300 2.700 peak 1197 spectrum 2 weight 0.11000E+01 volume 0.63691E-03 ppm1 1.419 ppm2 -1.180 CV 1
ASSI { 1198}
(( segid "PX14" and resid 56 and name HE2 ))
( segid "PX14" and resid 52 and name HE% )
4.000 2.000 2.000 peak 1198 spectrum 2 weight 0.11000E+01 volume 0.27465E-03 ppm1 1.438 ppm2 6.908 CV 1
ASSI { 1199}
(( segid "PX14" and resid 56 and name HE2 ))
(( segid "PX14" and resid 52 and name HZ ))
3.900 1.900 1.900 peak 1199 spectrum 2 weight 0.11000E+01 volume 0.57884E-03 ppm1 1.408 ppm2 7.199 CV 1
ASSI { 1206}
( segid "PX14" and resid 31 and name HG2%)
(( segid "PX05" and resid 103 and name HZ3 ))
4.300 4.300 1.700 peak 1206 spectrum 2 weight 0.11000E+01 volume 0.30747E-03 ppm1 -0.127 ppm2 6.360 CV 1
ASSI { 1207}
( segid "PX14" and resid 41 and name HG1%)
( segid "PX05" and resid 107 and name HD% )
3.500 3.500 2.500 peak 1207 spectrum 2 weight 0.11000E+01 volume 0.79505E-03 ppm1 0.464 ppm2 6.760 CV 1
ASSI { 1210}
(( segid "PX14" and resid 56 and name HB2 ))
(( segid "PX14" and resid 56 and name HA ))
3.700 3.700 2.300 peak 1210 spectrum 2 weight 0.11000E+01 volume 0.40474E-03 ppm1 1.064 ppm2 3.766 CV 1
ASSI { 1211}
(( segid "PX14" and resid 56 and name HB2 ))
(( segid "PX14" and resid 56 and name HB1 ))
2.100 2.100 3.900 peak 1211 spectrum 2 weight 0.11000E+01 volume 0.46194E-02 ppm1 1.085 ppm2 1.218 CV 1
ASSI { 1215}
(( segid "PX14" and resid 56 and name HB2 ))
(( segid "PX14" and resid 56 and name HG1 ))
3.600 1.600 1.600 peak 1215 spectrum 2 weight 0.11000E+01 volume 0.78693E-03 ppm1 1.072 ppm2 -1.172 CV 1
ASSI { 1216}
(( segid "PX14" and resid 36 and name HG ))
( segid "PX14" and resid 35 and name HD% )
3.300 3.300 2.700 peak 1216 spectrum 2 weight 0.11000E+01 volume 0.71420E-03 ppm1 2.019 ppm2 7.215 CV 1
ASSI { 1217}
( segid "PX14" and resid 28 and name HD2%)
(( segid "PX05" and resid 103 and name HH2 ))
3.000 3.000 3.000 peak 1217 spectrum 2 weight 0.11000E+01 volume 0.95842E-03 ppm1 0.866 ppm2 6.870 CV 1
ASSI { 1218}
( segid "PX14" and resid 28 and name HD2%)
(( segid "PX05" and resid 103 and name HZ2 ))
3.200 3.200 2.800 peak 1218 spectrum 2 weight 0.11000E+01 volume 0.57136E-03 ppm1 0.879 ppm2 7.340 CV 1
ASSI { 1219}
(( segid "PX14" and resid 36 and name HG ))
( segid "PX14" and resid 35 and name HE% )
4.500 4.500 1.500 peak 1219 spectrum 2 weight 0.11000E+01 volume 0.19576E-03 ppm1 2.034 ppm2 6.600 CV 1
ASSI { 1221}
( segid "PX14" and resid 36 and name HD1%)
( segid "PX14" and resid 67 and name HE% )
3.800 3.800 2.200 peak 1221 spectrum 2 weight 0.11000E+01 volume 0.50683E-03 ppm1 0.528 ppm2 7.053 CV 1
ASSI { 1222}
( segid "PX14" and resid 36 and name HD1%)
( segid "PX14" and resid 35 and name HD% )
2.900 2.900 3.100 peak 1222 spectrum 2 weight 0.11000E+01 volume 0.25446E-02 ppm1 0.529 ppm2 7.227 CV 1
ASSI { 1223}
( segid "PX14" and resid 36 and name HD1%)
( segid "PX14" and resid 35 and name HE% )
3.200 3.200 2.800 peak 1223 spectrum 2 weight 0.11000E+01 volume 0.18809E-02 ppm1 0.513 ppm2 6.608 CV 1
ASSI { 1224}
( segid "PX14" and resid 36 and name HD1%)
( segid "PX14" and resid 41 and name HG2%)
3.100 3.100 2.900 peak 1224 spectrum 2 weight 0.11000E+01 volume 0.31382E-02 ppm1 0.538 ppm2 -0.379 CV 1
ASSI { 1225}
( segid "PX14" and resid 63 and name HD1%)
(( segid "PX14" and resid 67 and name HZ ))
5.300 5.300 0.700 peak 1225 spectrum 2 weight 0.11000E+01 volume 0.12553E-03 ppm1 0.784 ppm2 6.936 CV 1
ASSI { 1227}
( segid "PX14" and resid 48 and name HG2%)
(( segid "PX14" and resid 44 and name HB2 ))
5.300 5.300 0.700 peak 1227 spectrum 2 weight 0.11000E+01 volume 0.14282E-03 ppm1 1.373 ppm2 4.059 CV 1
ASSI { 1230}
(( segid "PX14" and resid 65 and name HG2 ))
(( segid "PX14" and resid 65 and name HA ))
3.400 3.400 2.600 peak 1230 spectrum 2 weight 0.11000E+01 volume 0.10242E-02 ppm1 2.477 ppm2 4.093 CV 1
ASSI { 1231}
(( segid "PX14" and resid 65 and name HG2 ))
(( segid "PX14" and resid 65 and name HB1 ))
3.200 3.200 2.800 peak 1231 spectrum 2 weight 0.11000E+01 volume 0.11154E-02 ppm1 2.475 ppm2 2.154 CV 1
ASSI { 1235}
(( segid "PX14" and resid 78 and name HB2 ))
(( segid "PX14" and resid 78 and name HB1 ))
2.200 0.600 0.600 peak 1235 spectrum 2 weight 0.11000E+01 volume 0.60969E-02 ppm1 3.621 ppm2 3.745 CV 1
ASSI { 1238}
(( segid "PX14" and resid 53 and name HA ))
(( segid "PX14" and resid 56 and name HB2 ))
4.000 4.000 2.000 peak 1238 spectrum 2 weight 0.11000E+01 volume 0.20375E-03 ppm1 3.452 ppm2 1.080 CV 1
ASSI { 1239}
(( segid "PX14" and resid 66 and name HA ))
(( segid "PX14" and resid 69 and name HB1 ))
4.600 4.600 1.400 peak 1239 spectrum 2 weight 0.11000E+01 volume 0.43278E-03 ppm1 3.867 ppm2 2.078 CV 1
ASSI { 1242}
( segid "PX14" and resid 31 and name HG2%)
(( segid "PX05" and resid 103 and name HE3 ))
5.000 5.000 1.000 peak 1242 spectrum 2 weight 0.11000E+01 volume 0.10895E-03 ppm1 -0.127 ppm2 6.638 CV 1
ASSI { 1243}
( segid "PX14" and resid 31 and name HG2%)
(( segid "PX05" and resid 103 and name HH2 ))
6.000 6.000 0.000 peak 1243 spectrum 2 weight 0.11000E+01 volume 0.30425E-04 ppm1 -0.116 ppm2 6.862 CV 1
ASSI { 1244}
( segid "PX14" and resid 31 and name HG2%)
(( segid "PX05" and resid 103 and name HZ2 ))
4.600 4.600 1.400 peak 1244 spectrum 2 weight 0.11000E+01 volume 0.17638E-03 ppm1 -0.119 ppm2 7.336 CV 1
ASSI { 1245}
( segid "PX14" and resid 31 and name HG2%)
( segid "PX05" and resid 99 and name HD2%)
3.000 3.000 3.000 peak 1245 spectrum 2 weight 0.11000E+01 volume 0.27517E-02 ppm1 -0.120 ppm2 0.737 CV 1
ASSI { 1247}
(( segid "PX14" and resid 67 and name HA ))
(( segid "PX14" and resid 70 and name HB1 ))
3.100 3.100 2.900 peak 1247 spectrum 2 weight 0.11000E+01 volume 0.16909E-02 ppm1 3.909 ppm2 4.070 CV 1
ASSI { 1248}
(( segid "PX14" and resid 59 and name HB ))
( segid "PX14" and resid 59 and name HG2%)
2.700 2.700 3.300 peak 1248 spectrum 2 weight 0.11000E+01 volume 0.31455E-02 ppm1 4.640 ppm2 1.216 CV 1
ASSI { 1249}
(( segid "PX14" and resid 29 and name HA ))
( segid "PX14" and resid 32 and name HB% )
2.600 2.600 3.400 peak 1249 spectrum 2 weight 0.11000E+01 volume 0.42136E-02 ppm1 3.365 ppm2 1.601 CV 1
ASSI { 1253}
( segid "PX14" and resid 22 and name HG1%)
(( segid "PX14" and resid 24 and name HD2 ))
4.600 4.600 1.400 peak 1253 spectrum 2 weight 0.11000E+01 volume 0.40812E-03 ppm1 0.857 ppm2 3.604 CV 1
ASSI { 1255}
( segid "PX14" and resid 23 and name HD1%)
(( segid "PX14" and resid 23 and name HA ))
3.300 3.300 2.700 peak 1255 spectrum 2 weight 0.11000E+01 volume 0.12371E-02 ppm1 0.853 ppm2 4.613 CV 1
ASSI { 1259}
(( segid "PX14" and resid 54 and name HG1 ))
(( segid "PX14" and resid 54 and name HD1 ))
2.500 2.500 3.500 peak 1259 spectrum 2 weight 0.11000E+01 volume 0.77586E-02 ppm1 1.419 ppm2 1.630 CV 1
ASSI { 1261}
(( segid "PX14" and resid 29 and name HG12))
(( segid "PX14" and resid 65 and name HB1 ))
4.900 4.900 1.100 peak 1261 spectrum 2 weight 0.11000E+01 volume 0.11799E-03 ppm1 1.022 ppm2 2.153 CV 1
ASSI { 1263}
( segid "PX14" and resid 22 and name HG1%)
(( segid "PX14" and resid 20 and name HB2 ))
3.500 3.500 2.500 peak 1263 spectrum 2 weight 0.11000E+01 volume 0.38856E-03 ppm1 0.845 ppm2 1.839 CV 1
ASSI { 1267}
( segid "PX14" and resid 58 and name HD1%)
( segid "PX14" and resid 28 and name HD1%)
3.100 3.100 2.900 peak 1267 spectrum 2 weight 0.11000E+01 volume 0.68710E-03 ppm1 0.682 ppm2 0.999 CV 1
ASSI { 1272}
( segid "PX14" and resid 53 and name HD2%)
(( segid "PX05" and resid 103 and name HZ3 ))
5.000 5.000 1.000 peak 1272 spectrum 2 weight 0.11000E+01 volume 0.69092E-04 ppm1 0.906 ppm2 6.362 CV 1
ASSI { 1274}
( segid "PX14" and resid 53 and name HD2%)
(( segid "PX05" and resid 103 and name HH2 ))
5.600 5.600 0.400 peak 1274 spectrum 2 weight 0.11000E+01 volume 0.85651E-04 ppm1 0.937 ppm2 6.863 CV 1
ASSI { 1275}
( segid "PX14" and resid 41 and name HG1%)
(( segid "PX05" and resid 104 and name HA ))
3.600 3.600 2.400 peak 1275 spectrum 2 weight 0.11000E+01 volume 0.88281E-03 ppm1 0.460 ppm2 4.105 CV 1
ASSI { 1279}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 54 and name HB1 ))
3.100 3.100 2.900 peak 1279 spectrum 2 weight 0.11000E+01 volume 0.74567E-03 ppm1 0.620 ppm2 1.785 CV 1
ASSI { 1280}
( segid "PX14" and resid 41 and name HG1%)
( segid "PX05" and resid 104 and name HB% )
3.400 3.400 2.600 peak 1280 spectrum 2 weight 0.11000E+01 volume 0.12602E-02 ppm1 0.460 ppm2 1.567 CV 1
ASSI { 1284}
( segid "PX14" and resid 31 and name HG2%)
(( segid "PX05" and resid 100 and name HA ))
3.600 3.600 2.400 peak 1284 spectrum 2 weight 0.11000E+01 volume 0.71212E-03 ppm1 -0.115 ppm2 3.580 CV 1
ASSI { 1288}
( segid "PX14" and resid 46 and name HD1%)
(( segid "PX14" and resid 75 and name HB2 ))
4.300 4.300 1.700 peak 1288 spectrum 2 weight 0.11000E+01 volume 0.10540E-03 ppm1 0.651 ppm2 2.506 CV 1
ASSI { 1289}
(( segid "PX14" and resid 34 and name HA ))
( segid "PX14" and resid 33 and name HG2%)
4.200 4.200 1.800 peak 1289 spectrum 2 weight 0.11000E+01 volume 0.32138E-03 ppm1 3.992 ppm2 0.646 CV 1
ASSI { 1}
( segid "PX05" and resid 107 and name HD% )
(( segid "PX14" and resid 35 and name HZ ))
2.900 2.900 3.100 peak 1 spectrum 3 weight 0.11000E+01 volume 0.19007E-02 ppm1 6.745 ppm2 5.603 CV 1
ASSI { 2}
( segid "PX14" and resid 35 and name HE% )
(( segid "PX14" and resid 35 and name HZ ))
2.100 2.100 3.900 peak 2 spectrum 3 weight 0.11000E+01 volume 0.11228E-01 ppm1 6.588 ppm2 5.599 CV 1
ASSI { 4}
( segid "PX14" and resid 67 and name HD% )
( segid "PX14" and resid 67 and name HE% )
1.900 1.900 4.100 peak 4 spectrum 3 weight 0.11000E+01 volume 0.20056E-01 ppm1 7.235 ppm2 7.049 CV 1
ASSI { 7}
(( segid "PX14" and resid 67 and name HZ ))
( segid "PX14" and resid 67 and name HE% )
2.400 2.400 3.600 peak 7 spectrum 3 weight 0.11000E+01 volume 0.54325E-02 ppm1 6.914 ppm2 7.046 CV 1
ASSI { 8}
( segid "PX14" and resid 35 and name HD% )
( segid "PX14" and resid 35 and name HE% )
2.200 2.200 3.800 peak 8 spectrum 3 weight 0.11000E+01 volume 0.84685E-02 ppm1 7.190 ppm2 6.609 CV 1
ASSI { 14}
(( segid "PX05" and resid 103 and name HH2 ))
(( segid "PX05" and resid 103 and name HE3 ))
3.800 3.800 2.200 peak 14 spectrum 3 weight 0.11000E+01 volume 0.12151E-02 ppm1 6.846 ppm2 6.639 CV 1
ASSI { 15}
(( segid "PX05" and resid 103 and name HZ2 ))
(( segid "PX05" and resid 103 and name HZ3 ))
4.000 4.000 2.000 peak 15 spectrum 3 weight 0.11000E+01 volume 0.10230E-02 ppm1 7.314 ppm2 6.360 CV 1
ASSI { 19}
( segid "PX05" and resid 107 and name HD% )
( segid "PX14" and resid 52 and name HE% )
3.900 3.900 2.100 peak 19 spectrum 3 weight 0.11000E+01 volume 0.56629E-03 ppm1 6.747 ppm2 6.908 CV 1
ASSI { 20}
(( segid "PX05" and resid 103 and name HZ3 ))
( segid "PX14" and resid 35 and name HD% )
3.800 3.800 2.200 peak 20 spectrum 3 weight 0.11000E+01 volume 0.72447E-03 ppm1 6.340 ppm2 7.213 CV 1
ASSI { 28}
( segid "PX14" and resid 35 and name HD% )
(( segid "PX05" and resid 103 and name HB1 ))
2.100 2.100 3.900 peak 28 spectrum 3 weight 0.11000E+01 volume 0.12244E-01 ppm1 7.192 ppm2 3.389 CV 1
ASSI { 29}
( segid "PX14" and resid 35 and name HD% )
(( segid "PX05" and resid 103 and name HB2 ))
2.500 2.500 3.500 peak 29 spectrum 3 weight 0.11000E+01 volume 0.47641E-02 ppm1 7.180 ppm2 2.983 CV 1
ASSI { 33}
(( segid "PX05" and resid 96 and name HA ))
(( segid "PX05" and resid 96 and name HB2 ))
3.200 3.200 2.800 peak 33 spectrum 3 weight 0.11000E+01 volume 0.16975E-02 ppm1 4.448 ppm2 2.462 CV 1
ASSI { 34}
(( segid "PX05" and resid 96 and name HA ))
(( segid "PX05" and resid 96 and name HB1 ))
3.300 3.300 2.700 peak 34 spectrum 3 weight 0.11000E+01 volume 0.12128E-02 ppm1 4.448 ppm2 2.674 CV 1
ASSI { 37}
( segid "PX05" and resid 107 and name HD% )
( segid "PX05" and resid 108 and name HD2%)
2.500 2.500 3.500 peak 37 spectrum 3 weight 0.11000E+01 volume 0.45754E-02 ppm1 6.747 ppm2 0.744 CV 1
ASSI { 39}
( segid "PX05" and resid 107 and name HE% )
( segid "PX05" and resid 108 and name HD2%)
2.800 2.800 3.200 peak 39 spectrum 3 weight 0.11000E+01 volume 0.28255E-02 ppm1 7.234 ppm2 0.736 CV 1
ASSI { 40}
( segid "PX14" and resid 35 and name HE% )
( segid "PX05" and resid 107 and name HD% )
3.200 3.200 2.800 peak 40 spectrum 3 weight 0.11000E+01 volume 0.36190E-02 ppm1 6.590 ppm2 6.770 CV 1
ASSI { 53}
( segid "PX05" and resid 107 and name HD% )
(( segid "PX05" and resid 107 and name HA ))
2.600 2.600 3.400 peak 53 spectrum 3 weight 0.11000E+01 volume 0.46335E-02 ppm1 6.744 ppm2 3.788 CV 1
ASSI { 54}
( segid "PX14" and resid 35 and name HE% )
(( segid "PX05" and resid 107 and name HB1 ))
3.000 3.000 3.000 peak 54 spectrum 3 weight 0.11000E+01 volume 0.53044E-02 ppm1 6.588 ppm2 2.885 CV 1
ASSI { 55}
( segid "PX14" and resid 35 and name HE% )
(( segid "PX14" and resid 52 and name HA ))
2.900 2.900 3.100 peak 55 spectrum 3 weight 0.11000E+01 volume 0.75164E-02 ppm1 6.589 ppm2 4.101 CV 1
ASSI { 56}
( segid "PX14" and resid 35 and name HD% )
(( segid "PX05" and resid 104 and name HA ))
2.700 2.700 3.300 peak 56 spectrum 3 weight 0.11000E+01 volume 0.80713E-02 ppm1 7.197 ppm2 4.100 CV 1
ASSI { 57}
(( segid "PX14" and resid 52 and name HZ ))
(( segid "PX14" and resid 56 and name HG2 ))
5.600 5.600 0.400 peak 57 spectrum 3 weight 0.11000E+01 volume 0.15390E-03 ppm1 7.176 ppm2 -1.177 CV 1
ASSI { 64}
( segid "PX14" and resid 35 and name HD% )
( segid "PX05" and resid 104 and name HB% )
2.700 2.700 3.300 peak 64 spectrum 3 weight 0.11000E+01 volume 0.49003E-02 ppm1 7.192 ppm2 1.571 CV 1
ASSI { 65}
( segid "PX14" and resid 67 and name HD% )
(( segid "PX14" and resid 67 and name HB2 ))
2.400 2.400 3.600 peak 65 spectrum 3 weight 0.11000E+01 volume 0.50031E-02 ppm1 7.233 ppm2 3.008 CV 1
ASSI { 69}
( segid "PX14" and resid 35 and name HE% )
(( segid "PX05" and resid 107 and name HB2 ))
2.300 2.300 3.700 peak 69 spectrum 3 weight 0.11000E+01 volume 0.78036E-02 ppm1 6.588 ppm2 2.102 CV 1
ASSI { 74}
( segid "PX14" and resid 35 and name HD% )
( segid "PX14" and resid 36 and name HD2%)
3.200 3.200 2.800 peak 74 spectrum 3 weight 0.11000E+01 volume 0.12723E-02 ppm1 7.195 ppm2 0.175 CV 1
ASSI { 80}
(( segid "PX05" and resid 103 and name HZ2 ))
( segid "PX05" and resid 99 and name HD2%)
2.400 2.400 3.600 peak 80 spectrum 3 weight 0.11000E+01 volume 0.37665E-02 ppm1 7.317 ppm2 0.736 CV 1
ASSI { 92}
( segid "PX14" and resid 35 and name HD% )
( segid "PX14" and resid 41 and name HG1%)
3.100 3.100 2.900 peak 92 spectrum 3 weight 0.11000E+01 volume 0.19827E-02 ppm1 7.195 ppm2 0.488 CV 1
ASSI { 93}
( segid "PX14" and resid 67 and name HD% )
( segid "PX14" and resid 36 and name HD1%)
2.900 2.900 3.100 peak 93 spectrum 3 weight 0.11000E+01 volume 0.20310E-02 ppm1 7.231 ppm2 0.555 CV 1
ASSI { 94}
( segid "PX14" and resid 67 and name HE% )
(( segid "PX14" and resid 67 and name HA ))
4.800 4.800 1.200 peak 94 spectrum 3 weight 0.11000E+01 volume 0.36067E-03 ppm1 7.031 ppm2 3.949 CV 1
ASSI { 95}
(( segid "PX14" and resid 56 and name HG2 ))
(( segid "PX14" and resid 56 and name HG1 ))
1.900 1.900 4.100 peak 95 spectrum 3 weight 0.11000E+01 volume 0.10095E-01 ppm1 -1.196 ppm2 -0.096 CV 1
ASSI { 97}
(( segid "PX14" and resid 56 and name HG2 ))
(( segid "PX14" and resid 56 and name HD2 ))
3.000 3.000 3.000 peak 97 spectrum 3 weight 0.11000E+01 volume 0.17635E-02 ppm1 -1.193 ppm2 0.620 CV 1
ASSI { 98}
(( segid "PX14" and resid 56 and name HG2 ))
(( segid "PX14" and resid 56 and name HD1 ))
3.100 3.100 2.900 peak 98 spectrum 3 weight 0.11000E+01 volume 0.17372E-02 ppm1 -1.190 ppm2 0.803 CV 1
ASSI { 100}
(( segid "PX14" and resid 56 and name HG2 ))
(( segid "PX14" and resid 56 and name HE2 ))
2.600 2.600 3.400 peak 100 spectrum 3 weight 0.11000E+01 volume 0.37653E-02 ppm1 -1.195 ppm2 1.230 CV 1
ASSI { 103}
(( segid "PX14" and resid 56 and name HG2 ))
(( segid "PX14" and resid 56 and name HA ))
3.300 3.300 2.700 peak 103 spectrum 3 weight 0.11000E+01 volume 0.23897E-02 ppm1 -1.191 ppm2 3.779 CV 1
ASSI { 107}
(( segid "PX14" and resid 56 and name HG1 ))
(( segid "PX14" and resid 56 and name HD2 ))
2.500 2.500 3.500 peak 107 spectrum 3 weight 0.11000E+01 volume 0.34954E-02 ppm1 -0.118 ppm2 0.623 CV 1
ASSI { 108}
(( segid "PX14" and resid 56 and name HG1 ))
(( segid "PX14" and resid 56 and name HD1 ))
2.700 2.700 3.300 peak 108 spectrum 3 weight 0.11000E+01 volume 0.29073E-02 ppm1 -0.118 ppm2 0.807 CV 1
ASSI { 134}
(( segid "PX14" and resid 56 and name HB2 ))
(( segid "PX14" and resid 56 and name HG2 ))
2.400 2.400 3.600 peak 134 spectrum 3 weight 0.11000E+01 volume 0.42451E-02 ppm1 1.067 ppm2 -1.173 CV 1
ASSI { 136}
(( segid "PX14" and resid 56 and name HG1 ))
(( segid "PX14" and resid 56 and name HE2 ))
2.900 2.900 3.100 peak 136 spectrum 3 weight 0.11000E+01 volume 0.52569E-02 ppm1 -0.116 ppm2 1.226 CV 1
ASSI { 138}
(( segid "PX14" and resid 80 and name HB1 ))
(( segid "PX14" and resid 80 and name HA ))
2.300 2.300 3.700 peak 138 spectrum 3 weight 0.11000E+01 volume 0.83356E-02 ppm1 1.298 ppm2 4.214 CV 1
ASSI { 140}
(( segid "PX14" and resid 35 and name HZ ))
(( segid "PX14" and resid 52 and name HB1 ))
4.300 4.300 1.700 peak 140 spectrum 3 weight 0.11000E+01 volume 0.22292E-03 ppm1 5.580 ppm2 3.501 CV 1
ASSI { 141}
(( segid "PX14" and resid 35 and name HZ ))
(( segid "PX14" and resid 52 and name HB2 ))
3.900 3.900 2.100 peak 141 spectrum 3 weight 0.11000E+01 volume 0.57687E-03 ppm1 5.582 ppm2 3.013 CV 1
ASSI { 157}
(( segid "PX14" and resid 64 and name HB1 ))
(( segid "PX14" and resid 64 and name HA ))
3.700 3.700 2.300 peak 157 spectrum 3 weight 0.11000E+01 volume 0.82216E-03 ppm1 2.818 ppm2 4.409 CV 1
ASSI { 166}
(( segid "PX14" and resid 36 and name HB2 ))
(( segid "PX14" and resid 36 and name HB1 ))
1.900 1.900 4.100 peak 166 spectrum 3 weight 0.11000E+01 volume 0.93669E-02 ppm1 1.204 ppm2 1.815 CV 1
ASSI { 168}
(( segid "PX14" and resid 36 and name HB2 ))
(( segid "PX14" and resid 36 and name HA ))
3.300 3.300 2.700 peak 168 spectrum 3 weight 0.11000E+01 volume 0.16365E-02 ppm1 1.205 ppm2 3.402 CV 1
ASSI { 169}
(( segid "PX14" and resid 53 and name HB1 ))
(( segid "PX14" and resid 53 and name HG ))
2.900 1.000 1.000 peak 169 spectrum 3 weight 0.11000E+01 volume 0.29098E-02 ppm1 1.982 ppm2 1.221 CV 1
ASSI { 171}
(( segid "PX14" and resid 53 and name HB2 ))
(( segid "PX14" and resid 53 and name HA ))
3.300 3.300 2.700 peak 171 spectrum 3 weight 0.11000E+01 volume 0.14321E-02 ppm1 1.203 ppm2 3.472 CV 1
OR { 171}
(( segid "PX14" and resid 53 and name HB2 ))
(( segid "PX14" and resid 53 and name HA ))
ASSI { 176}
(( segid "PX14" and resid 54 and name HE1 ))
(( segid "PX14" and resid 54 and name HA ))
4.800 4.800 1.200 peak 176 spectrum 3 weight 0.11000E+01 volume 0.30828E-03 ppm1 2.848 ppm2 4.152 CV 1
ASSI { 177}
(( segid "PX14" and resid 75 and name HB1 ))
(( segid "PX14" and resid 75 and name HB2 ))
2.100 2.100 3.900 peak 177 spectrum 3 weight 0.11000E+01 volume 0.92662E-02 ppm1 2.618 ppm2 2.548 CV 1
ASSI { 187}
(( segid "PX14" and resid 50 and name HD2 ))
(( segid "PX14" and resid 50 and name HD1 ))
1.700 1.700 4.300 peak 187 spectrum 3 weight 0.11000E+01 volume 0.21909E-01 ppm1 3.033 ppm2 3.144 CV 1
ASSI { 188}
(( segid "PX14" and resid 25 and name HD1 ))
(( segid "PX14" and resid 25 and name HA ))
3.900 3.900 2.100 peak 188 spectrum 3 weight 0.11000E+01 volume 0.42320E-03 ppm1 3.240 ppm2 4.345 CV 1
ASSI { 192}
(( segid "PX14" and resid 50 and name HD1 ))
(( segid "PX14" and resid 50 and name HA ))
5.100 5.100 0.900 peak 192 spectrum 3 weight 0.11000E+01 volume 0.31202E-03 ppm1 3.121 ppm2 3.890 CV 1
ASSI { 193}
(( segid "PX14" and resid 50 and name HD2 ))
(( segid "PX14" and resid 50 and name HA ))
5.100 5.100 0.900 peak 193 spectrum 3 weight 0.11000E+01 volume 0.26496E-03 ppm1 3.038 ppm2 3.890 CV 1
ASSI { 196}
(( segid "PX14" and resid 50 and name HD1 ))
( segid "PX14" and resid 46 and name HD1%)
4.800 4.800 1.200 peak 196 spectrum 3 weight 0.11000E+01 volume 0.15935E-03 ppm1 3.125 ppm2 0.679 CV 1
ASSI { 198}
(( segid "PX14" and resid 50 and name HD2 ))
( segid "PX14" and resid 46 and name HD2%)
4.000 4.000 2.000 peak 198 spectrum 3 weight 0.11000E+01 volume 0.17506E-03 ppm1 3.039 ppm2 0.608 CV 1
ASSI { 199}
(( segid "PX14" and resid 50 and name HD2 ))
( segid "PX14" and resid 46 and name HD1%)
4.000 4.000 2.000 peak 199 spectrum 3 weight 0.11000E+01 volume 0.30600E-03 ppm1 3.037 ppm2 0.678 CV 1
ASSI { 201}
(( segid "PX14" and resid 50 and name HD1 ))
(( segid "PX14" and resid 50 and name HB2 ))
2.800 2.800 3.200 peak 201 spectrum 3 weight 0.11000E+01 volume 0.26972E-02 ppm1 3.122 ppm2 1.706 CV 1
ASSI { 203}
(( segid "PX14" and resid 50 and name HD2 ))
(( segid "PX14" and resid 50 and name HG1 ))
2.700 2.700 3.300 peak 203 spectrum 3 weight 0.11000E+01 volume 0.29669E-02 ppm1 3.038 ppm2 1.479 CV 1
ASSI { 204}
(( segid "PX14" and resid 50 and name HD2 ))
(( segid "PX14" and resid 50 and name HB2 ))
2.900 2.900 3.100 peak 204 spectrum 3 weight 0.11000E+01 volume 0.30496E-02 ppm1 3.037 ppm2 1.707 CV 1
ASSI { 205}
(( segid "PX14" and resid 50 and name HD2 ))
(( segid "PX14" and resid 50 and name HB1 ))
2.500 2.500 3.500 peak 205 spectrum 3 weight 0.11000E+01 volume 0.68837E-02 ppm1 3.035 ppm2 1.861 CV 1
ASSI { 213}
(( segid "PX14" and resid 40 and name HD1 ))
(( segid "PX14" and resid 40 and name HA ))
4.600 4.600 1.400 peak 213 spectrum 3 weight 0.11000E+01 volume 0.53170E-03 ppm1 3.185 ppm2 4.199 CV 1
ASSI { 214}
(( segid "PX14" and resid 40 and name HD2 ))
(( segid "PX14" and resid 40 and name HA ))
5.800 5.800 0.200 peak 214 spectrum 3 weight 0.11000E+01 volume 0.14312E-03 ppm1 3.118 ppm2 4.198 CV 1
ASSI { 215}
(( segid "PX14" and resid 40 and name HD1 ))
(( segid "PX14" and resid 40 and name HD2 ))
1.900 1.900 4.100 peak 215 spectrum 3 weight 0.11000E+01 volume 0.11601E-01 ppm1 3.183 ppm2 3.141 CV 1
ASSI { 218}
(( segid "PX14" and resid 40 and name HD1 ))
(( segid "PX14" and resid 40 and name HG1 ))
3.300 3.300 2.700 peak 218 spectrum 3 weight 0.11000E+01 volume 0.10385E-02 ppm1 3.184 ppm2 1.764 CV 1
ASSI { 219}
(( segid "PX14" and resid 40 and name HD2 ))
(( segid "PX14" and resid 40 and name HG1 ))
2.900 2.900 3.100 peak 219 spectrum 3 weight 0.11000E+01 volume 0.18180E-02 ppm1 3.118 ppm2 1.764 CV 1
ASSI { 221}
(( segid "PX14" and resid 40 and name HD1 ))
( segid "PX05" and resid 108 and name HD1%)
3.700 3.700 2.300 peak 221 spectrum 3 weight 0.11000E+01 volume 0.27503E-03 ppm1 3.183 ppm2 0.798 CV 1
ASSI { 226}
(( segid "PX14" and resid 49 and name HD2 ))
( segid "PX14" and resid 36 and name HD1%)
3.200 3.200 2.800 peak 226 spectrum 3 weight 0.11000E+01 volume 0.19293E-02 ppm1 2.656 ppm2 0.556 CV 1
ASSI { 227}
(( segid "PX14" and resid 49 and name HD1 ))
( segid "PX14" and resid 36 and name HD1%)
3.600 3.600 2.400 peak 227 spectrum 3 weight 0.11000E+01 volume 0.15060E-02 ppm1 3.230 ppm2 0.558 CV 1
ASSI { 238}
(( segid "PX14" and resid 42 and name HD2 ))
(( segid "PX14" and resid 42 and name HG2 ))
2.800 2.800 3.200 peak 238 spectrum 3 weight 0.11000E+01 volume 0.27732E-02 ppm1 2.974 ppm2 1.636 CV 1
ASSI { 240}
(( segid "PX14" and resid 42 and name HD2 ))
(( segid "PX14" and resid 42 and name HG1 ))
2.700 2.700 3.300 peak 240 spectrum 3 weight 0.11000E+01 volume 0.26317E-02 ppm1 2.975 ppm2 1.716 CV 1
ASSI { 242}
(( segid "PX14" and resid 42 and name HD1 ))
(( segid "PX14" and resid 42 and name HB2 ))
3.000 3.000 3.000 peak 242 spectrum 3 weight 0.11000E+01 volume 0.19595E-02 ppm1 3.007 ppm2 1.783 CV 1
ASSI { 243}
(( segid "PX14" and resid 42 and name HD2 ))
(( segid "PX14" and resid 42 and name HB2 ))
3.100 3.100 2.900 peak 243 spectrum 3 weight 0.11000E+01 volume 0.15916E-02 ppm1 2.974 ppm2 1.784 CV 1
ASSI { 244}
(( segid "PX14" and resid 42 and name HD2 ))
(( segid "PX14" and resid 42 and name HB1 ))
3.700 3.700 2.300 peak 244 spectrum 3 weight 0.11000E+01 volume 0.65138E-03 ppm1 2.974 ppm2 1.886 CV 1
ASSI { 247}
(( segid "PX14" and resid 42 and name HD2 ))
(( segid "PX14" and resid 42 and name HA ))
3.800 3.800 2.200 peak 247 spectrum 3 weight 0.11000E+01 volume 0.18154E-02 ppm1 2.973 ppm2 3.800 CV 1
ASSI { 248}
(( segid "PX14" and resid 57 and name HA2 ))
(( segid "PX14" and resid 57 and name HA1 ))
1.900 1.900 4.100 peak 248 spectrum 3 weight 0.11000E+01 volume 0.14261E-01 ppm1 3.534 ppm2 4.183 CV 1
ASSI { 254}
(( segid "PX14" and resid 24 and name HD1 ))
(( segid "PX14" and resid 24 and name HD2 ))
1.900 1.900 4.100 peak 254 spectrum 3 weight 0.11000E+01 volume 0.11360E-01 ppm1 3.878 ppm2 3.581 CV 1
ASSI { 264}
(( segid "PX14" and resid 24 and name HD2 ))
(( segid "PX14" and resid 24 and name HG1 ))
3.100 3.100 2.900 peak 264 spectrum 3 weight 0.11000E+01 volume 0.32459E-02 ppm1 3.557 ppm2 2.017 CV 1
ASSI { 265}
(( segid "PX14" and resid 24 and name HD1 ))
(( segid "PX14" and resid 24 and name HG1 ))
2.200 2.200 3.800 peak 265 spectrum 3 weight 0.11000E+01 volume 0.68576E-02 ppm1 3.880 ppm2 2.015 CV 1
ASSI { 266}
(( segid "PX14" and resid 27 and name HD1 ))
(( segid "PX14" and resid 27 and name HB2 ))
2.800 2.800 3.200 peak 266 spectrum 3 weight 0.11000E+01 volume 0.80612E-02 ppm1 3.805 ppm2 1.787 CV 1
ASSI { 270}
(( segid "PX14" and resid 21 and name HA ))
(( segid "PX14" and resid 21 and name HB2 ))
2.900 2.900 3.100 peak 270 spectrum 3 weight 0.11000E+01 volume 0.27789E-02 ppm1 4.648 ppm2 2.656 CV 1
ASSI { 287}
(( segid "PX14" and resid 43 and name HA ))
(( segid "PX14" and resid 43 and name HB2 ))
2.700 2.700 3.300 peak 287 spectrum 3 weight 0.11000E+01 volume 0.50540E-02 ppm1 4.249 ppm2 2.015 CV 1
ASSI { 291}
(( segid "PX14" and resid 32 and name HA ))
(( segid "PX14" and resid 35 and name HB2 ))
4.500 4.500 1.500 peak 291 spectrum 3 weight 0.11000E+01 volume 0.30963E-03 ppm1 4.194 ppm2 3.372 CV 1
ASSI { 302}
(( segid "PX14" and resid 53 and name HA ))
(( segid "PX14" and resid 56 and name HE2 ))
2.900 2.900 3.100 peak 302 spectrum 3 weight 0.11000E+01 volume 0.29209E-02 ppm1 3.445 ppm2 1.225 CV 1
ASSI { 360}
(( segid "PX14" and resid 70 and name HB1 ))
(( segid "PX14" and resid 70 and name HB2 ))
1.900 1.900 4.100 peak 360 spectrum 3 weight 0.11000E+01 volume 0.10011E-01 ppm1 4.070 ppm2 3.855 CV 1
ASSI { 365}
(( segid "PX05" and resid 101 and name HA ))
( segid "PX05" and resid 104 and name HB% )
2.300 2.300 3.700 peak 365 spectrum 3 weight 0.11000E+01 volume 0.11747E-01 ppm1 4.238 ppm2 1.557 CV 1
ASSI { 424}
( segid "PX14" and resid 72 and name HG2%)
(( segid "PX14" and resid 42 and name HD2 ))
3.500 3.500 2.500 peak 424 spectrum 3 weight 0.11000E+01 volume 0.95769E-03 ppm1 0.893 ppm2 3.003 CV 1
ASSI { 433}
( segid "PX14" and resid 36 and name HD1%)
(( segid "PX14" and resid 67 and name HZ ))
3.900 3.900 2.100 peak 433 spectrum 3 weight 0.11000E+01 volume 0.64969E-03 ppm1 0.533 ppm2 6.938 CV 1
ASSI { 451}
(( segid "PX14" and resid 54 and name HG2 ))
(( segid "PX14" and resid 54 and name HB1 ))
2.400 2.400 3.600 peak 451 spectrum 3 weight 0.11000E+01 volume 0.55075E-02 ppm1 1.329 ppm2 1.789 CV 1
ASSI { 453}
(( segid "PX14" and resid 54 and name HG2 ))
(( segid "PX14" and resid 54 and name HG1 ))
1.500 1.500 4.500 peak 453 spectrum 3 weight 0.11000E+01 volume 0.44096E-01 ppm1 1.329 ppm2 1.478 CV 1
ASSI { 489}
(( segid "PX14" and resid 49 and name HG2 ))
(( segid "PX14" and resid 49 and name HB1 ))
3.600 3.600 2.400 peak 489 spectrum 3 weight 0.11000E+01 volume 0.36876E-03 ppm1 1.174 ppm2 2.399 CV 1
ASSI { 490}
(( segid "PX14" and resid 49 and name HG2 ))
(( segid "PX14" and resid 49 and name HD2 ))
3.100 3.100 2.900 peak 490 spectrum 3 weight 0.11000E+01 volume 0.94749E-03 ppm1 1.174 ppm2 2.677 CV 1
ASSI { 496}
(( segid "PX14" and resid 49 and name HG1 ))
(( segid "PX14" and resid 49 and name HB2 ))
2.700 2.700 3.300 peak 496 spectrum 3 weight 0.11000E+01 volume 0.19894E-02 ppm1 1.172 ppm2 1.610 CV 1
ASSI { 498}
(( segid "PX14" and resid 37 and name HB2 ))
(( segid "PX14" and resid 37 and name HG1 ))
3.000 3.000 3.000 peak 498 spectrum 3 weight 0.11000E+01 volume 0.12421E-02 ppm1 2.025 ppm2 2.723 CV 1
ASSI { 513}
(( segid "PX14" and resid 81 and name HB1 ))
(( segid "PX14" and resid 81 and name HA ))
3.600 3.600 2.400 peak 513 spectrum 3 weight 0.11000E+01 volume 0.66680E-03 ppm1 3.249 ppm2 4.464 CV 1
ASSI { 531}
(( segid "PX14" and resid 55 and name HB1 ))
(( segid "PX14" and resid 55 and name HE1 ))
5.800 5.800 0.200 peak 531 spectrum 3 weight 0.11000E+01 volume 0.13483E-03 ppm1 1.685 ppm2 2.792 CV 1
ASSI { 536}
(( segid "PX14" and resid 52 and name HZ ))
(( segid "PX05" and resid 103 and name HA ))
2.700 2.700 3.300 peak 536 spectrum 3 weight 0.11000E+01 volume 0.27575E-02 ppm1 7.178 ppm2 4.746 CV 1
ASSI { 537}
( segid "PX14" and resid 52 and name HD% )
(( segid "PX05" and resid 103 and name HA ))
4.200 4.200 1.800 peak 537 spectrum 3 weight 0.11000E+01 volume 0.81914E-03 ppm1 6.895 ppm2 4.746 CV 1
ASSI { 538}
( segid "PX14" and resid 52 and name HE% )
(( segid "PX14" and resid 56 and name HG1 ))
4.800 4.800 1.200 peak 538 spectrum 3 weight 0.11000E+01 volume 0.44120E-03 ppm1 6.895 ppm2 -0.092 CV 1
ASSI { 539}
( segid "PX14" and resid 52 and name HE% )
(( segid "PX14" and resid 56 and name HG2 ))
4.900 4.900 1.100 peak 539 spectrum 3 weight 0.11000E+01 volume 0.19815E-03 ppm1 6.896 ppm2 -1.167 CV 1
ASSI { 540}
(( segid "PX14" and resid 56 and name HN ))
(( segid "PX14" and resid 56 and name HG1 ))
4.200 4.200 1.800 peak 540 spectrum 3 weight 0.11000E+01 volume 0.73648E-03 ppm1 6.949 ppm2 -0.093 CV 1
ASSI { 541}
(( segid "PX14" and resid 56 and name HN ))
(( segid "PX14" and resid 56 and name HG2 ))
4.200 4.200 1.800 peak 541 spectrum 3 weight 0.11000E+01 volume 0.51309E-03 ppm1 6.949 ppm2 -1.168 CV 1
ASSI { 542}
(( segid "PX05" and resid 103 and name HH2 ))
(( segid "PX14" and resid 56 and name HG2 ))
4.900 4.900 1.100 peak 542 spectrum 3 weight 0.11000E+01 volume 0.82907E-04 ppm1 6.846 ppm2 -1.169 CV 1
ASSI { 547}
(( segid "PX05" and resid 103 and name HE3 ))
(( segid "PX14" and resid 56 and name HG2 ))
6.000 6.000 0.000 peak 547 spectrum 3 weight 0.11000E+01 volume 0.27248E-04 ppm1 6.622 ppm2 -1.169 CV 1
ASSI { 549}
(( segid "PX05" and resid 103 and name HZ3 ))
(( segid "PX14" and resid 56 and name HG2 ))
6.000 6.000 0.000 peak 549 spectrum 3 weight 0.11000E+01 volume 0.20109E-04 ppm1 6.338 ppm2 -1.172 CV 1
ASSI { 553}
( segid "PX05" and resid 107 and name HE% )
(( segid "PX05" and resid 107 and name HB1 ))
4.400 4.400 1.600 peak 553 spectrum 3 weight 0.11000E+01 volume 0.60559E-03 ppm1 7.226 ppm2 2.896 CV 1
ASSI { 556}
( segid "PX14" and resid 35 and name HE% )
( segid "PX14" and resid 53 and name HD1%)
3.000 3.000 3.000 peak 556 spectrum 3 weight 0.11000E+01 volume 0.23108E-02 ppm1 6.590 ppm2 0.731 CV 1
ASSI { 562}
( segid "PX05" and resid 107 and name HE% )
(( segid "PX14" and resid 44 and name HB2 ))
2.800 2.800 3.200 peak 562 spectrum 3 weight 0.11000E+01 volume 0.40886E-02 ppm1 7.232 ppm2 4.044 CV 1
ASSI { 564}
( segid "PX05" and resid 107 and name HE% )
(( segid "PX14" and resid 48 and name HB ))
3.100 3.100 2.900 peak 564 spectrum 3 weight 0.11000E+01 volume 0.14149E-02 ppm1 7.232 ppm2 4.439 CV 1
ASSI { 570}
( segid "PX14" and resid 67 and name HD% )
( segid "PX14" and resid 46 and name HD1%)
3.800 3.800 2.200 peak 570 spectrum 3 weight 0.11000E+01 volume 0.50720E-03 ppm1 7.234 ppm2 0.678 CV 1
ASSI { 572}
( segid "PX14" and resid 67 and name HE% )
( segid "PX14" and resid 46 and name HD1%)
3.200 3.200 2.800 peak 572 spectrum 3 weight 0.11000E+01 volume 0.13389E-02 ppm1 7.029 ppm2 0.677 CV 1
ASSI { 573}
(( segid "PX14" and resid 67 and name HZ ))
( segid "PX14" and resid 46 and name HD1%)
3.800 3.800 2.200 peak 573 spectrum 3 weight 0.11000E+01 volume 0.51978E-03 ppm1 6.915 ppm2 0.677 CV 1
ASSI { 575}
(( segid "PX14" and resid 67 and name HZ ))
( segid "PX14" and resid 36 and name HD2%)
5.100 5.100 0.900 peak 575 spectrum 3 weight 0.11000E+01 volume 0.15831E-03 ppm1 6.915 ppm2 0.176 CV 1
ASSI { 576}
( segid "PX14" and resid 35 and name HE% )
( segid "PX14" and resid 36 and name HD2%)
4.300 4.300 1.700 peak 576 spectrum 3 weight 0.11000E+01 volume 0.19484E-03 ppm1 6.589 ppm2 0.176 CV 1
ASSI { 580}
( segid "PX05" and resid 107 and name HE% )
(( segid "PX14" and resid 49 and name HB1 ))
2.400 2.400 3.600 peak 580 spectrum 3 weight 0.11000E+01 volume 0.36115E-02 ppm1 7.232 ppm2 1.721 CV 1
ASSI { 583}
( segid "PX14" and resid 35 and name HD% )
(( segid "PX14" and resid 35 and name HZ ))
4.100 4.100 1.900 peak 583 spectrum 3 weight 0.11000E+01 volume 0.68723E-03 ppm1 7.196 ppm2 5.605 CV 1
ASSI { 584}
( segid "PX05" and resid 107 and name HE% )
(( segid "PX14" and resid 35 and name HZ ))
3.800 3.800 2.200 peak 584 spectrum 3 weight 0.11000E+01 volume 0.78962E-03 ppm1 7.228 ppm2 5.605 CV 1
ASSI { 587}
(( segid "PX14" and resid 56 and name HN ))
(( segid "PX14" and resid 56 and name HB2 ))
3.100 3.100 2.900 peak 587 spectrum 3 weight 0.11000E+01 volume 0.89744E-03 ppm1 6.949 ppm2 1.093 CV 1
ASSI { 588}
(( segid "PX14" and resid 56 and name HN ))
(( segid "PX14" and resid 56 and name HE2 ))
3.500 3.500 2.500 peak 588 spectrum 3 weight 0.11000E+01 volume 0.11084E-02 ppm1 6.949 ppm2 1.225 CV 1
ASSI { 589}
(( segid "PX05" and resid 103 and name HH2 ))
(( segid "PX14" and resid 56 and name HE2 ))
3.700 3.700 2.300 peak 589 spectrum 3 weight 0.11000E+01 volume 0.27106E-03 ppm1 6.847 ppm2 1.228 CV 1
ASSI { 590}
(( segid "PX05" and resid 103 and name HH2 ))
(( segid "PX14" and resid 56 and name HB2 ))
5.700 5.700 0.300 peak 590 spectrum 3 weight 0.11000E+01 volume 0.79042E-04 ppm1 6.848 ppm2 1.095 CV 1
ASSI { 593}
( segid "PX14" and resid 67 and name HE% )
(( segid "PX14" and resid 50 and name HB2 ))
3.600 3.600 2.400 peak 593 spectrum 3 weight 0.11000E+01 volume 0.12943E-02 ppm1 7.028 ppm2 1.707 CV 1
ASSI { 594}
(( segid "PX14" and resid 67 and name HZ ))
(( segid "PX14" and resid 50 and name HB2 ))
3.600 3.600 2.400 peak 594 spectrum 3 weight 0.11000E+01 volume 0.11732E-02 ppm1 6.914 ppm2 1.710 CV 1
ASSI { 595}
( segid "PX14" and resid 67 and name HD% )
(( segid "PX14" and resid 49 and name HB2 ))
3.400 3.400 2.600 peak 595 spectrum 3 weight 0.11000E+01 volume 0.25521E-02 ppm1 7.231 ppm2 1.615 CV 1
ASSI { 596}
( segid "PX14" and resid 67 and name HE% )
( segid "PX14" and resid 66 and name HB% )
3.400 3.400 2.600 peak 596 spectrum 3 weight 0.11000E+01 volume 0.41896E-03 ppm1 7.028 ppm2 1.306 CV 1
ASSI { 597}
( segid "PX14" and resid 67 and name HE% )
(( segid "PX14" and resid 50 and name HG1 ))
3.000 3.000 3.000 peak 597 spectrum 3 weight 0.11000E+01 volume 0.21249E-02 ppm1 7.029 ppm2 1.478 CV 1
ASSI { 607}
( segid "PX14" and resid 53 and name HD1%)
(( segid "PX14" and resid 56 and name HG1 ))
3.400 3.400 2.600 peak 607 spectrum 3 weight 0.11000E+01 volume 0.24645E-02 ppm1 0.717 ppm2 -0.089 CV 1
ASSI { 612}
( segid "PX05" and resid 108 and name HD1%)
(( segid "PX05" and resid 108 and name HG ))
2.300 2.300 3.700 peak 612 spectrum 3 weight 0.11000E+01 volume 0.69173E-02 ppm1 0.774 ppm2 1.988 CV 1
ASSI { 613}
( segid "PX05" and resid 108 and name HD2%)
(( segid "PX05" and resid 108 and name HG ))
2.300 2.300 3.700 peak 613 spectrum 3 weight 0.11000E+01 volume 0.69468E-02 ppm1 0.719 ppm2 1.989 CV 1
ASSI { 614}
( segid "PX05" and resid 108 and name HD2%)
(( segid "PX05" and resid 108 and name HB2 ))
3.100 3.100 2.900 peak 614 spectrum 3 weight 0.11000E+01 volume 0.52725E-02 ppm1 0.719 ppm2 1.445 CV 1
ASSI { 615}
( segid "PX05" and resid 108 and name HD1%)
(( segid "PX05" and resid 108 and name HB2 ))
2.400 2.400 3.600 peak 615 spectrum 3 weight 0.11000E+01 volume 0.80364E-02 ppm1 0.772 ppm2 1.446 CV 1
ASSI { 616}
( segid "PX05" and resid 108 and name HD1%)
(( segid "PX05" and resid 108 and name HB1 ))
2.500 2.500 3.500 peak 616 spectrum 3 weight 0.11000E+01 volume 0.62969E-02 ppm1 0.773 ppm2 1.777 CV 1
ASSI { 618}
( segid "PX05" and resid 108 and name HD2%)
(( segid "PX05" and resid 108 and name HA ))
2.400 2.400 3.600 peak 618 spectrum 3 weight 0.11000E+01 volume 0.55865E-02 ppm1 0.719 ppm2 3.924 CV 1
ASSI { 619}
( segid "PX05" and resid 108 and name HD1%)
( segid "PX14" and resid 41 and name HG1%)
2.700 2.700 3.300 peak 619 spectrum 3 weight 0.11000E+01 volume 0.17608E-02 ppm1 0.774 ppm2 0.486 CV 1
ASSI { 620}
( segid "PX05" and resid 108 and name HD2%)
( segid "PX14" and resid 41 and name HG1%)
2.500 2.500 3.500 peak 620 spectrum 3 weight 0.11000E+01 volume 0.24812E-02 ppm1 0.717 ppm2 0.487 CV 1
ASSI { 624}
(( segid "PX05" and resid 99 and name HA ))
( segid "PX05" and resid 99 and name HD1%)
2.200 2.200 3.800 peak 624 spectrum 3 weight 0.11000E+01 volume 0.16415E-01 ppm1 4.014 ppm2 0.906 CV 1
ASSI { 625}
(( segid "PX05" and resid 99 and name HA ))
( segid "PX05" and resid 99 and name HD2%)
3.100 3.100 2.900 peak 625 spectrum 3 weight 0.11000E+01 volume 0.22437E-02 ppm1 4.014 ppm2 0.744 CV 1
ASSI { 644}
( segid "PX14" and resid 48 and name HG2%)
( segid "PX05" and resid 107 and name HD% )
4.600 4.600 1.400 peak 644 spectrum 3 weight 0.11000E+01 volume 0.28421E-03 ppm1 1.378 ppm2 6.769 CV 1
ASSI { 658}
(( segid "PX14" and resid 35 and name HB1 ))
(( segid "PX14" and resid 35 and name HB2 ))
1.900 1.900 4.100 peak 658 spectrum 3 weight 0.11000E+01 volume 0.83967E-02 ppm1 3.548 ppm2 3.370 CV 1
ASSI { 670}
(( segid "PX14" and resid 65 and name HG2 ))
(( segid "PX14" and resid 65 and name HG1 ))
1.900 1.900 4.100 peak 670 spectrum 3 weight 0.11000E+01 volume 0.14323E-01 ppm1 2.480 ppm2 2.797 CV 1
ASSI { 672}
( segid "PX05" and resid 110 and name HB% )
(( segid "PX05" and resid 110 and name HA ))
2.500 2.500 3.500 peak 672 spectrum 3 weight 0.11000E+01 volume 0.59644E-02 ppm1 1.337 ppm2 4.214 CV 1
ASSI { 673}
( segid "PX05" and resid 109 and name HB% )
(( segid "PX05" and resid 109 and name HA ))
2.300 2.300 3.700 peak 673 spectrum 3 weight 0.11000E+01 volume 0.91199E-02 ppm1 1.401 ppm2 4.184 CV 1
ASSI { 674}
(( segid "PX14" and resid 24 and name HD2 ))
(( segid "PX14" and resid 24 and name HA ))
2.900 2.900 3.100 peak 674 spectrum 3 weight 0.11000E+01 volume 0.40358E-02 ppm1 3.559 ppm2 4.597 CV 1
ASSI { 675}
(( segid "PX14" and resid 24 and name HD1 ))
(( segid "PX14" and resid 24 and name HA ))
2.600 2.600 3.400 peak 675 spectrum 3 weight 0.11000E+01 volume 0.56544E-02 ppm1 3.882 ppm2 4.597 CV 1
ASSI { 682}
(( segid "PX14" and resid 24 and name HD2 ))
(( segid "PX14" and resid 24 and name HB1 ))
4.000 4.000 2.000 peak 682 spectrum 3 weight 0.11000E+01 volume 0.97318E-03 ppm1 3.556 ppm2 1.587 CV 1
ASSI { 685}
(( segid "PX05" and resid 102 and name HA ))
(( segid "PX05" and resid 102 and name HB2 ))
2.600 2.600 3.400 peak 685 spectrum 3 weight 0.11000E+01 volume 0.40046E-02 ppm1 4.564 ppm2 2.998 CV 1
ASSI { 686}
(( segid "PX05" and resid 102 and name HA ))
(( segid "PX05" and resid 102 and name HB1 ))
2.600 2.600 3.400 peak 686 spectrum 3 weight 0.11000E+01 volume 0.57939E-02 ppm1 4.561 ppm2 3.088 CV 1
ASSI { 691}
(( segid "PX05" and resid 102 and name HB1 ))
(( segid "PX05" and resid 99 and name HA ))
3.700 3.700 2.300 peak 691 spectrum 3 weight 0.11000E+01 volume 0.62602E-03 ppm1 3.066 ppm2 4.031 CV 1
ASSI { 692}
(( segid "PX05" and resid 102 and name HB2 ))
(( segid "PX05" and resid 99 and name HA ))
3.200 3.200 2.800 peak 692 spectrum 3 weight 0.11000E+01 volume 0.12539E-02 ppm1 2.977 ppm2 4.032 CV 1
ASSI { 693}
(( segid "PX14" and resid 67 and name HB2 ))
(( segid "PX14" and resid 64 and name HA ))
4.300 4.300 1.700 peak 693 spectrum 3 weight 0.11000E+01 volume 0.22273E-03 ppm1 2.990 ppm2 4.410 CV 1
ASSI { 694}
(( segid "PX14" and resid 67 and name HB1 ))
(( segid "PX14" and resid 64 and name HA ))
4.100 4.100 1.900 peak 694 spectrum 3 weight 0.11000E+01 volume 0.22406E-02 ppm1 3.256 ppm2 4.410 CV 1
ASSI { 696}
(( segid "PX05" and resid 103 and name HB1 ))
(( segid "PX05" and resid 103 and name HB2 ))
1.900 1.900 4.100 peak 696 spectrum 3 weight 0.11000E+01 volume 0.75835E-02 ppm1 3.385 ppm2 2.970 CV 1
ASSI { 697}
(( segid "PX05" and resid 103 and name HA ))
(( segid "PX05" and resid 103 and name HB2 ))
3.600 3.600 2.400 peak 697 spectrum 3 weight 0.11000E+01 volume 0.90213E-03 ppm1 4.726 ppm2 2.970 CV 1
ASSI { 704}
(( segid "PX05" and resid 107 and name HB1 ))
(( segid "PX05" and resid 107 and name HB2 ))
1.900 1.900 4.100 peak 704 spectrum 3 weight 0.11000E+01 volume 0.75969E-02 ppm1 2.871 ppm2 2.105 CV 1
ASSI { 705}
(( segid "PX05" and resid 107 and name HB2 ))
(( segid "PX05" and resid 107 and name HA ))
2.800 2.800 3.200 peak 705 spectrum 3 weight 0.11000E+01 volume 0.18671E-02 ppm1 2.085 ppm2 3.791 CV 1
ASSI { 706}
(( segid "PX05" and resid 107 and name HB1 ))
(( segid "PX05" and resid 107 and name HA ))
3.500 3.500 2.500 peak 706 spectrum 3 weight 0.11000E+01 volume 0.11523E-02 ppm1 2.871 ppm2 3.786 CV 1
ASSI { 707}
(( segid "PX05" and resid 107 and name HB1 ))
(( segid "PX05" and resid 104 and name HA ))
2.800 2.800 3.200 peak 707 spectrum 3 weight 0.11000E+01 volume 0.14309E-02 ppm1 2.870 ppm2 4.111 CV 1
ASSI { 708}
(( segid "PX05" and resid 107 and name HB2 ))
(( segid "PX05" and resid 104 and name HA ))
2.500 2.500 3.500 peak 708 spectrum 3 weight 0.11000E+01 volume 0.51499E-02 ppm1 2.079 ppm2 4.105 CV 1
ASSI { 713}
(( segid "PX05" and resid 107 and name HB1 ))
(( segid "PX14" and resid 35 and name HZ ))
4.700 4.700 1.300 peak 713 spectrum 3 weight 0.11000E+01 volume 0.54626E-03 ppm1 2.871 ppm2 5.606 CV 1
ASSI { 714}
(( segid "PX05" and resid 107 and name HB2 ))
(( segid "PX14" and resid 35 and name HZ ))
3.300 3.300 2.700 peak 714 spectrum 3 weight 0.11000E+01 volume 0.68697E-03 ppm1 2.083 ppm2 5.604 CV 1
ASSI { 715}
( segid "PX14" and resid 41 and name HG1%)
(( segid "PX14" and resid 35 and name HZ ))
4.100 4.100 1.900 peak 715 spectrum 3 weight 0.11000E+01 volume 0.28508E-03 ppm1 0.463 ppm2 5.605 CV 1
ASSI { 724}
( segid "PX14" and resid 36 and name HD1%)
(( segid "PX14" and resid 66 and name HA ))
4.100 4.100 1.900 peak 724 spectrum 3 weight 0.11000E+01 volume 0.56924E-03 ppm1 0.531 ppm2 3.884 CV 1
ASSI { 725}
( segid "PX14" and resid 36 and name HD1%)
(( segid "PX14" and resid 67 and name HA ))
3.600 3.600 2.400 peak 725 spectrum 3 weight 0.11000E+01 volume 0.56688E-03 ppm1 0.533 ppm2 3.956 CV 1
ASSI { 729}
( segid "PX14" and resid 36 and name HD1%)
(( segid "PX14" and resid 67 and name HB1 ))
3.000 3.000 3.000 peak 729 spectrum 3 weight 0.11000E+01 volume 0.48975E-02 ppm1 0.531 ppm2 3.282 CV 1
ASSI { 730}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 67 and name HE% )
3.800 3.800 2.200 peak 730 spectrum 3 weight 0.11000E+01 volume 0.73742E-03 ppm1 0.914 ppm2 7.050 CV 1
ASSI { 732}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 35 and name HE% )
3.700 3.700 2.300 peak 732 spectrum 3 weight 0.11000E+01 volume 0.54283E-03 ppm1 0.915 ppm2 6.613 CV 1
ASSI { 735}
(( segid "PX05" and resid 105 and name HB1 ))
(( segid "PX05" and resid 105 and name HA ))
2.900 2.900 3.100 peak 735 spectrum 3 weight 0.11000E+01 volume 0.39685E-02 ppm1 2.201 ppm2 3.977 CV 1
ASSI { 743}
(( segid "PX14" and resid 69 and name HG2 ))
(( segid "PX14" and resid 69 and name HG1 ))
1.700 1.700 4.300 peak 743 spectrum 3 weight 0.11000E+01 volume 0.22384E-01 ppm1 2.312 ppm2 2.587 CV 1
ASSI { 751}
(( segid "PX14" and resid 43 and name HG1 ))
(( segid "PX14" and resid 43 and name HG2 ))
1.900 1.900 4.100 peak 751 spectrum 3 weight 0.11000E+01 volume 0.11082E-01 ppm1 2.518 ppm2 2.356 CV 1
ASSI { 773}
( segid "PX14" and resid 53 and name HD2%)
(( segid "PX14" and resid 50 and name HA ))
4.600 4.600 1.400 peak 773 spectrum 3 weight 0.11000E+01 volume 0.27457E-03 ppm1 0.914 ppm2 3.890 CV 1
ASSI { 780}
( segid "PX05" and resid 108 and name HD2%)
(( segid "PX14" and resid 41 and name HA ))
2.900 2.900 3.100 peak 780 spectrum 3 weight 0.11000E+01 volume 0.12124E-02 ppm1 0.718 ppm2 3.316 CV 1
ASSI { 788}
( segid "PX14" and resid 33 and name HG2%)
(( segid "PX14" and resid 30 and name HA ))
3.300 3.300 2.700 peak 788 spectrum 3 weight 0.11000E+01 volume 0.95782E-03 ppm1 0.626 ppm2 3.961 CV 1
ASSI { 797}
(( segid "PX14" and resid 49 and name HB1 ))
( segid "PX14" and resid 36 and name HD1%)
3.700 3.700 2.300 peak 797 spectrum 3 weight 0.11000E+01 volume 0.62406E-03 ppm1 1.694 ppm2 0.554 CV 1
ASSI { 799}
(( segid "PX14" and resid 38 and name HB1 ))
( segid "PX14" and resid 41 and name HG2%)
3.000 3.000 3.000 peak 799 spectrum 3 weight 0.11000E+01 volume 0.14872E-02 ppm1 2.699 ppm2 -0.380 CV 1
ASSI { 800}
(( segid "PX05" and resid 105 and name HG2 ))
(( segid "PX05" and resid 105 and name HB1 ))
2.500 2.500 3.500 peak 800 spectrum 3 weight 0.11000E+01 volume 0.44703E-02 ppm1 2.441 ppm2 2.223 CV 1
ASSI { 801}
(( segid "PX05" and resid 105 and name HG1 ))
(( segid "PX05" and resid 105 and name HG2 ))
2.400 2.400 3.600 peak 801 spectrum 3 weight 0.11000E+01 volume 0.34023E-02 ppm1 2.536 ppm2 2.461 CV 1
ASSI { 802}
(( segid "PX05" and resid 105 and name HG1 ))
(( segid "PX05" and resid 105 and name HA ))
3.800 3.800 2.200 peak 802 spectrum 3 weight 0.11000E+01 volume 0.61027E-03 ppm1 2.540 ppm2 3.978 CV 1
ASSI { 803}
(( segid "PX05" and resid 105 and name HG2 ))
(( segid "PX05" and resid 105 and name HA ))
3.800 3.800 2.200 peak 803 spectrum 3 weight 0.11000E+01 volume 0.59070E-03 ppm1 2.443 ppm2 3.977 CV 1
ASSI { 809}
( segid "PX05" and resid 110 and name HB% )
(( segid "PX05" and resid 107 and name HA ))
4.800 4.800 1.200 peak 809 spectrum 3 weight 0.11000E+01 volume 0.11665E-03 ppm1 1.339 ppm2 3.785 CV 1
ASSI { 811}
(( segid "PX05" and resid 108 and name HB2 ))
(( segid "PX05" and resid 108 and name HA ))
2.700 2.700 3.300 peak 811 spectrum 3 weight 0.11000E+01 volume 0.57055E-02 ppm1 1.425 ppm2 3.921 CV 1
ASSI { 812}
(( segid "PX05" and resid 108 and name HB1 ))
(( segid "PX05" and resid 108 and name HA ))
2.900 2.900 3.100 peak 812 spectrum 3 weight 0.11000E+01 volume 0.15507E-02 ppm1 1.759 ppm2 3.922 CV 1
ASSI { 814}
(( segid "PX05" and resid 108 and name HG ))
(( segid "PX05" and resid 108 and name HB2 ))
3.800 3.800 2.200 peak 814 spectrum 3 weight 0.11000E+01 volume 0.27228E-03 ppm1 1.964 ppm2 1.450 CV 1
ASSI { 816}
(( segid "PX05" and resid 108 and name HB1 ))
(( segid "PX05" and resid 105 and name HA ))
4.000 4.000 2.000 peak 816 spectrum 3 weight 0.11000E+01 volume 0.10952E-02 ppm1 1.759 ppm2 3.976 CV 1
ASSI { 817}
(( segid "PX05" and resid 108 and name HB2 ))
(( segid "PX05" and resid 105 and name HA ))
3.600 3.600 2.400 peak 817 spectrum 3 weight 0.11000E+01 volume 0.44782E-03 ppm1 1.427 ppm2 3.978 CV 1
ASSI { 818}
(( segid "PX05" and resid 106 and name HB1 ))
(( segid "PX05" and resid 103 and name HA ))
4.500 4.500 1.500 peak 818 spectrum 3 weight 0.11000E+01 volume 0.73641E-03 ppm1 2.326 ppm2 4.745 CV 1
ASSI { 819}
(( segid "PX05" and resid 106 and name HB1 ))
(( segid "PX05" and resid 106 and name HA ))
2.500 2.500 3.500 peak 819 spectrum 3 weight 0.11000E+01 volume 0.47796E-02 ppm1 2.326 ppm2 4.011 CV 1
ASSI { 820}
(( segid "PX05" and resid 105 and name HB1 ))
(( segid "PX05" and resid 102 and name HA ))
3.000 3.000 3.000 peak 820 spectrum 3 weight 0.11000E+01 volume 0.13031E-02 ppm1 2.202 ppm2 4.575 CV 1
ASSI { 821}
(( segid "PX05" and resid 101 and name HB1 ))
(( segid "PX05" and resid 101 and name HA ))
2.800 2.800 3.200 peak 821 spectrum 3 weight 0.11000E+01 volume 0.37856E-02 ppm1 2.079 ppm2 4.262 CV 1
ASSI { 823}
( segid "PX05" and resid 104 and name HB% )
(( segid "PX05" and resid 104 and name HA ))
2.500 2.500 3.500 peak 823 spectrum 3 weight 0.11000E+01 volume 0.44754E-02 ppm1 1.546 ppm2 4.105 CV 1
ASSI { 824}
(( segid "PX05" and resid 98 and name HA ))
( segid "PX05" and resid 98 and name HB% )
2.400 2.400 3.600 peak 824 spectrum 3 weight 0.11000E+01 volume 0.75044E-02 ppm1 4.129 ppm2 1.362 CV 1
ASSI { 825}
(( segid "PX05" and resid 101 and name HB1 ))
(( segid "PX05" and resid 98 and name HA ))
3.500 3.500 2.500 peak 825 spectrum 3 weight 0.11000E+01 volume 0.74527E-03 ppm1 2.079 ppm2 4.150 CV 1
ASSI { 826}
(( segid "PX05" and resid 103 and name HB2 ))
(( segid "PX05" and resid 100 and name HA ))
3.600 3.600 2.400 peak 826 spectrum 3 weight 0.11000E+01 volume 0.41666E-03 ppm1 2.942 ppm2 3.576 CV 1
ASSI { 827}
(( segid "PX05" and resid 97 and name HA ))
( segid "PX05" and resid 97 and name HD2%)
2.700 2.700 3.300 peak 827 spectrum 3 weight 0.11000E+01 volume 0.35212E-02 ppm1 4.083 ppm2 0.782 CV 1
ASSI { 828}
( segid "PX05" and resid 95 and name HB% )
(( segid "PX05" and resid 95 and name HA ))
2.700 2.700 3.300 peak 828 spectrum 3 weight 0.11000E+01 volume 0.39327E-02 ppm1 1.217 ppm2 4.140 CV 1
ASSI { 840}
(( segid "PX05" and resid 100 and name HB1 ))
( segid "PX14" and resid 31 and name HG2%)
3.300 3.300 2.700 peak 840 spectrum 3 weight 0.11000E+01 volume 0.14256E-02 ppm1 3.876 ppm2 -0.090 CV 1
ASSI { 847}
(( segid "PX14" and resid 37 and name HA ))
(( segid "PX14" and resid 38 and name HB1 ))
3.800 3.800 2.200 peak 847 spectrum 3 weight 0.11000E+01 volume 0.15996E-02 ppm1 3.944 ppm2 2.727 CV 1
ASSI { 853}
(( segid "PX14" and resid 35 and name HZ ))
( segid "PX14" and resid 53 and name HD1%)
4.900 4.900 1.100 peak 853 spectrum 3 weight 0.11000E+01 volume 0.23772E-03 ppm1 5.582 ppm2 0.725 CV 1
ASSI { 856}
(( segid "PX14" and resid 35 and name HZ ))
( segid "PX05" and resid 104 and name HB% )
6.000 6.000 0.000 peak 856 spectrum 3 weight 0.11000E+01 volume 0.46695E-04 ppm1 5.583 ppm2 1.558 CV 1
ASSI { 858}
(( segid "PX14" and resid 35 and name HZ ))
(( segid "PX05" and resid 107 and name HA ))
6.000 6.000 0.000 peak 858 spectrum 3 weight 0.11000E+01 volume 0.48943E-04 ppm1 5.582 ppm2 3.779 CV 1
ASSI { 860}
( segid "PX14" and resid 31 and name HG2%)
(( segid "PX14" and resid 28 and name HA ))
4.400 4.400 1.600 peak 860 spectrum 3 weight 0.11000E+01 volume 0.38939E-03 ppm1 -0.114 ppm2 4.123 CV 1
ASSI { 861}
(( segid "PX14" and resid 33 and name HA ))
( segid "PX14" and resid 36 and name HD1%)
2.600 2.600 3.400 peak 861 spectrum 3 weight 0.11000E+01 volume 0.44130E-02 ppm1 3.264 ppm2 0.559 CV 1
ASSI { 871}
(( segid "PX14" and resid 70 and name HA ))
(( segid "PX14" and resid 33 and name HA ))
3.600 3.600 2.400 peak 871 spectrum 3 weight 0.11000E+01 volume 0.95534E-03 ppm1 4.236 ppm2 3.298 CV 1
ASSI { 888}
(( segid "PX14" and resid 40 and name HD2 ))
(( segid "PX14" and resid 40 and name HG2 ))
3.100 3.100 2.900 peak 888 spectrum 3 weight 0.11000E+01 volume 0.16560E-02 ppm1 3.118 ppm2 1.583 CV 1
ASSI { 889}
(( segid "PX14" and resid 40 and name HD1 ))
(( segid "PX14" and resid 40 and name HG2 ))
2.900 2.900 3.100 peak 889 spectrum 3 weight 0.11000E+01 volume 0.19656E-02 ppm1 3.184 ppm2 1.583 CV 1
ASSI { 890}
(( segid "PX14" and resid 40 and name HG1 ))
(( segid "PX14" and resid 40 and name HB1 ))
1.800 1.800 4.200 peak 890 spectrum 3 weight 0.11000E+01 volume 0.82243E-01 ppm1 1.743 ppm2 1.857 CV 1
ASSI { 891}
(( segid "PX14" and resid 40 and name HG1 ))
(( segid "PX14" and resid 40 and name HG2 ))
1.800 0.400 0.400 peak 891 spectrum 3 weight 0.11000E+01 volume 0.12651E-01 ppm1 1.742 ppm2 1.587 CV 1
ASSI { 897}
(( segid "PX14" and resid 38 and name HA ))
( segid "PX14" and resid 41 and name HG1%)
5.700 5.700 0.300 peak 897 spectrum 3 weight 0.11000E+01 volume 0.15889E-03 ppm1 4.288 ppm2 0.485 CV 1
ASSI { 898}
(( segid "PX14" and resid 35 and name HA ))
( segid "PX14" and resid 41 and name HG1%)
4.100 4.100 1.900 peak 898 spectrum 3 weight 0.11000E+01 volume 0.38130E-03 ppm1 4.236 ppm2 0.486 CV 1
ASSI { 919}
(( segid "PX05" and resid 100 and name HA ))
( segid "PX05" and resid 99 and name HD1%)
3.500 3.500 2.500 peak 919 spectrum 3 weight 0.11000E+01 volume 0.15939E-02 ppm1 3.556 ppm2 0.916 CV 1
ASSI { 920}
(( segid "PX05" and resid 100 and name HA ))
( segid "PX05" and resid 99 and name HD2%)
5.100 5.100 0.900 peak 920 spectrum 3 weight 0.11000E+01 volume 0.16005E-03 ppm1 3.555 ppm2 0.742 CV 1
ASSI { 926}
(( segid "PX05" and resid 103 and name HZ3 ))
(( segid "PX14" and resid 35 and name HB1 ))
4.600 4.600 1.400 peak 926 spectrum 3 weight 0.11000E+01 volume 0.27165E-03 ppm1 6.338 ppm2 3.571 CV 1
ASSI { 928}
(( segid "PX05" and resid 103 and name HZ3 ))
(( segid "PX14" and resid 31 and name HA ))
3.300 3.300 2.700 peak 928 spectrum 3 weight 0.11000E+01 volume 0.49739E-03 ppm1 6.339 ppm2 3.850 CV 1
ASSI { 929}
(( segid "PX14" and resid 42 and name HA ))
( segid "PX14" and resid 41 and name HG2%)
4.100 4.100 1.900 peak 929 spectrum 3 weight 0.11000E+01 volume 0.74641E-03 ppm1 3.805 ppm2 -0.379 CV 1
ASSI { 930}
(( segid "PX14" and resid 49 and name HA ))
( segid "PX14" and resid 41 and name HG2%)
4.900 4.900 1.100 peak 930 spectrum 3 weight 0.11000E+01 volume 0.37707E-03 ppm1 3.933 ppm2 -0.381 CV 1
ASSI { 933}
(( segid "PX05" and resid 103 and name HH2 ))
(( segid "PX14" and resid 28 and name HA ))
3.900 3.900 2.100 peak 933 spectrum 3 weight 0.11000E+01 volume 0.42017E-03 ppm1 6.847 ppm2 4.128 CV 1
ASSI { 934}
(( segid "PX05" and resid 103 and name HH2 ))
(( segid "PX14" and resid 32 and name HA ))
4.500 4.500 1.500 peak 934 spectrum 3 weight 0.11000E+01 volume 0.39285E-03 ppm1 6.846 ppm2 4.216 CV 1
ASSI { 939}
( segid "PX14" and resid 35 and name HE% )
(( segid "PX14" and resid 52 and name HB1 ))
3.300 3.300 2.700 peak 939 spectrum 3 weight 0.11000E+01 volume 0.72018E-03 ppm1 6.591 ppm2 3.509 CV 1
ASSI { 940}
( segid "PX14" and resid 35 and name HE% )
(( segid "PX14" and resid 52 and name HB2 ))
3.700 3.700 2.300 peak 940 spectrum 3 weight 0.11000E+01 volume 0.13876E-02 ppm1 6.590 ppm2 3.017 CV 1
ASSI { 941}
(( segid "PX14" and resid 53 and name HB2 ))
(( segid "PX14" and resid 53 and name HA ))
3.100 1.200 1.200 peak 941 spectrum 3 weight 0.11000E+01 volume 0.20068E-02 ppm1 2.060 ppm2 3.471 CV 1
ASSI { 942}
(( segid "PX14" and resid 53 and name HB2 ))
(( segid "PX14" and resid 53 and name HG ))
3.200 1.300 1.300 peak 942 spectrum 3 weight 0.11000E+01 volume 0.82457E-03 ppm1 2.058 ppm2 1.224 CV 1
ASSI { 943}
(( segid "PX14" and resid 53 and name HB2 ))
( segid "PX14" and resid 53 and name HD1%)
2.800 1.000 1.000 peak 943 spectrum 3 weight 0.11000E+01 volume 0.27425E-02 ppm1 2.060 ppm2 0.734 CV 1
ASSI { 944}
(( segid "PX14" and resid 53 and name HN ))
(( segid "PX14" and resid 52 and name HB2 ))
3.800 3.800 2.200 peak 944 spectrum 3 weight 0.11000E+01 volume 0.17741E-02 ppm1 7.460 ppm2 3.020 CV 1
ASSI { 945}
(( segid "PX14" and resid 53 and name HN ))
(( segid "PX14" and resid 52 and name HB1 ))
2.800 2.800 3.200 peak 945 spectrum 3 weight 0.11000E+01 volume 0.15120E-02 ppm1 7.454 ppm2 3.512 CV 1
ASSI { 946}
(( segid "PX14" and resid 53 and name HN ))
(( segid "PX14" and resid 50 and name HA ))
3.700 3.700 2.300 peak 946 spectrum 3 weight 0.11000E+01 volume 0.50808E-03 ppm1 7.460 ppm2 3.891 CV 1
ASSI { 947}
(( segid "PX14" and resid 53 and name HN ))
(( segid "PX14" and resid 52 and name HA ))
4.300 4.300 1.700 peak 947 spectrum 3 weight 0.11000E+01 volume 0.29231E-03 ppm1 7.460 ppm2 4.097 CV 1
ASSI { 949}
(( segid "PX14" and resid 53 and name HN ))
(( segid "PX14" and resid 53 and name HA ))
2.800 2.800 3.200 peak 949 spectrum 3 weight 0.11000E+01 volume 0.22078E-02 ppm1 7.460 ppm2 3.472 CV 1
ASSI { 950}
(( segid "PX14" and resid 53 and name HN ))
(( segid "PX14" and resid 53 and name HB1 ))
3.600 1.600 1.600 peak 950 spectrum 3 weight 0.11000E+01 volume 0.19815E-02 ppm1 7.459 ppm2 2.002 CV 1
ASSI { 951}
(( segid "PX14" and resid 53 and name HN ))
(( segid "PX14" and resid 53 and name HB2 ))
2.500 2.500 3.500 peak 951 spectrum 3 weight 0.11000E+01 volume 0.33533E-02 ppm1 7.459 ppm2 2.083 CV 1
ASSI { 952}
(( segid "PX14" and resid 54 and name HN ))
(( segid "PX14" and resid 53 and name HB2 ))
3.600 3.600 2.400 peak 952 spectrum 3 weight 0.11000E+01 volume 0.40838E-03 ppm1 8.083 ppm2 2.083 CV 1
ASSI { 953}
(( segid "PX14" and resid 54 and name HN ))
(( segid "PX14" and resid 53 and name HB1 ))
3.700 1.700 1.700 peak 953 spectrum 3 weight 0.11000E+01 volume 0.11152E-02 ppm1 8.083 ppm2 2.002 CV 1
ASSI { 954}
(( segid "PX14" and resid 54 and name HN ))
(( segid "PX14" and resid 54 and name HB1 ))
2.700 2.700 3.300 peak 954 spectrum 3 weight 0.11000E+01 volume 0.54229E-02 ppm1 8.084 ppm2 1.784 CV 1
ASSI { 955}
( segid "PX14" and resid 52 and name HE% )
(( segid "PX05" and resid 106 and name HG1 ))
5.700 4.100 0.300 peak 955 spectrum 3 weight 0.11000E+01 volume 0.13441E-03 ppm1 6.894 ppm2 2.534 CV 1
ASSI { 956}
(( segid "PX14" and resid 54 and name HN ))
(( segid "PX14" and resid 54 and name HG1 ))
3.800 3.800 2.200 peak 956 spectrum 3 weight 0.11000E+01 volume 0.76063E-03 ppm1 8.083 ppm2 1.485 CV 1
ASSI { 957}
(( segid "PX14" and resid 53 and name HN ))
(( segid "PX14" and resid 56 and name HE2 ))
3.300 3.300 2.700 peak 957 spectrum 3 weight 0.11000E+01 volume 0.16383E-02 ppm1 7.459 ppm2 1.223 CV 1
ASSI { 958}
(( segid "PX14" and resid 54 and name HN ))
( segid "PX14" and resid 63 and name HG2%)
3.300 3.300 2.700 peak 958 spectrum 3 weight 0.11000E+01 volume 0.16242E-02 ppm1 8.084 ppm2 0.643 CV 1
ASSI { 961}
(( segid "PX14" and resid 54 and name HN ))
(( segid "PX14" and resid 54 and name HA ))
3.100 3.100 2.900 peak 961 spectrum 3 weight 0.11000E+01 volume 0.16200E-02 ppm1 8.083 ppm2 4.151 CV 1
ASSI { 963}
(( segid "PX14" and resid 67 and name HN ))
( segid "PX14" and resid 67 and name HD% )
3.500 3.500 2.500 peak 963 spectrum 3 weight 0.11000E+01 volume 0.81075E-03 ppm1 9.058 ppm2 7.256 CV 1
ASSI { 964}
(( segid "PX14" and resid 67 and name HN ))
(( segid "PX14" and resid 64 and name HA ))
3.600 3.600 2.400 peak 964 spectrum 3 weight 0.11000E+01 volume 0.67905E-03 ppm1 9.058 ppm2 4.410 CV 1
ASSI { 965}
(( segid "PX14" and resid 67 and name HN ))
(( segid "PX14" and resid 67 and name HA ))
3.200 3.200 2.800 peak 965 spectrum 3 weight 0.11000E+01 volume 0.11063E-02 ppm1 9.058 ppm2 3.953 CV 1
ASSI { 966}
(( segid "PX14" and resid 67 and name HN ))
(( segid "PX14" and resid 66 and name HA ))
3.600 3.600 2.400 peak 966 spectrum 3 weight 0.11000E+01 volume 0.81733E-03 ppm1 9.058 ppm2 3.887 CV 1
ASSI { 967}
(( segid "PX14" and resid 67 and name HN ))
(( segid "PX14" and resid 67 and name HB1 ))
3.300 3.300 2.700 peak 967 spectrum 3 weight 0.11000E+01 volume 0.37751E-02 ppm1 9.058 ppm2 3.278 CV 1
ASSI { 968}
(( segid "PX14" and resid 67 and name HN ))
(( segid "PX14" and resid 67 and name HB2 ))
2.700 2.700 3.300 peak 968 spectrum 3 weight 0.11000E+01 volume 0.24920E-02 ppm1 9.058 ppm2 3.007 CV 1
ASSI { 969}
(( segid "PX14" and resid 67 and name HN ))
( segid "PX14" and resid 66 and name HB% )
3.100 3.100 2.900 peak 969 spectrum 3 weight 0.11000E+01 volume 0.13774E-02 ppm1 9.058 ppm2 1.315 CV 1
ASSI { 970}
(( segid "PX14" and resid 67 and name HN ))
( segid "PX14" and resid 36 and name HD2%)
4.000 4.000 2.000 peak 970 spectrum 3 weight 0.11000E+01 volume 0.54820E-03 ppm1 9.057 ppm2 0.176 CV 1
ASSI { 974}
(( segid "PX14" and resid 52 and name HN ))
(( segid "PX14" and resid 52 and name HB2 ))
3.200 3.200 2.800 peak 974 spectrum 3 weight 0.11000E+01 volume 0.90468E-03 ppm1 7.950 ppm2 3.018 CV 1
ASSI { 975}
(( segid "PX14" and resid 52 and name HN ))
(( segid "PX14" and resid 52 and name HB1 ))
3.500 3.500 2.500 peak 975 spectrum 3 weight 0.11000E+01 volume 0.71166E-03 ppm1 7.951 ppm2 3.511 CV 1
ASSI { 976}
(( segid "PX14" and resid 52 and name HN ))
(( segid "PX14" and resid 52 and name HA ))
4.100 4.100 1.900 peak 976 spectrum 3 weight 0.11000E+01 volume 0.32637E-03 ppm1 7.952 ppm2 4.099 CV 1
ASSI { 978}
(( segid "PX14" and resid 65 and name HN ))
(( segid "PX14" and resid 65 and name HB1 ))
3.100 3.100 2.900 peak 978 spectrum 3 weight 0.11000E+01 volume 0.19038E-02 ppm1 8.039 ppm2 2.155 CV 1
ASSI { 984}
(( segid "PX14" and resid 33 and name HN ))
( segid "PX14" and resid 33 and name HG1%)
2.900 2.900 3.100 peak 984 spectrum 3 weight 0.11000E+01 volume 0.21033E-02 ppm1 8.883 ppm2 1.144 CV 1
ASSI { 986}
(( segid "PX14" and resid 33 and name HN ))
(( segid "PX14" and resid 30 and name HA ))
3.600 3.600 2.400 peak 986 spectrum 3 weight 0.11000E+01 volume 0.73936E-03 ppm1 8.883 ppm2 3.961 CV 1
ASSI { 987}
(( segid "PX14" and resid 33 and name HN ))
(( segid "PX14" and resid 33 and name HA ))
3.300 3.300 2.700 peak 987 spectrum 3 weight 0.11000E+01 volume 0.95192E-03 ppm1 8.883 ppm2 3.296 CV 1
ASSI { 988}
(( segid "PX14" and resid 33 and name HN ))
(( segid "PX14" and resid 33 and name HB ))
2.900 2.900 3.100 peak 988 spectrum 3 weight 0.11000E+01 volume 0.37090E-02 ppm1 8.883 ppm2 2.136 CV 1
ASSI { 989}
(( segid "PX14" and resid 33 and name HN ))
( segid "PX14" and resid 32 and name HB% )
3.100 3.100 2.900 peak 989 spectrum 3 weight 0.11000E+01 volume 0.12960E-02 ppm1 8.883 ppm2 1.598 CV 1
ASSI { 990}
(( segid "PX14" and resid 33 and name HN ))
( segid "PX14" and resid 66 and name HB% )
3.600 3.600 2.400 peak 990 spectrum 3 weight 0.11000E+01 volume 0.80793E-03 ppm1 8.883 ppm2 1.318 CV 1
ASSI { 991}
(( segid "PX14" and resid 33 and name HN ))
( segid "PX14" and resid 29 and name HG2%)
3.800 3.800 2.200 peak 991 spectrum 3 weight 0.11000E+01 volume 0.54927E-03 ppm1 8.883 ppm2 0.748 CV 1
ASSI { 992}
(( segid "PX14" and resid 33 and name HN ))
( segid "PX14" and resid 33 and name HG2%)
3.300 3.300 2.700 peak 992 spectrum 3 weight 0.11000E+01 volume 0.92293E-03 ppm1 8.883 ppm2 0.648 CV 1
ASSI { 993}
(( segid "PX14" and resid 33 and name HN ))
( segid "PX14" and resid 36 and name HD2%)
5.400 5.400 0.600 peak 993 spectrum 3 weight 0.11000E+01 volume 0.11280E-03 ppm1 8.883 ppm2 0.175 CV 1
ASSI { 997}
(( segid "PX14" and resid 35 and name HN ))
( segid "PX14" and resid 35 and name HD% )
5.000 3.100 1.000 peak 997 spectrum 3 weight 0.11000E+01 volume 0.41144E-03 ppm1 7.980 ppm2 7.219 CV 1
ASSI { 998}
(( segid "PX14" and resid 34 and name HN ))
(( segid "PX14" and resid 33 and name HB ))
3.100 3.100 2.900 peak 998 spectrum 3 weight 0.11000E+01 volume 0.24392E-02 ppm1 7.055 ppm2 2.135 CV 1
ASSI { 1000}
(( segid "PX14" and resid 34 and name HN ))
(( segid "PX14" and resid 34 and name HG2 ))
3.200 3.200 2.800 peak 1000 spectrum 3 weight 0.11000E+01 volume 0.22955E-02 ppm1 7.055 ppm2 1.455 CV 1
ASSI { 1001}
(( segid "PX14" and resid 32 and name HN ))
( segid "PX14" and resid 32 and name HB% )
3.100 3.100 2.900 peak 1001 spectrum 3 weight 0.11000E+01 volume 0.13684E-02 ppm1 8.212 ppm2 1.598 CV 1
ASSI { 1002}
(( segid "PX14" and resid 32 and name HN ))
(( segid "PX14" and resid 31 and name HA ))
3.600 3.600 2.400 peak 1002 spectrum 3 weight 0.11000E+01 volume 0.73762E-03 ppm1 8.212 ppm2 3.848 CV 1
ASSI { 1003}
(( segid "PX14" and resid 32 and name HN ))
(( segid "PX14" and resid 32 and name HA ))
3.700 3.700 2.300 peak 1003 spectrum 3 weight 0.11000E+01 volume 0.46495E-03 ppm1 8.212 ppm2 4.220 CV 1
ASSI { 1004}
(( segid "PX14" and resid 33 and name HN ))
(( segid "PX14" and resid 32 and name HA ))
4.500 4.500 1.500 peak 1004 spectrum 3 weight 0.11000E+01 volume 0.18546E-03 ppm1 8.883 ppm2 4.217 CV 1
ASSI { 1006}
(( segid "PX14" and resid 66 and name HN ))
(( segid "PX14" and resid 66 and name HA ))
3.200 3.200 2.800 peak 1006 spectrum 3 weight 0.11000E+01 volume 0.11998E-02 ppm1 8.559 ppm2 3.886 CV 1
ASSI { 1008}
(( segid "PX14" and resid 66 and name HN ))
(( segid "PX14" and resid 65 and name HB1 ))
2.900 2.900 3.100 peak 1008 spectrum 3 weight 0.11000E+01 volume 0.19060E-02 ppm1 8.559 ppm2 2.154 CV 1
ASSI { 1009}
(( segid "PX14" and resid 65 and name HB2 ))
(( segid "PX14" and resid 65 and name HG1 ))
3.000 1.200 1.200 peak 1009 spectrum 3 weight 0.11000E+01 volume 0.11751E-02 ppm1 2.064 ppm2 2.797 CV 1
ASSI { 1010}
(( segid "PX14" and resid 65 and name HG2 ))
(( segid "PX14" and resid 65 and name HB2 ))
3.100 3.100 2.900 peak 1010 spectrum 3 weight 0.11000E+01 volume 0.23091E-02 ppm1 2.482 ppm2 2.084 CV 1
ASSI { 1011}
(( segid "PX14" and resid 66 and name HN ))
(( segid "PX14" and resid 65 and name HB2 ))
3.400 3.400 2.600 peak 1011 spectrum 3 weight 0.11000E+01 volume 0.15219E-02 ppm1 8.559 ppm2 2.086 CV 1
ASSI { 1012}
(( segid "PX14" and resid 65 and name HN ))
(( segid "PX14" and resid 65 and name HA ))
3.200 1.300 1.300 peak 1012 spectrum 3 weight 0.11000E+01 volume 0.12938E-02 ppm1 8.038 ppm2 4.097 CV 1
ASSI { 1013}
(( segid "PX14" and resid 65 and name HN ))
(( segid "PX14" and resid 65 and name HB2 ))
3.300 3.300 2.700 peak 1013 spectrum 3 weight 0.11000E+01 volume 0.79264E-03 ppm1 8.038 ppm2 2.087 CV 1
ASSI { 1014}
(( segid "PX14" and resid 65 and name HN ))
(( segid "PX14" and resid 64 and name HB1 ))
3.200 3.200 2.800 peak 1014 spectrum 3 weight 0.11000E+01 volume 0.11335E-02 ppm1 8.039 ppm2 2.839 CV 1
ASSI { 1015}
(( segid "PX14" and resid 65 and name HN ))
(( segid "PX14" and resid 65 and name HG1 ))
3.600 3.600 2.400 peak 1015 spectrum 3 weight 0.11000E+01 volume 0.18667E-02 ppm1 8.039 ppm2 2.800 CV 1
ASSI { 1016}
(( segid "PX14" and resid 65 and name HN ))
(( segid "PX14" and resid 64 and name HA ))
4.100 4.100 1.900 peak 1016 spectrum 3 weight 0.11000E+01 volume 0.31388E-03 ppm1 8.040 ppm2 4.410 CV 1
ASSI { 1017}
(( segid "PX14" and resid 64 and name HN ))
(( segid "PX14" and resid 64 and name HA ))
3.300 3.300 2.700 peak 1017 spectrum 3 weight 0.11000E+01 volume 0.10487E-02 ppm1 8.330 ppm2 4.410 CV 1
ASSI { 1018}
(( segid "PX14" and resid 64 and name HN ))
(( segid "PX14" and resid 63 and name HA ))
4.000 4.000 2.000 peak 1018 spectrum 3 weight 0.11000E+01 volume 0.40126E-03 ppm1 8.333 ppm2 3.286 CV 1
ASSI { 1019}
(( segid "PX14" and resid 65 and name HN ))
(( segid "PX14" and resid 64 and name HB2 ))
5.500 5.500 0.500 peak 1019 spectrum 3 weight 0.11000E+01 volume 0.12497E-03 ppm1 8.038 ppm2 2.636 CV 1
ASSI { 1020}
(( segid "PX14" and resid 64 and name HN ))
(( segid "PX14" and resid 64 and name HB1 ))
3.100 3.100 2.900 peak 1020 spectrum 3 weight 0.11000E+01 volume 0.18891E-02 ppm1 8.330 ppm2 2.840 CV 1
ASSI { 1021}
(( segid "PX14" and resid 64 and name HN ))
(( segid "PX14" and resid 64 and name HB2 ))
3.100 3.100 2.900 peak 1021 spectrum 3 weight 0.11000E+01 volume 0.13742E-02 ppm1 8.330 ppm2 2.636 CV 1
ASSI { 1023}
(( segid "PX14" and resid 63 and name HN ))
(( segid "PX14" and resid 63 and name HA ))
3.000 3.000 3.000 peak 1023 spectrum 3 weight 0.11000E+01 volume 0.17178E-02 ppm1 8.544 ppm2 3.284 CV 1
ASSI { 1026}
(( segid "PX14" and resid 63 and name HN ))
(( segid "PX14" and resid 60 and name HA ))
3.500 3.500 2.500 peak 1026 spectrum 3 weight 0.11000E+01 volume 0.75366E-03 ppm1 8.542 ppm2 4.183 CV 1
ASSI { 1027}
(( segid "PX14" and resid 66 and name HN ))
(( segid "PX14" and resid 62 and name HA ))
4.100 4.100 1.900 peak 1027 spectrum 3 weight 0.11000E+01 volume 0.36907E-03 ppm1 8.555 ppm2 3.825 CV 1
ASSI { 1028}
(( segid "PX14" and resid 62 and name HN ))
(( segid "PX14" and resid 62 and name HA ))
3.400 3.400 2.600 peak 1028 spectrum 3 weight 0.11000E+01 volume 0.88462E-03 ppm1 7.737 ppm2 3.825 CV 1
ASSI { 1029}
(( segid "PX14" and resid 62 and name HN ))
(( segid "PX14" and resid 61 and name HA ))
4.400 4.400 1.600 peak 1029 spectrum 3 weight 0.11000E+01 volume 0.22900E-03 ppm1 7.737 ppm2 4.053 CV 1
ASSI { 1039}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 59 and name HB ))
3.900 3.900 2.100 peak 1039 spectrum 3 weight 0.11000E+01 volume 0.48253E-03 ppm1 9.180 ppm2 4.667 CV 1
ASSI { 1040}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 59 and name HA ))
3.200 3.200 2.800 peak 1040 spectrum 3 weight 0.11000E+01 volume 0.10441E-02 ppm1 9.180 ppm2 4.273 CV 1
ASSI { 1041}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 58 and name HA ))
2.500 2.500 3.500 peak 1041 spectrum 3 weight 0.11000E+01 volume 0.44379E-02 ppm1 9.180 ppm2 4.408 CV 1
ASSI { 1045}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 58 and name HG ))
3.400 3.400 2.600 peak 1045 spectrum 3 weight 0.11000E+01 volume 0.26804E-02 ppm1 9.180 ppm2 1.667 CV 1
ASSI { 1046}
(( segid "PX14" and resid 59 and name HN ))
( segid "PX14" and resid 59 and name HG2%)
2.700 2.700 3.300 peak 1046 spectrum 3 weight 0.11000E+01 volume 0.31103E-02 ppm1 9.180 ppm2 1.219 CV 1
ASSI { 1047}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 58 and name HB2 ))
4.600 4.600 1.400 peak 1047 spectrum 3 weight 0.11000E+01 volume 0.48703E-03 ppm1 9.180 ppm2 1.111 CV 1
ASSI { 1048}
(( segid "PX14" and resid 59 and name HN ))
( segid "PX14" and resid 58 and name HD2%)
4.800 4.800 1.200 peak 1048 spectrum 3 weight 0.11000E+01 volume 0.32397E-03 ppm1 9.180 ppm2 0.904 CV 1
ASSI { 1049}
(( segid "PX14" and resid 59 and name HN ))
( segid "PX14" and resid 58 and name HD1%)
4.900 4.900 1.100 peak 1049 spectrum 3 weight 0.11000E+01 volume 0.41544E-03 ppm1 9.180 ppm2 0.712 CV 1
ASSI { 1050}
(( segid "PX14" and resid 36 and name HN ))
(( segid "PX14" and resid 36 and name HB2 ))
2.800 2.800 3.200 peak 1050 spectrum 3 weight 0.11000E+01 volume 0.16080E-02 ppm1 8.347 ppm2 1.231 CV 1
ASSI { 1051}
(( segid "PX14" and resid 36 and name HN ))
( segid "PX14" and resid 36 and name HD1%)
3.500 3.500 2.500 peak 1051 spectrum 3 weight 0.11000E+01 volume 0.10159E-02 ppm1 8.347 ppm2 0.556 CV 1
ASSI { 1052}
(( segid "PX14" and resid 36 and name HN ))
( segid "PX14" and resid 36 and name HD2%)
3.900 3.900 2.100 peak 1052 spectrum 3 weight 0.11000E+01 volume 0.80122E-03 ppm1 8.347 ppm2 0.177 CV 1
ASSI { 1053}
(( segid "PX14" and resid 64 and name HN ))
( segid "PX14" and resid 63 and name HD1%)
4.600 4.600 1.400 peak 1053 spectrum 3 weight 0.11000E+01 volume 0.41033E-03 ppm1 8.331 ppm2 0.801 CV 1
ASSI { 1054}
(( segid "PX14" and resid 36 and name HN ))
( segid "PX14" and resid 41 and name HG2%)
5.300 5.300 0.700 peak 1054 spectrum 3 weight 0.11000E+01 volume 0.11685E-03 ppm1 8.348 ppm2 -0.379 CV 1
ASSI { 1055}
(( segid "PX14" and resid 32 and name HN ))
( segid "PX14" and resid 31 and name HG2%)
5.200 3.400 0.800 peak 1055 spectrum 3 weight 0.11000E+01 volume 0.15161E-03 ppm1 8.213 ppm2 -0.093 CV 1
ASSI { 1056}
(( segid "PX14" and resid 35 and name HN ))
(( segid "PX14" and resid 35 and name HB1 ))
2.700 2.700 3.300 peak 1056 spectrum 3 weight 0.11000E+01 volume 0.18802E-02 ppm1 7.980 ppm2 3.568 CV 1
ASSI { 1057}
(( segid "PX14" and resid 35 and name HN ))
(( segid "PX14" and resid 35 and name HB2 ))
3.200 3.200 2.800 peak 1057 spectrum 3 weight 0.11000E+01 volume 0.15567E-02 ppm1 7.980 ppm2 3.373 CV 1
ASSI { 1058}
(( segid "PX14" and resid 36 and name HN ))
(( segid "PX14" and resid 35 and name HB1 ))
3.000 3.000 3.000 peak 1058 spectrum 3 weight 0.11000E+01 volume 0.10730E-02 ppm1 8.347 ppm2 3.567 CV 1
ASSI { 1059}
(( segid "PX14" and resid 36 and name HN ))
(( segid "PX14" and resid 36 and name HA ))
3.100 3.100 2.900 peak 1059 spectrum 3 weight 0.11000E+01 volume 0.14594E-02 ppm1 8.347 ppm2 3.399 CV 1
ASSI { 1061}
(( segid "PX14" and resid 36 and name HN ))
(( segid "PX14" and resid 36 and name HB1 ))
3.600 3.600 2.400 peak 1061 spectrum 3 weight 0.11000E+01 volume 0.21156E-02 ppm1 8.347 ppm2 1.814 CV 1
ASSI { 1062}
( segid "PX14" and resid 67 and name HE% )
(( segid "PX14" and resid 50 and name HB1 ))
3.400 3.400 2.600 peak 1062 spectrum 3 weight 0.11000E+01 volume 0.17870E-02 ppm1 7.030 ppm2 1.879 CV 1
ASSI { 1064}
(( segid "PX14" and resid 36 and name HN ))
( segid "PX14" and resid 35 and name HD% )
3.700 1.700 1.700 peak 1064 spectrum 3 weight 0.11000E+01 volume 0.65713E-03 ppm1 8.348 ppm2 7.219 CV 1
ASSI { 1066}
(( segid "PX14" and resid 37 and name HN ))
(( segid "PX14" and resid 36 and name HA ))
4.100 4.100 1.900 peak 1066 spectrum 3 weight 0.11000E+01 volume 0.31275E-03 ppm1 7.334 ppm2 3.400 CV 1
ASSI { 1067}
(( segid "PX14" and resid 37 and name HN ))
(( segid "PX14" and resid 37 and name HA ))
3.200 3.200 2.800 peak 1067 spectrum 3 weight 0.11000E+01 volume 0.12357E-02 ppm1 7.334 ppm2 3.964 CV 1
ASSI { 1068}
(( segid "PX14" and resid 35 and name HZ ))
(( segid "PX14" and resid 52 and name HA ))
4.600 4.600 1.400 peak 1068 spectrum 3 weight 0.11000E+01 volume 0.36564E-03 ppm1 5.579 ppm2 4.097 CV 1
ASSI { 1069}
( segid "PX14" and resid 35 and name HE% )
(( segid "PX05" and resid 107 and name HA ))
4.900 4.900 1.100 peak 1069 spectrum 3 weight 0.11000E+01 volume 0.45877E-03 ppm1 6.589 ppm2 3.787 CV 1
ASSI { 1071}
(( segid "PX14" and resid 59 and name HN ))
(( segid "PX14" and resid 63 and name HN ))
4.100 2.100 1.900 peak 1071 spectrum 3 weight 0.11000E+01 volume 0.52257E-03 ppm1 9.181 ppm2 7.760 CV 1
ASSI { 1073}
(( segid "PX14" and resid 58 and name HN ))
(( segid "PX14" and resid 58 and name HA ))
2.900 2.900 3.100 peak 1073 spectrum 3 weight 0.11000E+01 volume 0.20164E-02 ppm1 7.401 ppm2 4.409 CV 1
ASSI { 1074}
(( segid "PX14" and resid 58 and name HN ))
(( segid "PX14" and resid 57 and name HA2 ))
3.600 3.600 2.400 peak 1074 spectrum 3 weight 0.11000E+01 volume 0.94373E-03 ppm1 7.399 ppm2 3.565 CV 1
ASSI { 1078}
(( segid "PX14" and resid 36 and name HN ))
(( segid "PX14" and resid 35 and name HA ))
3.700 3.700 2.300 peak 1078 spectrum 3 weight 0.11000E+01 volume 0.71152E-03 ppm1 8.347 ppm2 4.256 CV 1
ASSI { 1079}
(( segid "PX14" and resid 63 and name HN ))
(( segid "PX14" and resid 64 and name HA ))
4.400 4.400 1.600 peak 1079 spectrum 3 weight 0.11000E+01 volume 0.42856E-03 ppm1 8.544 ppm2 4.409 CV 1
ASSI { 1080}
(( segid "PX14" and resid 62 and name HN ))
(( segid "PX14" and resid 62 and name HB1 ))
3.400 3.400 2.600 peak 1080 spectrum 3 weight 0.11000E+01 volume 0.26050E-02 ppm1 7.736 ppm2 2.477 CV 1
ASSI { 1081}
(( segid "PX14" and resid 62 and name HN ))
(( segid "PX14" and resid 62 and name HG2 ))
3.800 3.800 2.200 peak 1081 spectrum 3 weight 0.11000E+01 volume 0.78620E-03 ppm1 7.737 ppm2 2.137 CV 1
ASSI { 1082}
(( segid "PX14" and resid 62 and name HN ))
(( segid "PX14" and resid 61 and name HB2 ))
3.500 3.500 2.500 peak 1082 spectrum 3 weight 0.11000E+01 volume 0.87919E-03 ppm1 7.738 ppm2 1.843 CV 1
ASSI { 1084}
(( segid "PX14" and resid 62 and name HN ))
(( segid "PX14" and resid 62 and name HB2 ))
2.800 2.800 3.200 peak 1084 spectrum 3 weight 0.11000E+01 volume 0.16542E-02 ppm1 7.737 ppm2 1.660 CV 1
ASSI { 1085}
(( segid "PX14" and resid 63 and name HN ))
(( segid "PX14" and resid 62 and name HB2 ))
3.500 3.500 2.500 peak 1085 spectrum 3 weight 0.11000E+01 volume 0.45434E-03 ppm1 8.543 ppm2 1.661 CV 1
ASSI { 1086}
(( segid "PX14" and resid 63 and name HN ))
(( segid "PX14" and resid 62 and name HB1 ))
4.000 4.000 2.000 peak 1086 spectrum 3 weight 0.11000E+01 volume 0.79250E-03 ppm1 8.543 ppm2 2.476 CV 1
ASSI { 1087}
(( segid "PX14" and resid 63 and name HN ))
(( segid "PX14" and resid 63 and name HB ))
2.300 2.300 3.700 peak 1087 spectrum 3 weight 0.11000E+01 volume 0.88415E-02 ppm1 8.542 ppm2 1.889 CV 1
ASSI { 1090}
( segid "PX14" and resid 41 and name HG2%)
(( segid "PX14" and resid 35 and name HZ ))
4.100 4.100 1.900 peak 1090 spectrum 3 weight 0.11000E+01 volume 0.55656E-03 ppm1 -0.400 ppm2 5.604 CV 1
ASSI { 1091}
(( segid "PX14" and resid 49 and name HA ))
(( segid "PX14" and resid 35 and name HZ ))
4.300 4.300 1.700 peak 1091 spectrum 3 weight 0.11000E+01 volume 0.26606E-03 ppm1 3.932 ppm2 5.601 CV 1
ASSI { 1092}
(( segid "PX05" and resid 104 and name HA ))
(( segid "PX14" and resid 35 and name HZ ))
4.600 4.600 1.400 peak 1092 spectrum 3 weight 0.11000E+01 volume 0.56262E-03 ppm1 4.086 ppm2 5.601 CV 1
ASSI { 1094}
(( segid "PX14" and resid 56 and name HN ))
(( segid "PX14" and resid 56 and name HD1 ))
6.000 6.000 0.000 peak 1094 spectrum 3 weight 0.11000E+01 volume 0.46494E-04 ppm1 6.945 ppm2 0.805 CV 1
ASSI { 1095}
(( segid "PX14" and resid 56 and name HN ))
(( segid "PX14" and resid 55 and name HB1 ))
3.400 3.400 2.600 peak 1095 spectrum 3 weight 0.11000E+01 volume 0.91689E-03 ppm1 6.947 ppm2 1.712 CV 1
ASSI { 1096}
(( segid "PX14" and resid 56 and name HN ))
(( segid "PX14" and resid 53 and name HA ))
4.200 4.200 1.800 peak 1096 spectrum 3 weight 0.11000E+01 volume 0.25234E-03 ppm1 6.949 ppm2 3.473 CV 1
ASSI { 1097}
(( segid "PX14" and resid 56 and name HN ))
(( segid "PX14" and resid 56 and name HA ))
3.400 3.400 2.600 peak 1097 spectrum 3 weight 0.11000E+01 volume 0.75822E-03 ppm1 6.948 ppm2 3.784 CV 1
ASSI { 1098}
(( segid "PX14" and resid 56 and name HN ))
(( segid "PX14" and resid 55 and name HA ))
4.400 4.400 1.600 peak 1098 spectrum 3 weight 0.11000E+01 volume 0.22178E-03 ppm1 6.946 ppm2 3.879 CV 1
ASSI { 1100}
(( segid "PX14" and resid 34 and name HN ))
(( segid "PX14" and resid 31 and name HB ))
3.700 3.700 2.300 peak 1100 spectrum 3 weight 0.11000E+01 volume 0.97761E-03 ppm1 7.055 ppm2 3.527 CV 1
ASSI { 1101}
(( segid "PX14" and resid 34 and name HN ))
(( segid "PX14" and resid 33 and name HA ))
4.200 4.200 1.800 peak 1101 spectrum 3 weight 0.11000E+01 volume 0.27666E-03 ppm1 7.054 ppm2 3.294 CV 1
ASSI { 1106}
(( segid "PX14" and resid 31 and name HB ))
( segid "PX14" and resid 30 and name HB% )
4.100 4.100 1.900 peak 1106 spectrum 3 weight 0.11000E+01 volume 0.83142E-03 ppm1 3.502 ppm2 1.350 CV 1
ASSI { 1107}
(( segid "PX14" and resid 58 and name HN ))
(( segid "PX14" and resid 54 and name HA ))
3.400 3.400 2.600 peak 1107 spectrum 3 weight 0.11000E+01 volume 0.85450E-03 ppm1 7.400 ppm2 4.153 CV 1
ASSI { 1109}
(( segid "PX14" and resid 58 and name HN ))
(( segid "PX14" and resid 58 and name HG ))
3.800 3.800 2.200 peak 1109 spectrum 3 weight 0.11000E+01 volume 0.41895E-03 ppm1 7.401 ppm2 1.674 CV 1
ASSI { 1111}
(( segid "PX14" and resid 58 and name HN ))
(( segid "PX14" and resid 58 and name HB2 ))
2.500 2.500 3.500 peak 1111 spectrum 3 weight 0.11000E+01 volume 0.31239E-02 ppm1 7.401 ppm2 1.109 CV 1
ASSI { 1112}
(( segid "PX14" and resid 58 and name HN ))
( segid "PX14" and resid 58 and name HD2%)
3.000 3.000 3.000 peak 1112 spectrum 3 weight 0.11000E+01 volume 0.42904E-02 ppm1 7.401 ppm2 0.902 CV 1
ASSI { 1114}
(( segid "PX14" and resid 58 and name HN ))
( segid "PX14" and resid 58 and name HD1%)
3.400 3.400 2.600 peak 1114 spectrum 3 weight 0.11000E+01 volume 0.12878E-02 ppm1 7.401 ppm2 0.714 CV 1
ASSI { 1117}
(( segid "PX14" and resid 66 and name HN ))
( segid "PX14" and resid 66 and name HB% )
2.600 2.600 3.400 peak 1117 spectrum 3 weight 0.11000E+01 volume 0.42002E-02 ppm1 8.560 ppm2 1.317 CV 1
ASSI { 1118}
(( segid "PX14" and resid 66 and name HN ))
( segid "PX14" and resid 29 and name HG2%)
3.200 3.200 2.800 peak 1118 spectrum 3 weight 0.11000E+01 volume 0.15043E-02 ppm1 8.559 ppm2 0.748 CV 1
ASSI { 1119}
(( segid "PX14" and resid 63 and name HN ))
( segid "PX14" and resid 63 and name HD1%)
3.800 3.800 2.200 peak 1119 spectrum 3 weight 0.11000E+01 volume 0.12847E-02 ppm1 8.543 ppm2 0.801 CV 1
ASSI { 1120}
(( segid "PX14" and resid 63 and name HN ))
( segid "PX14" and resid 58 and name HD1%)
3.200 3.200 2.800 peak 1120 spectrum 3 weight 0.11000E+01 volume 0.58772E-03 ppm1 8.543 ppm2 0.713 CV 1
ASSI { 1121}
(( segid "PX14" and resid 63 and name HN ))
( segid "PX14" and resid 63 and name HG2%)
3.100 3.100 2.900 peak 1121 spectrum 3 weight 0.11000E+01 volume 0.20356E-02 ppm1 8.542 ppm2 0.643 CV 1
ASSI { 1122}
(( segid "PX14" and resid 66 and name HN ))
( segid "PX14" and resid 36 and name HD2%)
6.000 6.000 0.000 peak 1122 spectrum 3 weight 0.11000E+01 volume 0.69609E-04 ppm1 8.559 ppm2 0.176 CV 1
ASSI { 1124}
(( segid "PX14" and resid 66 and name HN ))
( segid "PX14" and resid 32 and name HB% )
4.900 4.900 1.100 peak 1124 spectrum 3 weight 0.11000E+01 volume 0.29326E-03 ppm1 8.558 ppm2 1.599 CV 1
ASSI { 1125}
(( segid "PX14" and resid 65 and name HN ))
(( segid "PX14" and resid 65 and name HG2 ))
3.800 3.800 2.200 peak 1125 spectrum 3 weight 0.11000E+01 volume 0.92320E-03 ppm1 8.038 ppm2 2.502 CV 1
ASSI { 1127}
(( segid "PX05" and resid 108 and name HB1 ))
( segid "PX05" and resid 108 and name HD2%)
3.500 3.500 2.500 peak 1127 spectrum 3 weight 0.11000E+01 volume 0.64069E-03 ppm1 1.753 ppm2 0.743 CV 1
ASSI { 1132}
( segid "PX14" and resid 52 and name HE% )
( segid "PX14" and resid 35 and name HE% )
2.900 2.900 3.100 peak 1132 spectrum 3 weight 0.11000E+01 volume 0.28034E-02 ppm1 6.895 ppm2 6.618 CV 1
ASSI { 1133}
( segid "PX14" and resid 52 and name HE% )
(( segid "PX05" and resid 103 and name HE3 ))
3.000 3.000 3.000 peak 1133 spectrum 3 weight 0.11000E+01 volume 0.15407E-02 ppm1 6.895 ppm2 6.646 CV 1
ASSI { 1136}
(( segid "PX05" and resid 103 and name HB1 ))
( segid "PX14" and resid 52 and name HE% )
4.000 2.000 2.000 peak 1136 spectrum 3 weight 0.11000E+01 volume 0.22647E-03 ppm1 3.383 ppm2 6.917 CV 1
ASSI { 1141}
(( segid "PX14" and resid 52 and name HB2 ))
( segid "PX14" and resid 52 and name HE% )
4.700 2.800 1.300 peak 1141 spectrum 3 weight 0.11000E+01 volume 0.42305E-03 ppm1 2.988 ppm2 6.916 CV 1
ASSI { 1144}
( segid "PX14" and resid 52 and name HE% )
(( segid "PX05" and resid 103 and name HB2 ))
4.500 2.500 1.500 peak 1144 spectrum 3 weight 0.11000E+01 volume 0.87221E-03 ppm1 6.893 ppm2 2.969 CV 1
ASSI { 1145}
( segid "PX14" and resid 52 and name HE% )
(( segid "PX05" and resid 106 and name HB1 ))
3.000 3.000 3.000 peak 1145 spectrum 3 weight 0.11000E+01 volume 0.26374E-02 ppm1 6.894 ppm2 2.346 CV 1
ASSI { 1146}
( segid "PX14" and resid 52 and name HE% )
(( segid "PX05" and resid 106 and name HG2 ))
4.500 4.500 1.500 peak 1146 spectrum 3 weight 0.11000E+01 volume 0.67663E-03 ppm1 6.893 ppm2 2.260 CV 1
ASSI { 1147}
( segid "PX14" and resid 52 and name HE% )
(( segid "PX05" and resid 107 and name HB2 ))
4.000 2.000 2.000 peak 1147 spectrum 3 weight 0.11000E+01 volume 0.28932E-03 ppm1 6.894 ppm2 2.102 CV 1
ASSI { 1150}
(( segid "PX05" and resid 103 and name HA ))
( segid "PX14" and resid 52 and name HE% )
3.800 1.800 1.800 peak 1150 spectrum 3 weight 0.11000E+01 volume 0.81867E-03 ppm1 4.723 ppm2 6.915 CV 1
ASSI { 1152}
(( segid "PX14" and resid 52 and name HZ ))
( segid "PX14" and resid 52 and name HE% )
3.700 1.700 1.700 peak 1152 spectrum 3 weight 0.11000E+01 volume 0.40827E-03 ppm1 7.176 ppm2 6.918 CV 1
ASSI { 1153}
(( segid "PX14" and resid 52 and name HZ ))
(( segid "PX05" and resid 106 and name HB1 ))
4.900 4.900 1.100 peak 1153 spectrum 3 weight 0.11000E+01 volume 0.36173E-03 ppm1 7.177 ppm2 2.344 CV 1
ASSI { 1154}
(( segid "PX14" and resid 52 and name HZ ))
(( segid "PX05" and resid 106 and name HG2 ))
5.700 5.700 0.300 peak 1154 spectrum 3 weight 0.11000E+01 volume 0.12342E-03 ppm1 7.177 ppm2 2.246 CV 1
ASSI { 1155}
(( segid "PX14" and resid 52 and name HZ ))
(( segid "PX05" and resid 106 and name HG1 ))
5.900 5.900 0.100 peak 1155 spectrum 3 weight 0.11000E+01 volume 0.77029E-04 ppm1 7.173 ppm2 2.534 CV 1
ASSI { 1159}
(( segid "PX14" and resid 23 and name HB2 ))
(( segid "PX14" and resid 23 and name HA ))
3.100 3.100 2.900 peak 1159 spectrum 3 weight 0.11000E+01 volume 0.14339E-02 ppm1 1.561 ppm2 4.596 CV 1
ASSI { 1162}
(( segid "PX14" and resid 53 and name HA ))
(( segid "PX14" and resid 56 and name HG2 ))
5.200 5.200 0.800 peak 1162 spectrum 3 weight 0.11000E+01 volume 0.73017E-04 ppm1 3.447 ppm2 -1.171 CV 1
ASSI { 1165}
(( segid "PX14" and resid 53 and name HA ))
(( segid "PX14" and resid 56 and name HG1 ))
4.300 4.300 1.700 peak 1165 spectrum 3 weight 0.11000E+01 volume 0.49596E-03 ppm1 3.447 ppm2 -0.093 CV 1
ASSI { 1166}
(( segid "PX14" and resid 49 and name HA ))
( segid "PX14" and resid 36 and name HD1%)
3.400 3.400 2.600 peak 1166 spectrum 3 weight 0.11000E+01 volume 0.15782E-02 ppm1 3.930 ppm2 0.554 CV 1
ASSI { 1167}
(( segid "PX05" and resid 104 and name HA ))
( segid "PX14" and resid 41 and name HG2%)
4.700 4.700 1.300 peak 1167 spectrum 3 weight 0.11000E+01 volume 0.12866E-03 ppm1 4.088 ppm2 -0.376 CV 1
ASSI { 1169}
(( segid "PX14" and resid 32 and name HA ))
( segid "PX14" and resid 31 and name HG2%)
3.900 3.900 2.100 peak 1169 spectrum 3 weight 0.11000E+01 volume 0.46815E-03 ppm1 4.193 ppm2 -0.090 CV 1
ASSI { 1170}
(( segid "PX14" and resid 32 and name HA ))
( segid "PX14" and resid 36 and name HD2%)
5.100 5.100 0.900 peak 1170 spectrum 3 weight 0.11000E+01 volume 0.12946E-03 ppm1 4.165 ppm2 0.174 CV 1
ASSI { 1171}
(( segid "PX14" and resid 35 and name HA ))
( segid "PX14" and resid 36 and name HD2%)
5.700 5.700 0.300 peak 1171 spectrum 3 weight 0.11000E+01 volume 0.13509E-03 ppm1 4.234 ppm2 0.174 CV 1
ASSI { 1182}
( segid "PX14" and resid 32 and name HB% )
( segid "PX14" and resid 36 and name HD2%)
4.100 4.100 1.900 peak 1182 spectrum 3 weight 0.11000E+01 volume 0.42159E-03 ppm1 1.574 ppm2 0.175 CV 1
ASSI { 1187}
(( segid "PX14" and resid 35 and name HA ))
(( segid "PX14" and resid 35 and name HN ))
3.400 3.400 2.600 peak 1187 spectrum 3 weight 0.11000E+01 volume 0.82424E-03 ppm1 4.238 ppm2 8.001 CV 1
ASSI { 1190}
(( segid "PX05" and resid 104 and name HA ))
( segid "PX14" and resid 35 and name HE% )
2.400 2.400 3.600 peak 1190 spectrum 3 weight 0.11000E+01 volume 0.36799E-02 ppm1 4.086 ppm2 6.612 CV 1
ASSI { 1195}
(( segid "PX14" and resid 41 and name HA ))
( segid "PX05" and resid 108 and name HD1%)
3.400 3.400 2.600 peak 1195 spectrum 3 weight 0.11000E+01 volume 0.16153E-02 ppm1 3.295 ppm2 0.742 CV 1
ASSI { 1201}
(( segid "PX05" and resid 106 and name HB1 ))
( segid "PX14" and resid 52 and name HD% )
3.900 3.900 2.100 peak 1201 spectrum 3 weight 0.11000E+01 volume 0.11297E-02 ppm1 2.323 ppm2 6.914 CV 1
ASSI { 1206}
(( segid "PX14" and resid 49 and name HD2 ))
( segid "PX14" and resid 67 and name HE% )
3.900 3.900 2.100 peak 1206 spectrum 3 weight 0.11000E+01 volume 0.29638E-03 ppm1 2.653 ppm2 7.049 CV 1
ASSI { 1208}
(( segid "PX14" and resid 49 and name HD2 ))
(( segid "PX14" and resid 67 and name HZ ))
4.600 4.600 1.400 peak 1208 spectrum 3 weight 0.11000E+01 volume 0.31901E-03 ppm1 2.652 ppm2 6.936 CV 1
ASSI { 1217}
(( segid "PX14" and resid 53 and name HG ))
(( segid "PX14" and resid 53 and name HN ))
3.100 1.200 1.200 peak 1217 spectrum 3 weight 0.11000E+01 volume 0.10421E-02 ppm1 1.199 ppm2 7.480 CV 1
ASSI { 1218}
( segid "PX14" and resid 53 and name HD2%)
(( segid "PX14" and resid 53 and name HN ))
3.700 3.700 2.300 peak 1218 spectrum 3 weight 0.11000E+01 volume 0.89576E-03 ppm1 0.913 ppm2 7.480 CV 1
ASSI { 1230}
( segid "PX14" and resid 41 and name HG2%)
( segid "PX05" and resid 108 and name HD1%)
4.500 4.500 1.500 peak 1230 spectrum 3 weight 0.11000E+01 volume 0.20648E-03 ppm1 -0.402 ppm2 0.797 CV 1
ASSI { 1231}
( segid "PX14" and resid 41 and name HG2%)
( segid "PX05" and resid 108 and name HD2%)
5.100 5.100 0.900 peak 1231 spectrum 3 weight 0.11000E+01 volume 0.84537E-04 ppm1 -0.398 ppm2 0.743 CV 1
ASSI { 1}
(( segid "PX05" and resid 110 and name HN ))
(( segid "PX05" and resid 110 and name HA ))
2.600 0.900 0.900 peak 1 spectrum 4 weight 0.11000E+01 volume 0.54514E-02 ppm1 7.662 ppm2 4.332 CV 1
ASSI { 1}
(( segid "PX05" and resid 109 and name HN ))
(( segid "PX05" and resid 109 and name HA ))
2.600 0.900 0.900 peak 1 spectrum 4 weight 0.11000E+01 volume 0.52390E-02 ppm1 7.640 ppm2 4.316 CV 1
ASSI { 2}
(( segid "PX05" and resid 109 and name HN ))
(( segid "PX05" and resid 108 and name HA ))
3.400 1.400 1.400 peak 2 spectrum 4 weight 0.11000E+01 volume 0.12543E-02 ppm1 7.639 ppm2 4.051 CV 1
ASSI { 3}
(( segid "PX05" and resid 108 and name HN ))
(( segid "PX05" and resid 108 and name HA ))
3.500 1.500 1.500 peak 3 spectrum 4 weight 0.11000E+01 volume 0.72984E-03 ppm1 8.423 ppm2 4.041 CV 1
ASSI { 4}
(( segid "PX05" and resid 111 and name HN ))
(( segid "PX05" and resid 110 and name HA ))
3.500 1.600 1.600 peak 4 spectrum 4 weight 0.11000E+01 volume 0.10842E-02 ppm1 8.025 ppm2 4.347 CV 1
ASSI { 5}
(( segid "PX05" and resid 111 and name HN ))
(( segid "PX05" and resid 111 and name HA1 ))
2.800 1.000 1.000 peak 5 spectrum 4 weight 0.11000E+01 volume 0.21548E-02 ppm1 8.032 ppm2 4.030 CV 1
ASSI { 6}
(( segid "PX05" and resid 111 and name HN ))
(( segid "PX05" and resid 111 and name HA2 ))
3.800 1.800 1.800 peak 6 spectrum 4 weight 0.11000E+01 volume 0.10114E-02 ppm1 8.028 ppm2 3.937 CV 1
ASSI { 7}
(( segid "PX05" and resid 112 and name HN ))
(( segid "PX05" and resid 111 and name HA2 ))
4.900 3.000 1.100 peak 7 spectrum 4 weight 0.11000E+01 volume 0.29707E-03 ppm1 7.894 ppm2 3.942 CV 1
ASSI { 8}
(( segid "PX05" and resid 112 and name HN ))
(( segid "PX05" and resid 111 and name HA1 ))
4.300 2.300 1.700 peak 8 spectrum 4 weight 0.11000E+01 volume 0.24718E-03 ppm1 7.890 ppm2 4.029 CV 1
ASSI { 9}
(( segid "PX05" and resid 112 and name HN ))
(( segid "PX05" and resid 112 and name HA ))
3.700 1.700 1.700 peak 9 spectrum 4 weight 0.11000E+01 volume 0.72702E-03 ppm1 7.888 ppm2 4.469 CV 1
ASSI { 10}
(( segid "PX05" and resid 107 and name HN ))
(( segid "PX05" and resid 107 and name HA ))
2.900 1.100 1.100 peak 10 spectrum 4 weight 0.11000E+01 volume 0.22665E-02 ppm1 8.831 ppm2 3.918 CV 1
ASSI { 11}
(( segid "PX05" and resid 105 and name HN ))
(( segid "PX05" and resid 104 and name HA ))
3.900 1.900 1.900 peak 11 spectrum 4 weight 0.11000E+01 volume 0.37280E-03 ppm1 8.180 ppm2 4.231 CV 1
ASSI { 12}
(( segid "PX05" and resid 102 and name HN ))
(( segid "PX05" and resid 101 and name HA ))
3.700 1.700 1.700 peak 12 spectrum 4 weight 0.11000E+01 volume 0.84698E-03 ppm1 8.181 ppm2 4.386 CV 1
ASSI { 13}
(( segid "PX05" and resid 103 and name HE3 ))
(( segid "PX05" and resid 103 and name HZ3 ))
2.300 0.700 0.700 peak 13 spectrum 4 weight 0.11000E+01 volume 0.69280E-02 ppm1 6.763 ppm2 6.481 CV 1
ASSI { 14}
(( segid "PX05" and resid 103 and name HH2 ))
(( segid "PX05" and resid 103 and name HZ3 ))
2.300 0.700 0.700 peak 14 spectrum 4 weight 0.11000E+01 volume 0.76050E-02 ppm1 6.996 ppm2 6.479 CV 1
ASSI { 16}
(( segid "PX05" and resid 103 and name HZ2 ))
(( segid "PX05" and resid 103 and name HH2 ))
2.200 0.600 0.600 peak 16 spectrum 4 weight 0.11000E+01 volume 0.14075E-01 ppm1 7.474 ppm2 6.984 CV 1
ASSI { 18}
( segid "PX05" and resid 107 and name HE% )
( segid "PX05" and resid 107 and name HD% )
1.900 0.500 0.500 peak 18 spectrum 4 weight 0.11000E+01 volume 0.19042E-01 ppm1 7.382 ppm2 6.889 CV 1
ASSI { 19}
(( segid "PX05" and resid 103 and name HE1 ))
(( segid "PX05" and resid 103 and name HD1 ))
3.000 1.100 1.100 peak 19 spectrum 4 weight 0.11000E+01 volume 0.21924E-02 ppm1 10.193 ppm2 7.313 CV 1
ASSI { 20}
(( segid "PX05" and resid 103 and name HE1 ))
(( segid "PX05" and resid 103 and name HZ2 ))
3.400 1.400 1.400 peak 20 spectrum 4 weight 0.11000E+01 volume 0.12039E-02 ppm1 10.193 ppm2 7.460 CV 1
ASSI { 21}
(( segid "PX05" and resid 106 and name HN ))
(( segid "PX05" and resid 106 and name HA ))
2.800 1.000 1.000 peak 21 spectrum 4 weight 0.11000E+01 volume 0.27841E-02 ppm1 8.323 ppm2 4.141 CV 1
ASSI { 22}
(( segid "PX05" and resid 105 and name HN ))
(( segid "PX05" and resid 105 and name HA ))
2.800 0.900 0.900 peak 22 spectrum 4 weight 0.11000E+01 volume 0.37569E-02 ppm1 8.179 ppm2 4.109 CV 1
ASSI { 23}
(( segid "PX05" and resid 105 and name HN ))
(( segid "PX05" and resid 105 and name HB1 ))
2.400 0.700 0.700 peak 23 spectrum 4 weight 0.11000E+01 volume 0.62001E-02 ppm1 8.180 ppm2 2.349 CV 1
ASSI { 24}
(( segid "PX05" and resid 105 and name HN ))
(( segid "PX05" and resid 105 and name HG2 ))
4.500 4.500 1.500 peak 24 spectrum 4 weight 0.11000E+01 volume 0.80330E-03 ppm1 8.181 ppm2 2.586 CV 1
ASSI { 25}
(( segid "PX05" and resid 105 and name HN ))
(( segid "PX05" and resid 105 and name HG1 ))
4.300 4.300 1.700 peak 25 spectrum 4 weight 0.11000E+01 volume 0.11381E-02 ppm1 8.179 ppm2 2.685 CV 1
ASSI { 26}
(( segid "PX05" and resid 107 and name HN ))
(( segid "PX05" and resid 107 and name HB1 ))
2.500 0.800 0.800 peak 26 spectrum 4 weight 0.11000E+01 volume 0.37904E-02 ppm1 8.830 ppm2 3.011 CV 1
ASSI { 27}
(( segid "PX05" and resid 107 and name HN ))
(( segid "PX05" and resid 107 and name HB2 ))
2.700 0.900 0.900 peak 27 spectrum 4 weight 0.11000E+01 volume 0.33972E-02 ppm1 8.830 ppm2 2.232 CV 1
ASSI { 28}
(( segid "PX05" and resid 102 and name HN ))
(( segid "PX05" and resid 102 and name HB1 ))
3.300 1.400 1.400 peak 28 spectrum 4 weight 0.11000E+01 volume 0.13789E-02 ppm1 8.176 ppm2 3.211 CV 1
ASSI { 29}
(( segid "PX05" and resid 102 and name HN ))
(( segid "PX05" and resid 102 and name HB2 ))
2.900 1.000 1.000 peak 29 spectrum 4 weight 0.11000E+01 volume 0.22718E-02 ppm1 8.179 ppm2 3.127 CV 1
ASSI { 30}
(( segid "PX05" and resid 102 and name HN ))
(( segid "PX05" and resid 102 and name HA ))
2.800 1.000 1.000 peak 30 spectrum 4 weight 0.11000E+01 volume 0.33602E-02 ppm1 8.178 ppm2 4.716 CV 1
ASSI { 31}
(( segid "PX05" and resid 104 and name HN ))
(( segid "PX05" and resid 104 and name HA ))
2.900 1.000 1.000 peak 31 spectrum 4 weight 0.11000E+01 volume 0.19239E-02 ppm1 8.659 ppm2 4.230 CV 1
ASSI { 32}
(( segid "PX05" and resid 104 and name HN ))
( segid "PX05" and resid 104 and name HB% )
2.400 2.400 3.600 peak 32 spectrum 4 weight 0.11000E+01 volume 0.65007E-02 ppm1 8.655 ppm2 1.689 CV 1
ASSI { 33}
(( segid "PX05" and resid 101 and name HN ))
(( segid "PX05" and resid 101 and name HA ))
3.200 1.300 1.300 peak 33 spectrum 4 weight 0.11000E+01 volume 0.13934E-02 ppm1 7.740 ppm2 4.387 CV 1
ASSI { 34}
(( segid "PX05" and resid 100 and name HN ))
(( segid "PX05" and resid 99 and name HA ))
4.100 2.100 1.900 peak 34 spectrum 4 weight 0.11000E+01 volume 0.46672E-03 ppm1 8.214 ppm2 4.157 CV 1
ASSI { 35}
(( segid "PX05" and resid 96 and name HN ))
(( segid "PX05" and resid 95 and name HA ))
2.800 1.000 1.000 peak 35 spectrum 4 weight 0.11000E+01 volume 0.45757E-02 ppm1 8.080 ppm2 4.273 CV 1
ASSI { 36}
(( segid "PX05" and resid 96 and name HN ))
(( segid "PX05" and resid 96 and name HA ))
3.700 1.700 1.700 peak 36 spectrum 4 weight 0.11000E+01 volume 0.63853E-03 ppm1 8.081 ppm2 4.600 CV 1
ASSI { 37}
(( segid "PX05" and resid 97 and name HN ))
(( segid "PX05" and resid 97 and name HA ))
2.900 1.000 1.000 peak 37 spectrum 4 weight 0.11000E+01 volume 0.23869E-02 ppm1 8.142 ppm2 4.235 CV 1
ASSI { 38}
(( segid "PX05" and resid 97 and name HN ))
(( segid "PX05" and resid 96 and name HA ))
2.600 0.800 0.800 peak 38 spectrum 4 weight 0.11000E+01 volume 0.58739E-02 ppm1 8.142 ppm2 4.601 CV 1
ASSI { 39}
(( segid "PX05" and resid 103 and name HN ))
(( segid "PX05" and resid 103 and name HA ))
3.000 1.100 1.100 peak 39 spectrum 4 weight 0.11000E+01 volume 0.18510E-02 ppm1 9.217 ppm2 4.866 CV 1
ASSI { 40}
(( segid "PX05" and resid 103 and name HN ))
(( segid "PX05" and resid 100 and name HB2 ))
4.700 2.800 1.300 peak 40 spectrum 4 weight 0.11000E+01 volume 0.62882E-04 ppm1 9.218 ppm2 3.712 CV 1
ASSI { 41}
(( segid "PX05" and resid 100 and name HN ))
(( segid "PX05" and resid 100 and name HB2 ))
5.100 3.300 0.900 peak 41 spectrum 4 weight 0.11000E+01 volume 0.85362E-04 ppm1 8.216 ppm2 3.714 CV 1
ASSI { 42}
(( segid "PX05" and resid 101 and name HN ))
(( segid "PX05" and resid 100 and name HB2 ))
5.700 4.100 0.300 peak 42 spectrum 4 weight 0.11000E+01 volume 0.49101E-04 ppm1 7.737 ppm2 3.721 CV 1
ASSI { 43}
(( segid "PX05" and resid 104 and name HN ))
(( segid "PX05" and resid 103 and name HA ))
4.500 2.500 1.500 peak 43 spectrum 4 weight 0.11000E+01 volume 0.26922E-03 ppm1 8.659 ppm2 4.875 CV 1
ASSI { 44}
(( segid "PX05" and resid 103 and name HN ))
(( segid "PX05" and resid 102 and name HB2 ))
3.000 1.200 1.200 peak 44 spectrum 4 weight 0.11000E+01 volume 0.36622E-02 ppm1 9.219 ppm2 3.102 CV 1
ASSI { 45}
(( segid "PX05" and resid 103 and name HN ))
(( segid "PX05" and resid 103 and name HB1 ))
3.700 1.700 1.700 peak 45 spectrum 4 weight 0.11000E+01 volume 0.20379E-02 ppm1 9.215 ppm2 3.517 CV 1
ASSI { 46}
(( segid "PX05" and resid 104 and name HN ))
(( segid "PX05" and resid 103 and name HB1 ))
3.300 1.300 1.300 peak 46 spectrum 4 weight 0.11000E+01 volume 0.22431E-02 ppm1 8.658 ppm2 3.523 CV 1
ASSI { 47}
(( segid "PX05" and resid 104 and name HN ))
(( segid "PX05" and resid 103 and name HB2 ))
3.100 1.200 1.200 peak 47 spectrum 4 weight 0.11000E+01 volume 0.91226E-03 ppm1 8.661 ppm2 3.101 CV 1
ASSI { 48}
(( segid "PX05" and resid 107 and name HN ))
(( segid "PX05" and resid 106 and name HA ))
3.500 1.500 1.500 peak 48 spectrum 4 weight 0.11000E+01 volume 0.94105E-03 ppm1 8.831 ppm2 4.144 CV 1
ASSI { 49}
(( segid "PX05" and resid 107 and name HN ))
(( segid "PX05" and resid 104 and name HA ))
4.000 2.000 2.000 peak 49 spectrum 4 weight 0.11000E+01 volume 0.33907E-03 ppm1 8.828 ppm2 4.231 CV 1
ASSI { 51}
(( segid "PX05" and resid 103 and name HN ))
(( segid "PX05" and resid 102 and name HA ))
3.600 1.700 1.700 peak 51 spectrum 4 weight 0.11000E+01 volume 0.73366E-03 ppm1 9.213 ppm2 4.716 CV 1
ASSI { 52}
(( segid "PX05" and resid 106 and name HN ))
(( segid "PX05" and resid 105 and name HA ))
3.600 1.600 1.600 peak 52 spectrum 4 weight 0.11000E+01 volume 0.92320E-03 ppm1 8.322 ppm2 4.107 CV 1
ASSI { 54}
(( segid "PX05" and resid 102 and name HN ))
(( segid "PX05" and resid 101 and name HN ))
3.300 1.300 1.300 peak 54 spectrum 4 weight 0.11000E+01 volume 0.10428E-02 ppm1 8.180 ppm2 7.731 CV 1
ASSI { 56}
(( segid "PX05" and resid 111 and name HN ))
(( segid "PX05" and resid 110 and name HN ))
3.600 1.600 1.600 peak 56 spectrum 4 weight 0.11000E+01 volume 0.53213E-03 ppm1 8.032 ppm2 7.655 CV 1
ASSI { 59}
(( segid "PX05" and resid 109 and name HN ))
(( segid "PX05" and resid 108 and name HN ))
2.800 1.000 1.000 peak 59 spectrum 4 weight 0.11000E+01 volume 0.22681E-02 ppm1 7.636 ppm2 8.419 CV 1
ASSI { 60}
(( segid "PX05" and resid 108 and name HN ))
(( segid "PX05" and resid 107 and name HN ))
3.000 1.100 1.100 peak 60 spectrum 4 weight 0.11000E+01 volume 0.14966E-02 ppm1 8.422 ppm2 8.829 CV 1
ASSI { 63}
(( segid "PX05" and resid 106 and name HN ))
(( segid "PX05" and resid 107 and name HN ))
2.800 1.000 1.000 peak 63 spectrum 4 weight 0.11000E+01 volume 0.22555E-02 ppm1 8.326 ppm2 8.827 CV 1
ASSI { 65}
(( segid "PX05" and resid 105 and name HN ))
(( segid "PX05" and resid 104 and name HN ))
2.900 1.000 1.000 peak 65 spectrum 4 weight 0.11000E+01 volume 0.19638E-02 ppm1 8.178 ppm2 8.652 CV 1
ASSI { 67}
(( segid "PX05" and resid 106 and name HN ))
(( segid "PX05" and resid 105 and name HN ))
2.500 0.800 0.800 peak 67 spectrum 4 weight 0.11000E+01 volume 0.53173E-02 ppm1 8.320 ppm2 8.176 CV 1
ASSI { 69}
(( segid "PX05" and resid 103 and name HN ))
(( segid "PX05" and resid 102 and name HN ))
3.400 1.500 1.500 peak 69 spectrum 4 weight 0.11000E+01 volume 0.64600E-03 ppm1 9.216 ppm2 8.174 CV 1
ASSI { 70}
(( segid "PX05" and resid 103 and name HN ))
(( segid "PX05" and resid 104 and name HN ))
3.100 1.200 1.200 peak 70 spectrum 4 weight 0.11000E+01 volume 0.15335E-02 ppm1 9.217 ppm2 8.652 CV 1
ASSI { 71}
(( segid "PX05" and resid 103 and name HN ))
(( segid "PX05" and resid 103 and name HD1 ))
3.000 1.200 1.200 peak 71 spectrum 4 weight 0.11000E+01 volume 0.13135E-02 ppm1 9.216 ppm2 7.316 CV 1
ASSI { 72}
(( segid "PX05" and resid 108 and name HN ))
( segid "PX05" and resid 107 and name HD% )
3.400 1.500 1.500 peak 72 spectrum 4 weight 0.11000E+01 volume 0.11977E-02 ppm1 8.425 ppm2 6.893 CV 1
ASSI { 73}
(( segid "PX05" and resid 107 and name HN ))
( segid "PX05" and resid 107 and name HD% )
4.300 2.300 1.700 peak 73 spectrum 4 weight 0.11000E+01 volume 0.99600E-03 ppm1 8.829 ppm2 6.894 CV 1
ASSI { 76}
(( segid "PX05" and resid 104 and name HN ))
(( segid "PX05" and resid 102 and name HA ))
4.100 4.100 1.900 peak 76 spectrum 4 weight 0.11000E+01 volume 0.59691E-03 ppm1 8.655 ppm2 4.386 CV 1
ASSI { 78}
(( segid "PX05" and resid 97 and name HA ))
(( segid "PX05" and resid 97 and name HG ))
2.700 0.900 0.900 peak 78 spectrum 4 weight 0.11000E+01 volume 0.50676E-02 ppm1 4.234 ppm2 1.685 CV 1
ASSI { 79}
(( segid "PX05" and resid 98 and name HN ))
(( segid "PX05" and resid 98 and name HA ))
2.900 1.000 1.000 peak 79 spectrum 4 weight 0.11000E+01 volume 0.28296E-02 ppm1 8.288 ppm2 4.289 CV 1
ASSI { 80}
(( segid "PX05" and resid 98 and name HN ))
(( segid "PX05" and resid 97 and name HA ))
3.100 1.200 1.200 peak 80 spectrum 4 weight 0.11000E+01 volume 0.24816E-02 ppm1 8.288 ppm2 4.235 CV 1
ASSI { 81}
(( segid "PX05" and resid 99 and name HN ))
(( segid "PX05" and resid 99 and name HA ))
3.000 1.100 1.100 peak 81 spectrum 4 weight 0.11000E+01 volume 0.20218E-02 ppm1 8.096 ppm2 4.162 CV 1
ASSI { 82}
(( segid "PX05" and resid 99 and name HN ))
(( segid "PX05" and resid 98 and name HA ))
2.900 1.000 1.000 peak 82 spectrum 4 weight 0.11000E+01 volume 0.37934E-02 ppm1 8.097 ppm2 4.290 CV 1
ASSI { 83}
(( segid "PX05" and resid 103 and name HE1 ))
( segid "PX05" and resid 99 and name HD1%)
3.100 1.200 1.200 peak 83 spectrum 4 weight 0.11000E+01 volume 0.19947E-02 ppm1 10.192 ppm2 1.035 CV 1
ASSI { 84}
(( segid "PX05" and resid 103 and name HE1 ))
( segid "PX05" and resid 99 and name HD2%)
3.500 3.500 2.500 peak 84 spectrum 4 weight 0.11000E+01 volume 0.10725E-02 ppm1 10.193 ppm2 0.871 CV 1
ASSI { 85}
(( segid "PX05" and resid 95 and name HN ))
(( segid "PX05" and resid 94 and name HA ))
3.300 1.400 1.400 peak 85 spectrum 4 weight 0.11000E+01 volume 0.14008E-02 ppm1 8.502 ppm2 4.176 CV 1
ASSI { 86}
(( segid "PX05" and resid 95 and name HN ))
(( segid "PX05" and resid 95 and name HA ))
3.800 1.800 1.800 peak 86 spectrum 4 weight 0.11000E+01 volume 0.55317E-03 ppm1 8.500 ppm2 4.275 CV 1
ASSI { 87}
(( segid "PX05" and resid 107 and name HN ))
(( segid "PX05" and resid 106 and name HB1 ))
3.300 1.300 1.300 peak 87 spectrum 4 weight 0.11000E+01 volume 0.30890E-02 ppm1 8.830 ppm2 2.470 CV 1
ASSI { 88}
(( segid "PX05" and resid 106 and name HN ))
(( segid "PX05" and resid 106 and name HB1 ))
3.100 1.200 1.200 peak 88 spectrum 4 weight 0.11000E+01 volume 0.58708E-02 ppm1 8.324 ppm2 2.470 CV 1
ASSI { 89}
(( segid "PX05" and resid 106 and name HN ))
(( segid "PX05" and resid 106 and name HG2 ))
2.600 0.800 0.800 peak 89 spectrum 4 weight 0.11000E+01 volume 0.40283E-02 ppm1 8.323 ppm2 2.348 CV 1
ASSI { 90}
(( segid "PX05" and resid 106 and name HN ))
(( segid "PX05" and resid 106 and name HG1 ))
3.300 1.400 1.400 peak 90 spectrum 4 weight 0.11000E+01 volume 0.22002E-02 ppm1 8.322 ppm2 2.675 CV 1
ASSI { 91}
(( segid "PX05" and resid 108 and name HN ))
(( segid "PX05" and resid 107 and name HB1 ))
3.000 1.200 1.200 peak 91 spectrum 4 weight 0.11000E+01 volume 0.80418E-03 ppm1 8.422 ppm2 3.023 CV 1
ASSI { 92}
(( segid "PX05" and resid 108 and name HN ))
(( segid "PX05" and resid 107 and name HB2 ))
5.000 3.100 1.000 peak 92 spectrum 4 weight 0.11000E+01 volume 0.41000E-03 ppm1 8.422 ppm2 2.237 CV 1
ASSI { 93}
(( segid "PX05" and resid 108 and name HN ))
(( segid "PX05" and resid 108 and name HG ))
2.400 0.700 0.700 peak 93 spectrum 4 weight 0.11000E+01 volume 0.41071E-02 ppm1 8.422 ppm2 2.108 CV 1
ASSI { 94}
(( segid "PX05" and resid 108 and name HN ))
(( segid "PX05" and resid 108 and name HB1 ))
3.600 1.600 1.600 peak 94 spectrum 4 weight 0.11000E+01 volume 0.25693E-02 ppm1 8.425 ppm2 1.900 CV 1
ASSI { 95}
(( segid "PX05" and resid 108 and name HN ))
(( segid "PX05" and resid 108 and name HB2 ))
2.500 0.800 0.800 peak 95 spectrum 4 weight 0.11000E+01 volume 0.35845E-02 ppm1 8.423 ppm2 1.571 CV 1
ASSI { 96}
(( segid "PX05" and resid 108 and name HN ))
( segid "PX05" and resid 108 and name HD1%)
4.100 2.100 1.900 peak 96 spectrum 4 weight 0.11000E+01 volume 0.13476E-02 ppm1 8.420 ppm2 0.919 CV 1
ASSI { 97}
(( segid "PX05" and resid 108 and name HN ))
( segid "PX05" and resid 108 and name HD2%)
4.500 2.500 1.500 peak 97 spectrum 4 weight 0.11000E+01 volume 0.56949E-03 ppm1 8.423 ppm2 0.861 CV 1
ASSI { 98}
(( segid "PX05" and resid 98 and name HN ))
( segid "PX05" and resid 98 and name HB% )
2.600 0.800 0.800 peak 98 spectrum 4 weight 0.11000E+01 volume 0.52221E-02 ppm1 8.288 ppm2 1.493 CV 1
ASSI { 99}
(( segid "PX05" and resid 99 and name HN ))
(( segid "PX05" and resid 99 and name HB1 ))
3.000 1.100 1.100 peak 99 spectrum 4 weight 0.11000E+01 volume 0.31477E-02 ppm1 8.098 ppm2 1.490 CV 1
ASSI { 100}
(( segid "PX05" and resid 103 and name HZ2 ))
( segid "PX05" and resid 99 and name HD1%)
2.300 2.300 3.700 peak 100 spectrum 4 weight 0.11000E+01 volume 0.41248E-02 ppm1 7.469 ppm2 1.034 CV 1
ASSI { 103}
(( segid "PX05" and resid 109 and name HN ))
(( segid "PX05" and resid 108 and name HB2 ))
2.200 0.600 0.600 peak 103 spectrum 4 weight 0.11000E+01 volume 0.87959E-02 ppm1 7.638 ppm2 1.553 CV 1
ASSI { 104}
(( segid "PX05" and resid 109 and name HN ))
(( segid "PX05" and resid 108 and name HB1 ))
4.100 2.100 1.900 peak 104 spectrum 4 weight 0.11000E+01 volume 0.88489E-03 ppm1 7.634 ppm2 1.898 CV 1
ASSI { 105}
(( segid "PX05" and resid 101 and name HN ))
(( segid "PX05" and resid 101 and name HB1 ))
2.700 0.900 0.900 peak 105 spectrum 4 weight 0.11000E+01 volume 0.46357E-02 ppm1 7.739 ppm2 2.225 CV 1
ASSI { 106}
(( segid "PX05" and resid 102 and name HN ))
(( segid "PX05" and resid 101 and name HB1 ))
2.900 1.000 1.000 peak 106 spectrum 4 weight 0.11000E+01 volume 0.22084E-02 ppm1 8.178 ppm2 2.225 CV 1
ASSI { 107}
(( segid "PX05" and resid 110 and name HN ))
( segid "PX05" and resid 110 and name HB% )
2.800 0.900 0.900 peak 107 spectrum 4 weight 0.11000E+01 volume 0.36142E-02 ppm1 7.661 ppm2 1.488 CV 1
ASSI { 108}
(( segid "PX05" and resid 96 and name HN ))
(( segid "PX05" and resid 96 and name HB2 ))
3.000 1.100 1.100 peak 108 spectrum 4 weight 0.11000E+01 volume 0.18399E-02 ppm1 8.082 ppm2 2.593 CV 1
ASSI { 110}
(( segid "PX05" and resid 95 and name HN ))
( segid "PX05" and resid 95 and name HB% )
3.600 1.600 1.600 peak 110 spectrum 4 weight 0.11000E+01 volume 0.76439E-03 ppm1 8.505 ppm2 1.376 CV 1
ASSI { 111}
(( segid "PX05" and resid 96 and name HN ))
(( segid "PX05" and resid 96 and name HB1 ))
3.600 1.600 1.600 peak 111 spectrum 4 weight 0.11000E+01 volume 0.13685E-02 ppm1 8.081 ppm2 1.376 CV 1
ASSI { 112}
(( segid "PX05" and resid 103 and name HD1 ))
(( segid "PX05" and resid 103 and name HB2 ))
3.000 3.000 3.000 peak 112 spectrum 4 weight 0.11000E+01 volume 0.25309E-02 ppm1 7.322 ppm2 3.100 CV 1
ASSI { 113}
(( segid "PX05" and resid 103 and name HD1 ))
(( segid "PX05" and resid 102 and name HB1 ))
3.200 3.200 2.800 peak 113 spectrum 4 weight 0.11000E+01 volume 0.10956E-02 ppm1 7.324 ppm2 3.211 CV 1
ASSI { 114}
(( segid "PX05" and resid 103 and name HD1 ))
(( segid "PX05" and resid 103 and name HB1 ))
4.500 4.500 1.500 peak 114 spectrum 4 weight 0.11000E+01 volume 0.47462E-03 ppm1 7.322 ppm2 3.528 CV 1
ASSI { 115}
(( segid "PX05" and resid 103 and name HD1 ))
(( segid "PX05" and resid 103 and name HA ))
2.500 2.500 3.500 peak 115 spectrum 4 weight 0.11000E+01 volume 0.61729E-02 ppm1 7.322 ppm2 4.865 CV 1
ASSI { 116}
(( segid "PX05" and resid 103 and name HN ))
(( segid "PX05" and resid 102 and name HB1 ))
3.700 1.700 1.700 peak 116 spectrum 4 weight 0.11000E+01 volume 0.50769E-03 ppm1 9.214 ppm2 3.212 CV 1
ASSI { 117}
(( segid "PX05" and resid 97 and name HN ))
( segid "PX05" and resid 97 and name HD1%)
5.100 3.300 0.900 peak 117 spectrum 4 weight 0.11000E+01 volume 0.36779E-03 ppm1 8.144 ppm2 0.986 CV 1
ASSI { 118}
(( segid "PX05" and resid 97 and name HN ))
( segid "PX05" and resid 97 and name HD2%)
5.400 3.700 0.600 peak 118 spectrum 4 weight 0.11000E+01 volume 0.19075E-03 ppm1 8.141 ppm2 0.908 CV 1
ASSI { 119}
(( segid "PX05" and resid 97 and name HN ))
(( segid "PX05" and resid 97 and name HG ))
2.300 0.700 0.700 peak 119 spectrum 4 weight 0.11000E+01 volume 0.66729E-02 ppm1 8.142 ppm2 1.730 CV 1
ASSI { 122}
( segid "PX05" and resid 107 and name HD% )
(( segid "PX05" and resid 107 and name HB1 ))
2.200 0.600 0.600 peak 122 spectrum 4 weight 0.11000E+01 volume 0.70193E-02 ppm1 6.894 ppm2 3.014 CV 1
ASSI { 125}
(( segid "PX05" and resid 103 and name HZ3 ))
( segid "PX14" and resid 53 and name HD1%)
2.300 0.700 0.700 peak 125 spectrum 4 weight 0.11000E+01 volume 0.46998E-02 ppm1 6.487 ppm2 0.846 CV 1
ASSI { 128}
( segid "PX05" and resid 107 and name HE% )
(( segid "PX14" and resid 41 and name HA ))
2.500 0.800 0.800 peak 128 spectrum 4 weight 0.11000E+01 volume 0.50453E-02 ppm1 7.383 ppm2 3.438 CV 1
ASSI { 129}
(( segid "PX05" and resid 100 and name HN ))
( segid "PX14" and resid 31 and name HG2%)
5.400 5.400 0.600 peak 129 spectrum 4 weight 0.11000E+01 volume 0.78546E-04 ppm1 8.213 ppm2 0.018 CV 1
ASSI { 131}
(( segid "PX05" and resid 99 and name HN ))
( segid "PX05" and resid 99 and name HD2%)
4.300 2.300 1.700 peak 131 spectrum 4 weight 0.11000E+01 volume 0.70877E-03 ppm1 8.100 ppm2 0.870 CV 1
ASSI { 132}
(( segid "PX05" and resid 99 and name HN ))
( segid "PX05" and resid 99 and name HD1%)
5.800 4.200 0.200 peak 132 spectrum 4 weight 0.11000E+01 volume 0.13613E-03 ppm1 8.097 ppm2 1.036 CV 1
ASSI { 133}
(( segid "PX05" and resid 103 and name HD1 ))
( segid "PX05" and resid 99 and name HD2%)
3.500 3.500 2.500 peak 133 spectrum 4 weight 0.11000E+01 volume 0.13964E-02 ppm1 7.323 ppm2 0.871 CV 1
ASSI { 134}
(( segid "PX05" and resid 103 and name HD1 ))
( segid "PX05" and resid 99 and name HD1%)
3.300 3.300 2.700 peak 134 spectrum 4 weight 0.11000E+01 volume 0.18466E-02 ppm1 7.322 ppm2 1.036 CV 1
ASSI { 147}
( segid "PX05" and resid 107 and name HD% )
(( segid "PX05" and resid 107 and name HB2 ))
2.500 0.800 0.800 peak 147 spectrum 4 weight 0.11000E+01 volume 0.44338E-02 ppm1 6.895 ppm2 2.230 CV 1
ASSI { 148}
( segid "PX05" and resid 107 and name HD% )
(( segid "PX05" and resid 104 and name HA ))
3.500 1.500 1.500 peak 148 spectrum 4 weight 0.11000E+01 volume 0.20820E-02 ppm1 6.894 ppm2 4.227 CV 1
ASSI { 149}
( segid "PX05" and resid 107 and name HD% )
(( segid "PX05" and resid 108 and name HA ))
3.200 1.200 1.200 peak 149 spectrum 4 weight 0.11000E+01 volume 0.21294E-02 ppm1 6.898 ppm2 4.057 CV 1
ASSI { 151}
( segid "PX05" and resid 107 and name HD% )
(( segid "PX14" and resid 41 and name HA ))
4.600 2.600 1.400 peak 151 spectrum 4 weight 0.11000E+01 volume 0.30252E-03 ppm1 6.901 ppm2 3.434 CV 1
ASSI { 153}
( segid "PX05" and resid 107 and name HD% )
(( segid "PX05" and resid 108 and name HG ))
2.300 0.700 0.700 peak 153 spectrum 4 weight 0.11000E+01 volume 0.52657E-02 ppm1 6.895 ppm2 2.112 CV 1
ASSI { 154}
( segid "PX05" and resid 107 and name HD% )
( segid "PX05" and resid 108 and name HD1%)
3.900 1.900 1.900 peak 154 spectrum 4 weight 0.11000E+01 volume 0.20299E-02 ppm1 6.899 ppm2 0.916 CV 1
ASSI { 159}
(( segid "PX05" and resid 103 and name HZ3 ))
(( segid "PX14" and resid 32 and name HA ))
2.500 0.800 0.800 peak 159 spectrum 4 weight 0.11000E+01 volume 0.37809E-02 ppm1 6.487 ppm2 4.335 CV 1
ASSI { 160}
(( segid "PX05" and resid 103 and name HE3 ))
(( segid "PX14" and resid 32 and name HA ))
3.600 1.600 1.600 peak 160 spectrum 4 weight 0.11000E+01 volume 0.13270E-02 ppm1 6.765 ppm2 4.336 CV 1
ASSI { 162}
(( segid "PX05" and resid 103 and name HE3 ))
(( segid "PX05" and resid 103 and name HB2 ))
3.800 1.800 1.800 peak 162 spectrum 4 weight 0.11000E+01 volume 0.14919E-02 ppm1 6.768 ppm2 3.100 CV 1
ASSI { 163}
(( segid "PX05" and resid 103 and name HE3 ))
(( segid "PX05" and resid 103 and name HB1 ))
2.800 1.000 1.000 peak 163 spectrum 4 weight 0.11000E+01 volume 0.16375E-02 ppm1 6.769 ppm2 3.542 CV 1
ASSI { 164}
(( segid "PX05" and resid 103 and name HE3 ))
(( segid "PX14" and resid 35 and name HB1 ))
3.200 1.300 1.300 peak 164 spectrum 4 weight 0.11000E+01 volume 0.20818E-02 ppm1 6.765 ppm2 3.698 CV 1
ASSI { 165}
(( segid "PX05" and resid 103 and name HE3 ))
(( segid "PX14" and resid 35 and name HB2 ))
2.400 0.700 0.700 peak 165 spectrum 4 weight 0.11000E+01 volume 0.43449E-02 ppm1 6.766 ppm2 3.491 CV 1
ASSI { 169}
(( segid "PX05" and resid 103 and name HZ2 ))
(( segid "PX14" and resid 56 and name HG1 ))
3.800 1.800 1.800 peak 169 spectrum 4 weight 0.11000E+01 volume 0.82605E-03 ppm1 7.466 ppm2 0.013 CV 1
ASSI { 171}
(( segid "PX05" and resid 103 and name HZ2 ))
(( segid "PX14" and resid 56 and name HG2 ))
4.600 2.600 1.400 peak 171 spectrum 4 weight 0.11000E+01 volume 0.26668E-03 ppm1 7.460 ppm2 -1.029 CV 1
ASSI { 173}
(( segid "PX05" and resid 103 and name HZ2 ))
(( segid "PX14" and resid 56 and name HB2 ))
5.000 3.100 1.000 peak 173 spectrum 4 weight 0.11000E+01 volume 0.30600E-03 ppm1 7.470 ppm2 1.219 CV 1
ASSI { 174}
(( segid "PX05" and resid 103 and name HZ2 ))
(( segid "PX14" and resid 56 and name HE2 ))
4.300 2.400 1.700 peak 174 spectrum 4 weight 0.11000E+01 volume 0.79653E-03 ppm1 7.473 ppm2 1.346 CV 1
ASSI { 175}
(( segid "PX05" and resid 112 and name HN ))
(( segid "PX05" and resid 112 and name HB2 ))
3.500 1.500 1.500 peak 175 spectrum 4 weight 0.11000E+01 volume 0.11703E-02 ppm1 7.892 ppm2 2.596 CV 1
ASSI { 176}
(( segid "PX05" and resid 112 and name HN ))
(( segid "PX05" and resid 112 and name HB1 ))
3.800 1.900 1.900 peak 176 spectrum 4 weight 0.11000E+01 volume 0.62403E-03 ppm1 7.898 ppm2 2.730 CV 1
ASSI { 177}
(( segid "PX05" and resid 105 and name HN ))
( segid "PX05" and resid 104 and name HB% )
2.900 2.900 3.100 peak 177 spectrum 4 weight 0.11000E+01 volume 0.31386E-02 ppm1 8.180 ppm2 1.688 CV 1
ASSI { 178}
( segid "PX05" and resid 107 and name HE% )
(( segid "PX05" and resid 108 and name HG ))
5.300 3.500 0.700 peak 178 spectrum 4 weight 0.11000E+01 volume 0.20989E-03 ppm1 7.384 ppm2 2.113 CV 1
ASSI { 179}
( segid "PX05" and resid 107 and name HE% )
(( segid "PX05" and resid 107 and name HB2 ))
5.800 4.100 0.200 peak 179 spectrum 4 weight 0.11000E+01 volume 0.13178E-03 ppm1 7.387 ppm2 2.228 CV 1
ASSI { 180}
(( segid "PX05" and resid 100 and name HN ))
( segid "PX05" and resid 99 and name HD2%)
5.200 3.400 0.800 peak 180 spectrum 4 weight 0.11000E+01 volume 0.26973E-03 ppm1 8.216 ppm2 0.872 CV 1
ASSI { 9}
( segid "PX05" and resid 109 and name HB% )
(( segid "PX05" and resid 106 and name HA ))
2.800 2.800 3.200 peak 9 spectrum 5 weight 0.11000E+01 volume 0.33085E-02 ppm1 1.410 ppm2 4.014 CV 1
ASSI { 22}
(( segid "PX05" and resid 94 and name HB ))
(( segid "PX05" and resid 94 and name HA ))
4.000 4.000 2.000 peak 22 spectrum 5 weight 0.11000E+01 volume 0.42921E-03 ppm1 2.026 ppm2 4.048 CV 1
ASSI { 32}
(( segid "PX05" and resid 106 and name HG2 ))
(( segid "PX05" and resid 106 and name HA ))
2.500 2.500 3.500 peak 32 spectrum 5 weight 0.11000E+01 volume 0.57689E-02 ppm1 2.231 ppm2 4.014 CV 1
ASSI { 35}
(( segid "PX05" and resid 112 and name HB1 ))
(( segid "PX05" and resid 112 and name HA ))
4.300 4.300 1.700 peak 35 spectrum 5 weight 0.11000E+01 volume 0.42787E-03 ppm1 2.585 ppm2 4.336 CV 1
ASSI { 36}
(( segid "PX05" and resid 112 and name HA ))
(( segid "PX05" and resid 112 and name HB2 ))
4.300 2.400 1.700 peak 36 spectrum 5 weight 0.11000E+01 volume 0.26992E-03 ppm1 2.440 ppm2 4.336 CV 1
ASSI { 37}
(( segid "PX05" and resid 106 and name HG1 ))
(( segid "PX05" and resid 106 and name HA ))
3.200 3.200 2.800 peak 37 spectrum 5 weight 0.11000E+01 volume 0.38154E-02 ppm1 2.528 ppm2 4.009 CV 1
ASSI { 41}
(( segid "PX05" and resid 101 and name HG2 ))
(( segid "PX05" and resid 101 and name HA ))
3.700 3.700 2.300 peak 41 spectrum 5 weight 0.11000E+01 volume 0.10689E-02 ppm1 2.245 ppm2 4.263 CV 1
ASSI { 42}
(( segid "PX05" and resid 101 and name HG1 ))
(( segid "PX05" and resid 101 and name HA ))
3.800 3.800 2.200 peak 42 spectrum 5 weight 0.11000E+01 volume 0.51939E-03 ppm1 2.302 ppm2 4.261 CV 1
ASSI { 45}
(( segid "PX05" and resid 103 and name HB1 ))
(( segid "PX05" and resid 103 and name HA ))
3.000 3.000 3.000 peak 45 spectrum 5 weight 0.11000E+01 volume 0.15191E-02 ppm1 3.393 ppm2 4.751 CV 1
ASSI { 46}
(( segid "PX05" and resid 108 and name HB1 ))
(( segid "PX05" and resid 108 and name HB2 ))
1.900 1.900 4.100 peak 46 spectrum 5 weight 0.11000E+01 volume 0.10185E-01 ppm1 1.762 ppm2 1.444 CV 1
ASSI { 55}
(( segid "PX05" and resid 108 and name HB1 ))
(( segid "PX05" and resid 108 and name HG ))
3.700 3.700 2.300 peak 55 spectrum 5 weight 0.11000E+01 volume 0.10146E-02 ppm1 1.757 ppm2 1.990 CV 1
ASSI { 59}
(( segid "PX05" and resid 96 and name HB1 ))
(( segid "PX05" and resid 96 and name HB2 ))
1.900 1.900 4.100 peak 59 spectrum 5 weight 0.11000E+01 volume 0.16542E-01 ppm1 2.660 ppm2 2.452 CV 1
ASSI { 61}
(( segid "PX05" and resid 97 and name HG ))
( segid "PX05" and resid 97 and name HD1%)
2.300 2.300 3.700 peak 61 spectrum 5 weight 0.11000E+01 volume 0.80639E-02 ppm1 1.586 ppm2 0.858 CV 1
ASSI { 62}
(( segid "PX05" and resid 97 and name HG ))
( segid "PX05" and resid 97 and name HD2%)
2.400 2.400 3.600 peak 62 spectrum 5 weight 0.11000E+01 volume 0.70481E-02 ppm1 1.586 ppm2 0.789 CV 1
ASSI { 65}
(( segid "PX05" and resid 97 and name HA ))
( segid "PX05" and resid 97 and name HD1%)
4.200 4.200 1.800 peak 65 spectrum 5 weight 0.11000E+01 volume 0.17315E-02 ppm1 4.089 ppm2 0.857 CV 1
ASSI { 76}
(( segid "PX05" and resid 99 and name HB1 ))
(( segid "PX05" and resid 99 and name HA ))
2.500 2.500 3.500 peak 76 spectrum 5 weight 0.11000E+01 volume 0.72259E-02 ppm1 1.323 ppm2 4.036 CV 1
ASSI { 83}
( segid "PX05" and resid 108 and name HD1%)
(( segid "PX05" and resid 108 and name HA ))
4.100 4.100 1.900 peak 83 spectrum 5 weight 0.11000E+01 volume 0.19730E-02 ppm1 0.777 ppm2 3.924 CV 1
ASSI { 85}
( segid "PX05" and resid 94 and name HG1%)
(( segid "PX05" and resid 94 and name HB ))
2.200 2.200 3.800 peak 85 spectrum 5 weight 0.11000E+01 volume 0.15698E-01 ppm1 0.882 ppm2 2.048 CV 1
ASSI { 99}
(( segid "PX05" and resid 97 and name HA ))
(( segid "PX05" and resid 100 and name HB1 ))
3.700 3.700 2.300 peak 99 spectrum 5 weight 0.11000E+01 volume 0.68515E-03 ppm1 4.098 ppm2 3.906 CV 1
ASSI { 102}
( segid "PX05" and resid 108 and name HD1%)
(( segid "PX05" and resid 109 and name HA ))
3.000 3.000 3.000 peak 102 spectrum 5 weight 0.11000E+01 volume 0.88227E-03 ppm1 0.785 ppm2 4.190 CV 1
ASSI { 107}
(( segid "PX05" and resid 108 and name HG ))
( segid "PX14" and resid 41 and name HG1%)
3.300 3.300 2.700 peak 107 spectrum 5 weight 0.11000E+01 volume 0.54500E-03 ppm1 1.967 ppm2 0.478 CV 1
ASSI { 111}
(( segid "PX05" and resid 100 and name HB2 ))
( segid "PX14" and resid 31 and name HG2%)
3.300 1.300 1.300 peak 111 spectrum 5 weight 0.11000E+01 volume 0.20506E-02 ppm1 3.701 ppm2 -0.094 CV 1
ASSI { 113}
(( segid "PX05" and resid 100 and name HA ))
(( segid "PX05" and resid 100 and name HB1 ))
2.400 2.400 3.600 peak 113 spectrum 5 weight 0.11000E+01 volume 0.73789E-02 ppm1 3.566 ppm2 3.899 CV 1
ASSI { 115}
(( segid "PX05" and resid 100 and name HA ))
(( segid "PX05" and resid 103 and name HB1 ))
3.500 3.500 2.500 peak 115 spectrum 5 weight 0.11000E+01 volume 0.34812E-02 ppm1 3.565 ppm2 3.401 CV 1
ASSI { 120}
(( segid "PX05" and resid 102 and name HB2 ))
( segid "PX05" and resid 99 and name HD1%)
3.400 3.400 2.600 peak 120 spectrum 5 weight 0.11000E+01 volume 0.18839E-02 ppm1 2.983 ppm2 0.911 CV 1
ASSI { 121}
(( segid "PX05" and resid 102 and name HB1 ))
( segid "PX05" and resid 99 and name HD1%)
3.600 3.600 2.400 peak 121 spectrum 5 weight 0.11000E+01 volume 0.10711E-02 ppm1 3.073 ppm2 0.910 CV 1
ASSI { 122}
(( segid "PX05" and resid 99 and name HB1 ))
( segid "PX14" and resid 31 and name HG2%)
3.000 3.000 3.000 peak 122 spectrum 5 weight 0.11000E+01 volume 0.18591E-02 ppm1 1.323 ppm2 -0.091 CV 1
ASSI { 124}
( segid "PX05" and resid 99 and name HD1%)
( segid "PX14" and resid 31 and name HG2%)
4.100 4.100 1.900 peak 124 spectrum 5 weight 0.11000E+01 volume 0.48559E-03 ppm1 0.893 ppm2 -0.098 CV 1
ASSI { 126}
(( segid "PX05" and resid 102 and name HA ))
(( segid "PX05" and resid 105 and name HG1 ))
3.200 3.200 2.800 peak 126 spectrum 5 weight 0.11000E+01 volume 0.50094E-02 ppm1 4.566 ppm2 2.227 CV 1
ASSI { 127}
(( segid "PX05" and resid 103 and name HZ3 ))
(( segid "PX14" and resid 35 and name HB2 ))
4.600 4.600 1.400 peak 127 spectrum 5 weight 0.11000E+01 volume 0.31178E-03 ppm1 6.349 ppm2 3.378 CV 1
ASSI { 137}
(( segid "PX05" and resid 103 and name HH2 ))
(( segid "PX14" and resid 56 and name HD1 ))
3.600 3.600 2.400 peak 137 spectrum 5 weight 0.11000E+01 volume 0.33016E-03 ppm1 6.858 ppm2 0.801 CV 1
ASSI { 143}
(( segid "PX05" and resid 101 and name HB1 ))
( segid "PX05" and resid 104 and name HB% )
4.900 4.900 1.100 peak 143 spectrum 5 weight 0.11000E+01 volume 0.30821E-03 ppm1 2.087 ppm2 1.566 CV 1
ASSI { 145}
(( segid "PX05" and resid 108 and name HG ))
(( segid "PX05" and resid 108 and name HA ))
3.000 3.000 3.000 peak 145 spectrum 5 weight 0.11000E+01 volume 0.29130E-02 ppm1 1.973 ppm2 3.926 CV 1
ASSI { 149}
(( segid "PX05" and resid 103 and name HD1 ))
( segid "PX14" and resid 31 and name HG2%)
4.700 4.700 1.300 peak 149 spectrum 5 weight 0.11000E+01 volume 0.22300E-03 ppm1 7.178 ppm2 -0.088 CV 1
ASSI { 175}
( segid "PX05" and resid 98 and name HB% )
(( segid "PX05" and resid 95 and name HA ))
6.000 6.000 0.000 peak 175 spectrum 5 weight 0.11000E+01 volume 0.00000E+00 ppm1 1.343 ppm2 4.148 CV 1
ASSI { 176}
(( segid "PX05" and resid 97 and name HB1 ))
(( segid "PX05" and resid 94 and name HA ))
5.500 5.500 0.500 peak 176 spectrum 5 weight 0.11000E+01 volume 0.23416E-03 ppm1 1.529 ppm2 4.059 CV 1
ASSI { 188}
(( segid "PX05" and resid 100 and name HB2 ))
(( segid "PX05" and resid 100 and name HB1 ))
2.800 2.800 3.200 peak 188 spectrum 5 weight 0.11000E+01 volume 0.12365E-02 ppm1 3.691 ppm2 3.895 CV 1
ASSI { 191}
(( segid "PX05" and resid 100 and name HB2 ))
(( segid "PX05" and resid 100 and name HA ))
3.500 3.500 2.500 peak 191 spectrum 5 weight 0.11000E+01 volume 0.10049E-02 ppm1 3.691 ppm2 3.586 CV 1
ASSI { 192}
(( segid "PX05" and resid 100 and name HB1 ))
(( segid "PX14" and resid 34 and name HB1 ))
3.900 3.900 2.100 peak 192 spectrum 5 weight 0.11000E+01 volume 0.32065E-03 ppm1 3.880 ppm2 1.884 CV 1
OR { 192}
(( segid "PX05" and resid 100 and name HB1 ))
(( segid "PX14" and resid 34 and name HD1 ))
ASSI { 193}
(( segid "PX05" and resid 100 and name HB2 ))
(( segid "PX14" and resid 34 and name HB1 ))
4.100 2.100 1.900 peak 193 spectrum 5 weight 0.11000E+01 volume 0.23620E-03 ppm1 3.693 ppm2 1.879 CV 1
OR { 193}
(( segid "PX05" and resid 100 and name HB2 ))
(( segid "PX14" and resid 34 and name HD1 ))
ASSI { 223}
(( segid "PX14" and resid 29 and name HA ))
( segid "PX14" and resid 32 and name HB% )
3.400 3.400 2.600 peak 223 spectrum 2 weight 0.11000E+01 volume 0.95265E-03 ppm1 3.369 ppm2 1.655 CV 1
OR { 223}
(( segid "PX14" and resid 29 and name HA ))
(( segid "PX14" and resid 29 and name HG11))
ASSI { 947}
( segid "PX14" and resid 66 and name HB% )
( segid "PX14" and resid 63 and name HG2%)
3.900 3.900 2.100 peak 947 spectrum 2 weight 0.11000E+01 volume 0.74158E-03 ppm1 1.295 ppm2 0.636 CV 1
OR { 947}
( segid "PX14" and resid 66 and name HB% )
( segid "PX14" and resid 33 and name HG2%)
ASSI { 973}
( segid "PX14" and resid 29 and name HD1%)
(( segid "PX14" and resid 62 and name HG2 ))
2.300 2.300 3.700 peak 973 spectrum 2 weight 0.11000E+01 volume 0.78908E-02 ppm1 0.857 ppm2 2.161 CV 1
OR { 973}
( segid "PX14" and resid 29 and name HD1%)
(( segid "PX14" and resid 65 and name HB1 ))
ASSI { 1057}
(( segid "PX14" and resid 49 and name HB2 ))
( segid "PX05" and resid 107 and name HE% )
5.000 5.000 1.000 peak 1057 spectrum 2 weight 0.11000E+01 volume 0.24414E-03 ppm1 1.616 ppm2 7.281 CV 1
OR { 1057}
(( segid "PX14" and resid 49 and name HB2 ))
( segid "PX14" and resid 67 and name HD% )
ASSI { 1086}
( segid "PX14" and resid 66 and name HB% )
( segid "PX14" and resid 29 and name HG2%)
2.600 2.600 3.400 peak 1086 spectrum 2 weight 0.11000E+01 volume 0.45931E-02 ppm1 1.286 ppm2 0.734 CV 1
OR { 1086}
( segid "PX14" and resid 66 and name HB% )
( segid "PX14" and resid 53 and name HD1%)
ASSI { 1161}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 35 and name HE% )
4.100 4.100 1.900 peak 1161 spectrum 2 weight 0.11000E+01 volume 0.31567E-03 ppm1 0.915 ppm2 6.609 CV 1
OR { 1161}
( segid "PX14" and resid 53 and name HD2%)
( segid "PX14" and resid 52 and name HE% )
ASSI { 81}
(( segid "PX05" and resid 103 and name HZ2 ))
( segid "PX14" and resid 28 and name HD2%)
2.500 2.500 3.500 peak 81 spectrum 3 weight 0.11000E+01 volume 0.44355E-02 ppm1 7.317 ppm2 0.904 CV 1
OR { 81}
(( segid "PX05" and resid 103 and name HZ2 ))
( segid "PX14" and resid 58 and name HD2%)
ASSI { 135}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 63 and name HA ))
2.400 2.400 3.600 peak 135 spectrum 3 weight 0.11000E+01 volume 0.77358E-02 ppm1 0.623 ppm2 3.283 CV 1
OR { 135}
( segid "PX14" and resid 33 and name HG2%)
(( segid "PX14" and resid 33 and name HA ))
ASSI { 202}
(( segid "PX14" and resid 40 and name HD2 ))
(( segid "PX14" and resid 40 and name HB1 ))
3.000 3.000 3.000 peak 202 spectrum 3 weight 0.11000E+01 volume 0.21517E-02 ppm1 3.122 ppm2 1.872 CV 1
OR { 202}
(( segid "PX14" and resid 50 and name HD1 ))
(( segid "PX14" and resid 50 and name HB1 ))
ASSI { 439}
( segid "PX14" and resid 53 and name HD1%)
(( segid "PX05" and resid 103 and name HZ3 ))
3.400 3.400 2.600 peak 439 spectrum 3 weight 0.11000E+01 volume 0.12456E-02 ppm1 0.708 ppm2 6.360 CV 1
OR { 439}
( segid "PX14" and resid 58 and name HD1%)
(( segid "PX05" and resid 103 and name HZ3 ))
ASSI { 543}
(( segid "PX05" and resid 103 and name HH2 ))
(( segid "PX14" and resid 56 and name HG1 ))
3.800 3.800 2.200 peak 543 spectrum 3 weight 0.11000E+01 volume 0.60206E-03 ppm1 6.847 ppm2 -0.090 CV 1
OR { 543}
(( segid "PX05" and resid 103 and name HH2 ))
( segid "PX14" and resid 31 and name HG2%)
ASSI { 546}
(( segid "PX05" and resid 103 and name HE3 ))
( segid "PX14" and resid 31 and name HG2%)
4.000 4.000 2.000 peak 546 spectrum 3 weight 0.11000E+01 volume 0.47467E-03 ppm1 6.620 ppm2 -0.089 CV 1
OR { 546}
(( segid "PX05" and resid 103 and name HE3 ))
(( segid "PX14" and resid 56 and name HG1 ))
ASSI { 769}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 50 and name HG1 ))
2.500 2.500 3.500 peak 769 spectrum 3 weight 0.11000E+01 volume 0.10087E-01 ppm1 0.617 ppm2 1.482 CV 1
OR { 769}
( segid "PX14" and resid 63 and name HG2%)
(( segid "PX14" and resid 54 and name HG1 ))
ASSI { 878}
(( segid "PX14" and resid 35 and name HA ))
( segid "PX14" and resid 33 and name HG2%)
2.400 2.400 3.600 peak 878 spectrum 3 weight 0.11000E+01 volume 0.40189E-02 ppm1 4.235 ppm2 0.648 CV 1
OR { 878}
(( segid "PX14" and resid 35 and name HA ))
( segid "PX14" and resid 63 and name HG2%)
ASSI { 906}
( segid "PX14" and resid 31 and name HG2%)
(( segid "PX05" and resid 100 and name HA ))
3.500 3.500 2.500 peak 906 spectrum 3 weight 0.11000E+01 volume 0.94903E-03 ppm1 -0.115 ppm2 3.578 CV 1
OR { 906}
( segid "PX14" and resid 31 and name HG2%)
(( segid "PX14" and resid 35 and name HB1 ))
ASSI { 1093}
(( segid "PX14" and resid 56 and name HN ))
( segid "PX14" and resid 58 and name HD2%)
5.100 5.100 0.900 peak 1093 spectrum 3 weight 0.11000E+01 volume 0.22525E-03 ppm1 6.947 ppm2 0.906 CV 1
OR { 1093}
(( segid "PX14" and resid 56 and name HN ))
( segid "PX14" and resid 53 and name HD2%)
ASSI { 1103}
( segid "PX14" and resid 35 and name HD% )
(( segid "PX14" and resid 53 and name HG ))
4.400 4.400 1.600 peak 1103 spectrum 3 weight 0.11000E+01 volume 0.34480E-03 ppm1 7.195 ppm2 1.225 CV 1
OR { 1103}
( segid "PX14" and resid 35 and name HD% )
(( segid "PX14" and resid 36 and name HB2 ))
ASSI { 1110}
(( segid "PX14" and resid 58 and name HN ))
( segid "PX14" and resid 59 and name HG2%)
4.300 2.300 1.700 peak 1110 spectrum 3 weight 0.11000E+01 volume 0.52413E-03 ppm1 7.400 ppm2 1.221 CV 1
OR { 1110}
(( segid "PX14" and resid 58 and name HN ))
(( segid "PX14" and resid 56 and name HE2 ))
OR { 1110}
(( segid "PX14" and resid 58 and name HN ))
(( segid "PX14" and resid 53 and name HG ))
ASSI { 1126}
(( segid "PX14" and resid 67 and name HB2 ))
(( segid "PX14" and resid 72 and name HB ))
4.200 4.200 1.800 peak 1126 spectrum 3 weight 0.11000E+01 volume 0.73333E-03 ppm1 2.988 ppm2 4.196 CV 1
OR { 1126}
(( segid "PX14" and resid 67 and name HB2 ))
(( segid "PX14" and resid 73 and name HA ))
ASSI { 1157}
( segid "PX05" and resid 107 and name HE% )
( segid "PX14" and resid 35 and name HE% )
3.000 3.000 3.000 peak 1157 spectrum 3 weight 0.11000E+01 volume 0.91193E-03 ppm1 7.223 ppm2 6.613 CV 1
OR { 1157}
( segid "PX05" and resid 107 and name HE% )
( segid "PX14" and resid 35 and name HE% )
OR { 1157}
( segid "PX05" and resid 107 and name HE% )
( segid "PX14" and resid 52 and name HD% )
OR { 1157}
( segid "PX05" and resid 107 and name HE% )
( segid "PX14" and resid 52 and name HD% )
ASSI { 1172}
( segid "PX14" and resid 35 and name HD% )
( segid "PX14" and resid 31 and name HG2%)
5.300 3.600 0.700 peak 1172 spectrum 3 weight 0.11000E+01 volume 0.16161E-03 ppm1 7.179 ppm2 -0.093 CV 1
OR { 1172}
(( segid "PX14" and resid 52 and name HZ ))
(( segid "PX14" and resid 56 and name HG1 ))
ASSI { 172}
(( segid "PX05" and resid 103 and name HZ3 ))
( segid "PX14" and resid 31 and name HG2%)
4.300 4.300 1.700 peak 172 spectrum 4 weight 0.11000E+01 volume 0.37773E-03 ppm1 6.490 ppm2 0.022 CV 1
OR { 172}
(( segid "PX05" and resid 103 and name HZ3 ))
(( segid "PX14" and resid 56 and name HG1 ))
ASSI { 90}
(( segid "PX05" and resid 103 and name HH2 ))
( segid "PX14" and resid 53 and name HD1%)
2.700 2.700 3.300 peak 90 spectrum 5 weight 0.11000E+01 volume 0.16886E-02 ppm1 6.858 ppm2 0.731 CV 1
OR { 90}
(( segid "PX05" and resid 103 and name HH2 ))
( segid "PX05" and resid 99 and name HD2%)
ASSI { 101}
( segid "PX05" and resid 108 and name HD2%)
(( segid "PX05" and resid 109 and name HA ))
3.100 3.100 2.900 peak 101 spectrum 5 weight 0.11000E+01 volume 0.83779E-03 ppm1 0.722 ppm2 4.191 CV 1
OR { 101}
( segid "PX05" and resid 108 and name HD2%)
(( segid "PX14" and resid 40 and name HA ))
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