NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
20778 |
2gi4   |
7189 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 106}
( segid " " and resid 119 and name HD% )
(( segid " " and resid 137 and name HG12))
5.100 3.200 0.900 peak 106 spectrum 1 weight 0.10000E+01 volume 0.88383E-03 ppm1 7.144 ppm2 0.272 CV 1
ASSI { 107}
( segid " " and resid 119 and name HD% )
( segid " " and resid 137 and name HD1%)
3.700 1.700 1.700 peak 107 spectrum 1 weight 0.10000E+01 volume 0.18452E-02 ppm1 7.143 ppm2 -0.126 CV 1
ASSI { 115}
( segid " " and resid 119 and name HD% )
( segid " " and resid 117 and name HD1%)
3.200 1.300 1.300 peak 115 spectrum 1 weight 0.10000E+01 volume 0.81168E-02 ppm1 7.142 ppm2 1.003 CV 1
ASSI { 116}
( segid " " and resid 119 and name HD% )
( segid " " and resid 117 and name HD2%)
3.500 3.500 2.500 peak 116 spectrum 1 weight 0.66052E+00 volume 0.58371E-02 ppm1 7.141 ppm2 0.842 CV 1
ASSI { 126}
( segid " " and resid 127 and name HD% )
( segid " " and resid 119 and name HE% )
3.100 3.100 2.900 peak 126 spectrum 1 weight 0.67069E+00 volume 0.92580E-03 ppm1 7.250 ppm2 6.743 CV 1
ASSI { 128}
( segid " " and resid 127 and name HD% )
(( segid " " and resid 124 and name HB2 ))
3.500 1.500 1.500 peak 128 spectrum 1 weight 0.73652E+00 volume 0.79345E-02 ppm1 7.251 ppm2 3.390 CV 1
ASSI { 140}
( segid " " and resid 135 and name HD% )
(( segid " " and resid 136 and name HN ))
5.100 3.200 0.900 peak 140 spectrum 1 weight 0.67365E+00 volume 0.83093E-03 ppm1 6.973 ppm2 8.380 CV 1
ASSI { 152}
( segid " " and resid 135 and name HD% )
( segid " " and resid 62 and name HD1%)
2.700 2.700 3.300 peak 152 spectrum 1 weight 0.69953E+00 volume 0.23345E-02 ppm1 6.970 ppm2 0.281 CV 1
ASSI { 193}
( segid " " and resid 148 and name HD% )
( segid " " and resid 145 and name HD1%)
2.300 2.300 3.700 peak 193 spectrum 1 weight 0.69886E+00 volume 0.51954E-02 ppm1 7.091 ppm2 -0.094 CV 1
ASSI { 201}
( segid " " and resid 148 and name HD% )
( segid " " and resid 149 and name HD1%)
3.300 3.300 2.700 peak 201 spectrum 1 weight 0.81839E+00 volume 0.11293E-01 ppm1 7.090 ppm2 0.175 CV 1
OR { 201}
( segid " " and resid 148 and name HD% )
( segid " " and resid 149 and name HD2%)
ASSI { 215}
( segid " " and resid 84 and name HD% )
(( segid " " and resid 85 and name HN ))
5.100 3.200 0.900 peak 215 spectrum 1 weight 0.67190E+00 volume 0.68623E-03 ppm1 7.043 ppm2 8.669 CV 1
ASSI { 221}
( segid " " and resid 84 and name HD% )
(( segid " " and resid 83 and name HB2 ))
6.000 5.700 0.000 peak 221 spectrum 1 weight 0.59089E+00 volume 0.24952E-03 ppm1 7.042 ppm2 2.110 CV 1
ASSI { 223}
( segid " " and resid 84 and name HD% )
(( segid " " and resid 106 and name HG2 ))
4.500 2.500 1.500 peak 223 spectrum 1 weight 0.60555E+00 volume 0.14329E-02 ppm1 7.042 ppm2 1.207 CV 1
OR { 223}
( segid " " and resid 84 and name HD% )
(( segid " " and resid 106 and name HG1 ))
ASSI { 225}
( segid " " and resid 84 and name HD% )
( segid " " and resid 108 and name HD2%)
3.100 1.200 1.200 peak 225 spectrum 1 weight 0.71788E+00 volume 0.86106E-02 ppm1 7.043 ppm2 0.705 CV 1
ASSI { 226}
( segid " " and resid 84 and name HD% )
( segid " " and resid 4 and name HG2%)
3.700 1.700 1.700 peak 226 spectrum 1 weight 0.58601E+00 volume 0.56979E-02 ppm1 7.045 ppm2 0.204 CV 1
OR { 226}
( segid " " and resid 84 and name HD% )
( segid " " and resid 149 and name HD1%)
ASSI { 254}
( segid " " and resid 113 and name HD% )
( segid " " and resid 108 and name HD2%)
3.700 1.700 1.700 peak 254 spectrum 1 weight 0.62952E+00 volume 0.48674E-02 ppm1 7.111 ppm2 0.725 CV 1
ASSI { 263}
( segid " " and resid 6 and name HD% )
(( segid " " and resid 86 and name HB ))
2.600 0.800 0.800 peak 263 spectrum 1 weight 0.79135E+00 volume 0.92867E-02 ppm1 6.893 ppm2 1.819 CV 1
ASSI { 265}
( segid " " and resid 6 and name HD% )
( segid " " and resid 18 and name HB% )
3.900 1.900 1.900 peak 265 spectrum 1 weight 0.68027E+00 volume 0.12963E-02 ppm1 6.895 ppm2 0.142 CV 1
ASSI { 290}
( segid " " and resid 6 and name HE% )
( segid " " and resid 149 and name HD2%)
4.900 3.000 1.100 peak 290 spectrum 1 weight 0.56394E+00 volume 0.43969E-03 ppm1 6.912 ppm2 0.156 CV 1
OR { 290}
( segid " " and resid 6 and name HE% )
( segid " " and resid 18 and name HB% )
ASSI { 308}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 22 and name HB2 ))
3.300 1.400 1.400 peak 308 spectrum 1 weight 0.66893E+00 volume 0.41956E-02 ppm1 6.919 ppm2 2.476 CV 1
ASSI { 316}
( segid " " and resid 100 and name HE% )
(( segid " " and resid 74 and name HG ))
4.300 2.400 1.700 peak 316 spectrum 1 weight 0.60781E+00 volume 0.15664E-02 ppm1 7.047 ppm2 0.587 CV 1
ASSI { 317}
( segid " " and resid 100 and name HE% )
( segid " " and resid 74 and name HD2%)
3.000 1.100 1.100 peak 317 spectrum 1 weight 0.62350E+00 volume 0.46679E-02 ppm1 7.047 ppm2 0.321 CV 1
ASSI { 373}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 67 and name HG1 ))
3.700 1.700 1.700 peak 373 spectrum 1 weight 0.63815E+00 volume 0.30218E-02 ppm1 6.631 ppm2 1.284 CV 1
OR { 373}
(( segid " " and resid 66 and name HD2 ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 426}
( segid " " and resid 119 and name HE% )
( segid " " and resid 117 and name HD1%)
4.100 2.100 1.900 peak 426 spectrum 1 weight 0.58545E+00 volume 0.32854E-02 ppm1 6.720 ppm2 1.003 CV 1
ASSI { 427}
( segid " " and resid 119 and name HE% )
(( segid " " and resid 137 and name HG12))
6.000 6.000 0.000 peak 427 spectrum 1 weight 0.59031E+00 volume 0.15623E-03 ppm1 6.723 ppm2 0.291 CV 1
ASSI { 428}
( segid " " and resid 119 and name HE% )
( segid " " and resid 137 and name HD1%)
4.500 2.600 1.500 peak 428 spectrum 1 weight 0.54664E+00 volume 0.14487E-02 ppm1 6.721 ppm2 -0.124 CV 1
ASSI { 443}
( segid " " and resid 135 and name HE% )
( segid " " and resid 62 and name HD1%)
2.600 2.600 3.400 peak 443 spectrum 1 weight 0.62946E+00 volume 0.26484E-02 ppm1 6.573 ppm2 0.296 CV 1
ASSI { 447}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 53 and name HD% )
4.800 2.800 1.200 peak 447 spectrum 1 weight 0.53531E+00 volume 0.99749E-03 ppm1 7.117 ppm2 6.746 CV 1
OR { 447}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 53 and name HE% )
ASSI { 449}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 12 and name HD1%)
4.200 2.200 1.800 peak 449 spectrum 1 weight 0.60248E+00 volume 0.12410E-02 ppm1 7.119 ppm2 0.304 CV 1
ASSI { 454}
( segid " " and resid 127 and name HE% )
(( segid " " and resid 126 and name HD1 ))
5.800 4.200 0.200 peak 454 spectrum 1 weight 0.59022E+00 volume 0.13974E-03 ppm1 6.998 ppm2 5.825 CV 1
ASSI { 456}
( segid " " and resid 127 and name HE% )
(( segid " " and resid 124 and name HB2 ))
5.500 3.700 0.500 peak 456 spectrum 1 weight 0.53062E+00 volume 0.30825E-04 ppm1 6.999 ppm2 3.418 CV 1
ASSI { 480}
( segid " " and resid 6 and name HD% )
(( segid " " and resid 19 and name HA ))
4.300 2.300 1.700 peak 480 spectrum 1 weight 0.53540E+00 volume 0.65026E-03 ppm1 6.890 ppm2 3.461 CV 1
ASSI { 481}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 19 and name HA ))
6.000 4.700 0.000 peak 481 spectrum 1 weight 0.59007E+00 volume 0.10762E-03 ppm1 6.917 ppm2 3.459 CV 1
ASSI { 482}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 86 and name HB ))
3.900 1.900 1.900 peak 482 spectrum 1 weight 0.56561E+00 volume 0.24360E-02 ppm1 6.908 ppm2 1.812 CV 1
ASSI { 483}
( segid " " and resid 127 and name HD% )
(( segid " " and resid 126 and name HD1 ))
4.800 2.900 1.200 peak 483 spectrum 1 weight 0.59378E+00 volume 0.57673E-03 ppm1 7.247 ppm2 5.812 CV 1
ASSI { 485}
( segid " " and resid 127 and name HD% )
(( segid " " and resid 124 and name HN ))
6.000 5.100 0.000 peak 485 spectrum 1 weight 0.59004E+00 volume 0.10034E-03 ppm1 7.249 ppm2 9.075 CV 1
ASSI { 486}
( segid " " and resid 127 and name HD% )
(( segid " " and resid 124 and name HB1 ))
2.900 1.100 1.100 peak 486 spectrum 1 weight 0.61096E+00 volume 0.42377E-02 ppm1 7.250 ppm2 2.744 CV 1
ASSI { 487}
( segid " " and resid 127 and name HE% )
(( segid " " and resid 126 and name HN ))
4.200 2.200 1.800 peak 487 spectrum 1 weight 0.59025E+00 volume 0.14537E-03 ppm1 7.007 ppm2 8.058 CV 1
ASSI { 520}
( segid " " and resid 100 and name HD% )
( segid " " and resid 74 and name HD2%)
4.600 2.700 1.400 peak 520 spectrum 1 weight 0.55070E+00 volume 0.16835E-02 ppm1 7.192 ppm2 0.341 CV 1
ASSI { 523}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 125 and name HB1 ))
4.400 2.400 1.600 peak 523 spectrum 1 weight 0.58573E+00 volume 0.11340E-03 ppm1 6.969 ppm2 -0.043 CV 1
ASSI { 528}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 130 and name HA ))
6.000 5.400 0.000 peak 528 spectrum 1 weight 0.59024E+00 volume 0.14194E-03 ppm1 6.967 ppm2 5.143 CV 1
ASSI { 529}
( segid " " and resid 131 and name HD% )
(( segid " " and resid 132 and name HN ))
6.000 6.000 0.000 peak 529 spectrum 1 weight 0.58981E+00 volume 0.36898E-04 ppm1 6.965 ppm2 8.307 CV 1
ASSI { 534}
( segid " " and resid 127 and name HE% )
(( segid " " and resid 126 and name HZ2 ))
3.200 3.200 2.800 peak 534 spectrum 1 weight 0.53641E+00 volume 0.73805E-03 ppm1 6.996 ppm2 7.512 CV 1
ASSI { 535}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 126 and name HD1 ))
6.000 5.300 0.000 peak 535 spectrum 1 weight 0.10000E+01 volume 0.40457E-03 ppm1 7.120 ppm2 5.821 CV 1
ASSI { 49}
(( segid " " and resid 87 and name HB ))
(( segid " " and resid 92 and name HA ))
4.700 2.800 1.300 peak 49 spectrum 1 weight 0.54059E+00 volume 0.17233E-02 ppm1 4.555 ppm2 4.750 CV 1
ASSI { 50}
(( segid " " and resid 87 and name HB ))
(( segid " " and resid 90 and name HA ))
3.200 3.200 2.800 peak 50 spectrum 1 weight 0.53732E+00 volume 0.51825E-02 ppm1 4.559 ppm2 4.653 CV 1
ASSI { 56}
(( segid " " and resid 87 and name HB ))
(( segid " " and resid 92 and name HB1 ))
3.300 1.300 1.300 peak 56 spectrum 1 weight 0.67077E+00 volume 0.69420E-02 ppm1 4.551 ppm2 2.631 CV 1
ASSI { 65}
(( segid " " and resid 101 and name HB ))
(( segid " " and resid 102 and name HA ))
5.000 3.200 1.000 peak 65 spectrum 1 weight 0.59544E+00 volume 0.11819E-02 ppm1 4.204 ppm2 4.573 CV 1
ASSI { 68}
(( segid " " and resid 101 and name HB ))
(( segid " " and resid 102 and name HB2 ))
5.400 3.700 0.600 peak 68 spectrum 1 weight 0.59359E+00 volume 0.91063E-03 ppm1 4.210 ppm2 3.080 CV 1
OR { 68}
(( segid " " and resid 101 and name HB ))
(( segid " " and resid 100 and name HB2 ))
ASSI { 76}
(( segid " " and resid 103 and name HB ))
(( segid " " and resid 106 and name HE1 ))
6.000 6.000 0.000 peak 76 spectrum 1 weight 0.40847E+00 volume 0.17134E-04 ppm1 4.006 ppm2 2.869 CV 1
OR { 76}
(( segid " " and resid 103 and name HB ))
(( segid " " and resid 106 and name HE2 ))
OR { 76}
(( segid " " and resid 103 and name HB ))
(( segid " " and resid 100 and name HB1 ))
ASSI { 93}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 13 and name HA ))
3.600 1.600 1.600 peak 93 spectrum 1 weight 0.59394E+00 volume 0.96391E-03 ppm1 4.234 ppm2 5.252 CV 1
ASSI { 115}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 74 and name HD2%)
6.000 4.800 0.000 peak 115 spectrum 1 weight 0.55645E+00 volume 0.58171E-03 ppm1 4.429 ppm2 0.345 CV 1
ASSI { 140}
(( segid " " and resid 134 and name HB ))
(( segid " " and resid 55 and name HA ))
3.600 1.600 1.600 peak 140 spectrum 1 weight 0.51454E+00 volume 0.13571E-02 ppm1 3.820 ppm2 3.684 CV 1
ASSI { 172}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 20 and name HE% )
2.800 2.800 3.200 peak 172 spectrum 1 weight 0.34357E+00 volume 0.12228E-02 ppm1 3.802 ppm2 7.316 CV 1
ASSI { 177}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 134 and name HA ))
3.500 1.500 1.500 peak 177 spectrum 1 weight 0.51172E+00 volume 0.11257E-01 ppm1 3.652 ppm2 3.546 CV 1
ASSI { 195}
(( segid " " and resid 96 and name HA ))
( segid " " and resid 74 and name HD2%)
4.500 2.600 1.500 peak 195 spectrum 1 weight 0.59542E+00 volume 0.11793E-02 ppm1 3.799 ppm2 0.335 CV 1
ASSI { 200}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 58 and name HN ))
4.300 2.300 1.700 peak 200 spectrum 1 weight 0.53159E+00 volume 0.37501E-03 ppm1 3.678 ppm2 7.084 CV 1
ASSI { 201}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 131 and name HD% )
4.600 2.600 1.400 peak 201 spectrum 1 weight 0.53853E+00 volume 0.14775E-02 ppm1 3.682 ppm2 6.990 CV 1
OR { 201}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 135 and name HD% )
ASSI { 212}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 58 and name HG1 ))
4.700 2.800 1.300 peak 212 spectrum 1 weight 0.53340E+00 volume 0.74196E-03 ppm1 3.676 ppm2 1.066 CV 1
ASSI { 213}
(( segid " " and resid 134 and name HA ))
(( segid " " and resid 137 and name HN ))
4.900 3.000 1.100 peak 213 spectrum 1 weight 0.38972E+00 volume 0.23831E-03 ppm1 3.516 ppm2 7.366 CV 1
ASSI { 215}
(( segid " " and resid 134 and name HA ))
( segid " " and resid 137 and name HD1%)
4.000 2.000 2.000 peak 215 spectrum 1 weight 0.52981E+00 volume 0.33042E-02 ppm1 3.517 ppm2 -0.100 CV 1
ASSI { 229}
(( segid " " and resid 39 and name HB1 ))
(( segid " " and resid 40 and name HN ))
5.700 4.000 0.300 peak 229 spectrum 1 weight 0.59083E+00 volume 0.39241E-03 ppm1 3.749 ppm2 8.749 CV 1
ASSI { 238}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HN ))
6.000 5.100 0.000 peak 238 spectrum 1 weight 0.41546E+00 volume 0.70185E-04 ppm1 3.777 ppm2 8.875 CV 1
ASSI { 239}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 24 and name HN ))
5.500 3.700 0.500 peak 239 spectrum 1 weight 0.42157E+00 volume 0.19478E-03 ppm1 3.777 ppm2 7.588 CV 1
OR { 239}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 20 and name HN ))
ASSI { 257}
(( segid " " and resid 142 and name HA ))
(( segid " " and resid 145 and name HN ))
3.400 1.500 1.500 peak 257 spectrum 1 weight 0.61325E+00 volume 0.30422E-02 ppm1 3.933 ppm2 9.146 CV 1
ASSI { 273}
(( segid " " and resid 142 and name HA ))
(( segid " " and resid 18 and name HA ))
6.000 5.400 0.000 peak 273 spectrum 1 weight 0.42325E+00 volume 0.11170E-03 ppm1 3.943 ppm2 3.320 CV 1
ASSI { 278}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 73 and name HA ))
4.700 2.700 1.300 peak 278 spectrum 1 weight 0.58591E+00 volume 0.82537E-03 ppm1 4.360 ppm2 4.707 CV 1
OR { 278}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 92 and name HA ))
ASSI { 285}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 74 and name HG ))
4.600 2.700 1.400 peak 285 spectrum 1 weight 0.59912E+00 volume 0.16482E-02 ppm1 4.357 ppm2 0.621 CV 1
OR { 285}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 5 and name HD2%)
ASSI { 286}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 74 and name HD2%)
4.600 2.600 1.400 peak 286 spectrum 1 weight 0.60188E+00 volume 0.30210E-02 ppm1 4.359 ppm2 0.338 CV 1
ASSI { 290}
(( segid " " and resid 142 and name HA ))
( segid " " and resid 6 and name HE% )
5.200 3.300 0.800 peak 290 spectrum 1 weight 0.37220E+00 volume 0.28433E-03 ppm1 3.943 ppm2 6.905 CV 1
ASSI { 292}
(( segid " " and resid 142 and name HA ))
( segid " " and resid 18 and name HB% )
3.000 3.000 3.000 peak 292 spectrum 1 weight 0.45690E+00 volume 0.73596E-02 ppm1 3.939 ppm2 0.135 CV 1
ASSI { 302}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 16 and name HD1 ))
6.000 4.900 0.000 peak 302 spectrum 1 weight 0.28029E+00 volume 0.12470E-03 ppm1 4.761 ppm2 3.139 CV 1
OR { 302}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 11 and name HB1 ))
ASSI { 305}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 74 and name HN ))
4.200 2.200 1.800 peak 305 spectrum 1 weight 0.56229E+00 volume 0.10233E-02 ppm1 4.357 ppm2 9.314 CV 1
ASSI { 317}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 80 and name HN ))
4.000 2.000 2.000 peak 317 spectrum 1 weight 0.59272E+00 volume 0.76659E-03 ppm1 3.783 ppm2 8.540 CV 1
ASSI { 402}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 21 and name HN ))
4.400 2.500 1.600 peak 402 spectrum 1 weight 0.53614E+00 volume 0.60558E-03 ppm1 4.383 ppm2 8.593 CV 1
OR { 402}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 23 and name HN ))
ASSI { 440}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 114 and name HA ))
3.500 3.500 2.500 peak 440 spectrum 1 weight 0.41776E+00 volume 0.61955E-02 ppm1 4.242 ppm2 4.979 CV 1
ASSI { 445}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 47 and name HB2 ))
5.100 3.300 0.900 peak 445 spectrum 1 weight 0.46836E+00 volume 0.46533E-03 ppm1 4.030 ppm2 2.505 CV 1
OR { 445}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 47 and name HB1 ))
ASSI { 450}
(( segid " " and resid 114 and name HB2 ))
(( segid " " and resid 115 and name HD2 ))
6.000 6.000 0.000 peak 450 spectrum 1 weight 0.58982E+00 volume 0.69365E-04 ppm1 3.243 ppm2 3.458 CV 1
OR { 450}
(( segid " " and resid 114 and name HB1 ))
(( segid " " and resid 115 and name HD2 ))
ASSI { 460}
(( segid " " and resid 123 and name HA ))
(( segid " " and resid 119 and name HA ))
5.800 4.300 0.200 peak 460 spectrum 1 weight 0.45832E+00 volume 0.19774E-03 ppm1 4.406 ppm2 4.612 CV 1
ASSI { 468}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 113 and name HB1 ))
3.600 1.600 1.600 peak 468 spectrum 1 weight 0.45204E+00 volume 0.11113E-02 ppm1 4.219 ppm2 3.092 CV 1
ASSI { 471}
(( segid " " and resid 110 and name HA ))
( segid " " and resid 119 and name HE% )
6.000 6.000 0.000 peak 471 spectrum 1 weight 0.48434E+00 volume 0.11798E-03 ppm1 4.213 ppm2 6.718 CV 1
ASSI { 479}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 109 and name HA ))
5.000 3.200 1.000 peak 479 spectrum 1 weight 0.58531E+00 volume 0.61011E-03 ppm1 4.216 ppm2 4.582 CV 1
ASSI { 493}
(( segid " " and resid 135 and name HA ))
(( segid " " and resid 138 and name HN ))
4.100 2.100 1.900 peak 493 spectrum 1 weight 0.59382E+00 volume 0.94645E-03 ppm1 3.861 ppm2 8.175 CV 1
ASSI { 497}
(( segid " " and resid 135 and name HA ))
( segid " " and resid 138 and name HD1%)
3.700 1.700 1.700 peak 497 spectrum 1 weight 0.57574E+00 volume 0.47020E-02 ppm1 3.864 ppm2 0.720 CV 1
ASSI { 548}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 100 and name HB2 ))
4.000 2.000 2.000 peak 548 spectrum 1 weight 0.52134E+00 volume 0.62890E-03 ppm1 4.117 ppm2 3.075 CV 1
OR { 548}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 102 and name HB2 ))
ASSI { 571}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 7 and name HN ))
2.800 0.900 0.900 peak 571 spectrum 1 weight 0.65218E+00 volume 0.58348E-02 ppm1 5.185 ppm2 9.182 CV 1
ASSI { 572}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 86 and name HA ))
3.400 1.500 1.500 peak 572 spectrum 1 weight 0.55765E+00 volume 0.33427E-02 ppm1 5.183 ppm2 5.341 CV 1
OR { 572}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 8 and name HA ))
ASSI { 576}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 92 and name HB1 ))
4.800 2.900 1.200 peak 576 spectrum 1 weight 0.59704E+00 volume 0.13941E-02 ppm1 5.181 ppm2 2.636 CV 1
ASSI { 581}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 100 and name HA ))
5.700 4.100 0.300 peak 581 spectrum 1 weight 0.52147E+00 volume 0.25844E-03 ppm1 4.414 ppm2 4.903 CV 1
ASSI { 605}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 88 and name HA ))
4.300 2.300 1.700 peak 605 spectrum 1 weight 0.50718E+00 volume 0.14300E-02 ppm1 5.185 ppm2 5.061 CV 1
ASSI { 609}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 100 and name HB2 ))
5.200 3.300 0.800 peak 609 spectrum 1 weight 0.59346E+00 volume 0.89000E-03 ppm1 4.409 ppm2 3.076 CV 1
OR { 609}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 102 and name HB2 ))
ASSI { 630}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 26 and name HN ))
4.700 2.800 1.300 peak 630 spectrum 1 weight 0.59084E+00 volume 0.39499E-03 ppm1 3.746 ppm2 8.702 CV 1
ASSI { 638}
(( segid " " and resid 139 and name HB1 ))
( segid " " and resid 135 and name HE% )
5.700 4.000 0.300 peak 638 spectrum 1 weight 0.66688E+00 volume 0.13345E-03 ppm1 3.421 ppm2 6.594 CV 1
ASSI { 655}
(( segid " " and resid 139 and name HB2 ))
( segid " " and resid 135 and name HE% )
4.400 2.500 1.600 peak 655 spectrum 1 weight 0.57889E+00 volume 0.55103E-03 ppm1 2.949 ppm2 6.577 CV 1
ASSI { 656}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 108 and name HN ))
2.200 0.600 0.600 peak 656 spectrum 1 weight 0.75361E+00 volume 0.11102E-01 ppm1 5.446 ppm2 9.156 CV 1
ASSI { 657}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 85 and name HN ))
3.800 1.800 1.800 peak 657 spectrum 1 weight 0.59454E+00 volume 0.10541E-02 ppm1 5.447 ppm2 8.717 CV 1
ASSI { 659}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 84 and name HA ))
3.300 3.300 2.700 peak 659 spectrum 1 weight 0.57862E+00 volume 0.49389E-03 ppm1 5.447 ppm2 5.161 CV 1
OR { 659}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 87 and name HA ))
ASSI { 660}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 85 and name HA ))
6.000 6.000 0.000 peak 660 spectrum 1 weight 0.52759E+00 volume 0.34141E-04 ppm1 5.445 ppm2 5.054 CV 1
ASSI { 679}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 16 and name HG2 ))
2.900 1.100 1.100 peak 679 spectrum 1 weight 0.48847E+00 volume 0.72221E-02 ppm1 3.827 ppm2 1.138 CV 1
OR { 679}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 134 and name HG2%)
ASSI { 695}
(( segid " " and resid 150 and name HA ))
( segid " " and resid 149 and name HD2%)
3.500 3.500 2.500 peak 695 spectrum 1 weight 0.54706E+00 volume 0.34934E-03 ppm1 4.437 ppm2 0.223 CV 1
OR { 695}
(( segid " " and resid 150 and name HA ))
( segid " " and resid 149 and name HD1%)
ASSI { 709}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 59 and name HD1%)
4.000 2.000 2.000 peak 709 spectrum 1 weight 0.60862E+00 volume 0.26287E-02 ppm1 3.273 ppm2 0.523 CV 1
ASSI { 710}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 55 and name HN ))
6.000 6.000 0.000 peak 710 spectrum 1 weight 0.58996E+00 volume 0.13242E-03 ppm1 3.265 ppm2 6.660 CV 1
ASSI { 711}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 40 and name HN ))
3.600 1.600 1.600 peak 711 spectrum 1 weight 0.59353E+00 volume 0.89997E-03 ppm1 5.514 ppm2 8.760 CV 1
ASSI { 712}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HN ))
2.900 1.000 1.000 peak 712 spectrum 1 weight 0.60590E+00 volume 0.23691E-02 ppm1 5.515 ppm2 7.925 CV 1
ASSI { 724}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 5 and name HN ))
2.200 0.600 0.600 peak 724 spectrum 1 weight 0.69804E+00 volume 0.84232E-02 ppm1 4.528 ppm2 8.403 CV 1
ASSI { 741}
(( segid " " and resid 122 and name HA ))
(( segid " " and resid 123 and name HD1 ))
2.900 1.100 1.100 peak 741 spectrum 1 weight 0.63860E+00 volume 0.49543E-02 ppm1 4.086 ppm2 3.284 CV 1
ASSI { 744}
(( segid " " and resid 122 and name HA ))
( segid " " and resid 137 and name HG2%)
4.300 2.300 1.700 peak 744 spectrum 1 weight 0.53817E+00 volume 0.14324E-02 ppm1 4.084 ppm2 0.669 CV 1
ASSI { 745}
(( segid " " and resid 122 and name HA ))
( segid " " and resid 137 and name HD1%)
4.000 2.000 2.000 peak 745 spectrum 1 weight 0.61610E+00 volume 0.32834E-02 ppm1 4.084 ppm2 -0.104 CV 1
ASSI { 762}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 55 and name HG2%)
3.300 1.300 1.300 peak 762 spectrum 1 weight 0.65278E+00 volume 0.91296E-02 ppm1 3.650 ppm2 1.217 CV 1
ASSI { 772}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HA ))
4.300 2.300 1.700 peak 772 spectrum 1 weight 0.58589E+00 volume 0.18186E-02 ppm1 5.517 ppm2 5.359 CV 1
OR { 772}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 6 and name HA ))
OR { 772}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 41 and name HA2 ))
ASSI { 774}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 37 and name HA ))
5.200 3.300 0.800 peak 774 spectrum 1 weight 0.57057E+00 volume 0.54156E-03 ppm1 4.533 ppm2 4.718 CV 1
ASSI { 775}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 84 and name HN ))
3.200 1.300 1.300 peak 775 spectrum 1 weight 0.59876E+00 volume 0.16059E-02 ppm1 4.522 ppm2 7.425 CV 1
ASSI { 785}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 32 and name HG2 ))
3.500 1.500 1.500 peak 785 spectrum 1 weight 0.44913E+00 volume 0.31526E-02 ppm1 4.207 ppm2 2.292 CV 1
OR { 785}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 117 and name HB2 ))
ASSI { 815}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 80 and name HN ))
4.200 2.200 1.800 peak 815 spectrum 1 weight 0.59355E+00 volume 0.90312E-03 ppm1 4.079 ppm2 8.528 CV 1
ASSI { 816}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 80 and name HB2 ))
3.000 1.100 1.100 peak 816 spectrum 1 weight 0.55504E+00 volume 0.31243E-02 ppm1 4.075 ppm2 2.640 CV 1
ASSI { 831}
(( segid " " and resid 104 and name HA ))
( segid " " and resid 97 and name HD2%)
3.600 3.600 2.400 peak 831 spectrum 1 weight 0.71112E+00 volume 0.90881E-02 ppm1 3.878 ppm2 0.409 CV 1
ASSI { 837}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 108 and name HN ))
2.100 0.500 0.500 peak 837 spectrum 1 weight 0.77853E+00 volume 0.12200E-01 ppm1 5.355 ppm2 9.157 CV 1
ASSI { 845}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 127 and name HE% )
5.100 3.200 0.900 peak 845 spectrum 1 weight 0.59300E+00 volume 0.97310E-03 ppm1 5.262 ppm2 6.999 CV 1
ASSI { 851}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 4 and name HG2%)
4.700 2.800 1.300 peak 851 spectrum 1 weight 0.56305E+00 volume 0.14640E-02 ppm1 4.743 ppm2 0.270 CV 1
ASSI { 852}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HN ))
2.400 0.700 0.700 peak 852 spectrum 1 weight 0.67173E+00 volume 0.69964E-02 ppm1 4.738 ppm2 8.563 CV 1
ASSI { 860}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 3 and name HA ))
5.400 3.600 0.600 peak 860 spectrum 1 weight 0.54534E+00 volume 0.62183E-03 ppm1 4.445 ppm2 5.452 CV 1
ASSI { 863}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HB2 ))
6.000 5.500 0.000 peak 863 spectrum 1 weight 0.50054E+00 volume 0.18776E-03 ppm1 3.492 ppm2 2.635 CV 1
ASSI { 867}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 87 and name HB ))
6.000 5.100 0.000 peak 867 spectrum 1 weight 0.39833E+00 volume 0.20814E-03 ppm1 5.385 ppm2 4.588 CV 1
OR { 867}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 109 and name HA ))
ASSI { 874}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 67 and name HN ))
3.800 3.800 2.200 peak 874 spectrum 1 weight 0.55144E+00 volume 0.29870E-02 ppm1 4.816 ppm2 7.436 CV 1
ASSI { 877}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 4 and name HN ))
3.200 1.300 1.300 peak 877 spectrum 1 weight 0.59529E+00 volume 0.11620E-02 ppm1 4.745 ppm2 9.409 CV 1
ASSI { 885}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 84 and name HN ))
4.900 3.000 1.100 peak 885 spectrum 1 weight 0.59265E+00 volume 0.75490E-03 ppm1 4.450 ppm2 7.420 CV 1
ASSI { 888}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 3 and name HB1 ))
1.500 0.300 0.700 peak 888 spectrum 1 weight 0.86391E+00 volume 0.19474E-01 ppm1 4.455 ppm2 2.091 CV 1
ASSI { 889}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 3 and name HB2 ))
1.800 0.400 0.400 peak 889 spectrum 1 weight 0.86391E+00 volume 0.20585E-01 ppm1 4.454 ppm2 1.984 CV 1
ASSI { 890}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 3 and name HD1 ))
4.000 2.000 2.000 peak 890 spectrum 1 weight 0.52986E+00 volume 0.46766E-02 ppm1 4.451 ppm2 1.733 CV 1
ASSI { 892}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 3 and name HG2 ))
4.600 2.700 1.400 peak 892 spectrum 1 weight 0.60173E+00 volume 0.19419E-02 ppm1 4.453 ppm2 1.374 CV 1
ASSI { 895}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 23 and name HN ))
6.000 5.000 0.000 peak 895 spectrum 1 weight 0.54623E+00 volume 0.68691E-04 ppm1 3.481 ppm2 8.606 CV 1
OR { 895}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 21 and name HN ))
ASSI { 903}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 18 and name HB% )
4.800 2.900 1.200 peak 903 spectrum 1 weight 0.59155E+00 volume 0.55069E-03 ppm1 3.483 ppm2 0.140 CV 1
ASSI { 907}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 67 and name HN ))
3.800 3.800 2.200 peak 907 spectrum 1 weight 0.48382E+00 volume 0.32443E-02 ppm1 4.822 ppm2 7.305 CV 1
ASSI { 911}
(( segid " " and resid 133 and name HA ))
( segid " " and resid 137 and name HD1%)
4.900 3.000 1.100 peak 911 spectrum 1 weight 0.59097E+00 volume 0.42523E-03 ppm1 3.927 ppm2 -0.100 CV 1
ASSI { 913}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 79 and name HN ))
3.200 1.300 1.300 peak 913 spectrum 1 weight 0.60680E+00 volume 0.24562E-02 ppm1 3.845 ppm2 7.530 CV 1
ASSI { 916}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 100 and name HE% )
2.900 1.100 1.100 peak 916 spectrum 1 weight 0.55808E+00 volume 0.35000E-02 ppm1 3.846 ppm2 7.083 CV 1
ASSI { 918}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 100 and name HB2 ))
4.900 3.000 1.100 peak 918 spectrum 1 weight 0.53534E+00 volume 0.10509E-02 ppm1 3.846 ppm2 3.102 CV 1
ASSI { 922}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HN ))
2.600 0.800 0.800 peak 922 spectrum 1 weight 0.57528E+00 volume 0.46700E-02 ppm1 5.740 ppm2 8.771 CV 1
ASSI { 925}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 5 and name HA ))
4.200 2.200 1.800 peak 925 spectrum 1 weight 0.60170E+00 volume 0.19382E-02 ppm1 5.744 ppm2 4.815 CV 1
ASSI { 928}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 6 and name HB1 ))
4.200 2.200 1.800 peak 928 spectrum 1 weight 0.60250E+00 volume 0.20236E-02 ppm1 5.742 ppm2 2.773 CV 1
ASSI { 931}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 5 and name HD2%)
2.900 1.100 1.100 peak 931 spectrum 1 weight 0.69070E+00 volume 0.80380E-02 ppm1 5.743 ppm2 0.590 CV 1
OR { 931}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 5 and name HD1%)
ASSI { 937}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 74 and name HG ))
3.400 1.500 1.500 peak 937 spectrum 1 weight 0.60151E+00 volume 0.19183E-02 ppm1 4.836 ppm2 0.616 CV 1
OR { 937}
(( segid " " and resid 75 and name HA ))
( segid " " and resid 5 and name HD1%)
ASSI { 938}
(( segid " " and resid 75 and name HA ))
( segid " " and resid 74 and name HD2%)
5.300 3.500 0.700 peak 938 spectrum 1 weight 0.59160E+00 volume 0.56096E-03 ppm1 4.844 ppm2 0.342 CV 1
ASSI { 948}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 43 and name HA ))
2.600 2.600 3.400 peak 948 spectrum 1 weight 0.49723E+00 volume 0.40220E-02 ppm1 4.836 ppm2 4.503 CV 1
OR { 948}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 99 and name HA ))
OR { 948}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 82 and name HA ))
ASSI { 957}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HN ))
4.000 2.000 2.000 peak 957 spectrum 1 weight 0.59281E+00 volume 0.15129E-02 ppm1 4.555 ppm2 8.263 CV 1
ASSI { 961}
(( segid " " and resid 132 and name HA ))
(( segid " " and resid 58 and name HG1 ))
4.400 2.500 1.600 peak 961 spectrum 1 weight 0.57023E+00 volume 0.34695E-03 ppm1 4.395 ppm2 1.085 CV 1
ASSI { 976}
(( segid " " and resid 146 and name HA ))
(( segid " " and resid 147 and name HA ))
4.800 2.900 1.200 peak 976 spectrum 1 weight 0.51326E+00 volume 0.54914E-03 ppm1 3.705 ppm2 3.556 CV 1
OR { 976}
(( segid " " and resid 146 and name HA ))
(( segid " " and resid 145 and name HA ))
ASSI { 986}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HN ))
2.500 0.800 0.800 peak 986 spectrum 1 weight 0.61165E+00 volume 0.52575E-02 ppm1 5.373 ppm2 9.199 CV 1
ASSI { 1002}
(( segid " " and resid 132 and name HA ))
(( segid " " and resid 58 and name HN ))
4.000 2.000 2.000 peak 1002 spectrum 1 weight 0.59014E+00 volume 0.20146E-03 ppm1 4.405 ppm2 7.120 CV 1
OR { 1002}
(( segid " " and resid 132 and name HA ))
( segid " " and resid 119 and name HD% )
ASSI { 1008}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 12 and name HD1%)
4.700 2.800 1.300 peak 1008 spectrum 1 weight 0.59136E+00 volume 0.50995E-03 ppm1 4.267 ppm2 0.324 CV 1
ASSI { 1012}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HN ))
3.600 1.700 1.700 peak 1012 spectrum 1 weight 0.59505E+00 volume 0.11273E-02 ppm1 4.107 ppm2 8.251 CV 1
ASSI { 1019}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 26 and name HN ))
4.400 2.500 1.600 peak 1019 spectrum 1 weight 0.51193E+00 volume 0.52665E-03 ppm1 3.955 ppm2 8.685 CV 1
ASSI { 1026}
(( segid " " and resid 146 and name HA ))
( segid " " and resid 149 and name HD2%)
3.400 1.400 1.400 peak 1026 spectrum 1 weight 0.60865E+00 volume 0.38224E-02 ppm1 3.696 ppm2 0.247 CV 1
ASSI { 1030}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 86 and name HN ))
3.900 1.900 1.900 peak 1030 spectrum 1 weight 0.53267E+00 volume 0.60714E-03 ppm1 5.368 ppm2 9.086 CV 1
ASSI { 1046}
(( segid " " and resid 132 and name HA ))
( segid " " and resid 135 and name HD% )
4.200 2.200 1.800 peak 1046 spectrum 1 weight 0.42536E+00 volume 0.10719E-02 ppm1 4.395 ppm2 7.000 CV 1
ASSI { 1048}
(( segid " " and resid 132 and name HA ))
(( segid " " and resid 58 and name HE2 ))
3.200 1.200 1.200 peak 1048 spectrum 1 weight 0.62926E+00 volume 0.43012E-02 ppm1 4.401 ppm2 2.388 CV 1
ASSI { 1050}
(( segid " " and resid 132 and name HA ))
(( segid " " and resid 58 and name HD1 ))
3.500 1.500 1.500 peak 1050 spectrum 1 weight 0.57707E+00 volume 0.47941E-02 ppm1 4.400 ppm2 1.552 CV 1
ASSI { 1056}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 21 and name HD1%)
4.500 2.500 1.500 peak 1056 spectrum 1 weight 0.51942E+00 volume 0.99743E-03 ppm1 4.094 ppm2 0.558 CV 1
OR { 1056}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 146 and name HD2%)
ASSI { 1057}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 24 and name HN ))
6.000 5.000 0.000 peak 1057 spectrum 1 weight 0.59045E+00 volume 0.29503E-03 ppm1 3.960 ppm2 7.555 CV 1
ASSI { 1071}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 62 and name HD1%)
4.500 2.600 1.500 peak 1071 spectrum 1 weight 0.58891E+00 volume 0.19245E-02 ppm1 3.774 ppm2 0.309 CV 1
ASSI { 1084}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 49 and name HA ))
1.800 1.800 4.200 peak 1084 spectrum 1 weight 0.61636E+00 volume 0.18320E-01 ppm1 4.606 ppm2 4.422 CV 1
ASSI { 1093}
(( segid " " and resid 145 and name HA ))
( segid " " and resid 149 and name HD2%)
5.500 3.700 0.500 peak 1093 spectrum 1 weight 0.54280E+00 volume 0.28511E-03 ppm1 3.527 ppm2 0.196 CV 1
OR { 1093}
(( segid " " and resid 145 and name HA ))
( segid " " and resid 149 and name HD1%)
ASSI { 1094}
(( segid " " and resid 145 and name HA ))
( segid " " and resid 148 and name HD% )
4.000 2.000 2.000 peak 1094 spectrum 1 weight 0.59841E+00 volume 0.15636E-02 ppm1 3.521 ppm2 7.117 CV 1
ASSI { 1110}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 47 and name HB1 ))
6.000 6.000 0.000 peak 1110 spectrum 1 weight 0.53073E+00 volume 0.10899E-03 ppm1 5.306 ppm2 2.549 CV 1
OR { 1110}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 47 and name HB2 ))
ASSI { 1116}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 92 and name HB1 ))
5.400 3.700 0.600 peak 1116 spectrum 1 weight 0.58031E+00 volume 0.28492E-03 ppm1 5.301 ppm2 2.624 CV 1
ASSI { 1119}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 99 and name HA ))
4.500 2.500 1.500 peak 1119 spectrum 1 weight 0.46635E+00 volume 0.10316E-02 ppm1 4.229 ppm2 4.492 CV 1
ASSI { 1129}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 9 and name HD1%)
6.000 4.600 0.000 peak 1129 spectrum 1 weight 0.54450E+00 volume 0.48010E-03 ppm1 5.309 ppm2 1.086 CV 1
OR { 1129}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 87 and name HG2%)
ASSI { 1132}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 106 and name HA ))
4.900 3.000 1.100 peak 1132 spectrum 1 weight 0.51712E+00 volume 0.61074E-03 ppm1 5.136 ppm2 4.654 CV 1
ASSI { 1166}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HN ))
3.400 1.400 1.400 peak 1166 spectrum 1 weight 0.59020E+00 volume 0.15468E-02 ppm1 5.559 ppm2 8.870 CV 1
ASSI { 1204}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 84 and name HN ))
3.900 1.900 1.900 peak 1204 spectrum 1 weight 0.60111E+00 volume 0.18740E-02 ppm1 4.442 ppm2 7.436 CV 1
ASSI { 1228}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 35 and name HB1 ))
5.400 3.700 0.600 peak 1228 spectrum 1 weight 0.42929E+00 volume 0.75933E-03 ppm1 5.484 ppm2 2.727 CV 1
OR { 1228}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 38 and name HB2 ))
OR { 1228}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 38 and name HB1 ))
ASSI { 1239}
(( segid " " and resid 124 and name HA ))
(( segid " " and resid 125 and name HB2 ))
4.200 2.200 1.800 peak 1239 spectrum 1 weight 0.50917E+00 volume 0.30941E-02 ppm1 4.735 ppm2 1.067 CV 1
ASSI { 1242}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 84 and name HA ))
3.700 1.700 1.700 peak 1242 spectrum 1 weight 0.61418E+00 volume 0.31220E-02 ppm1 4.654 ppm2 5.145 CV 1
ASSI { 1264}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 46 and name HA ))
3.600 1.600 1.600 peak 1264 spectrum 1 weight 0.63226E+00 volume 0.45159E-02 ppm1 3.944 ppm2 4.826 CV 1
OR { 1264}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 12 and name HA ))
OR { 1264}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 9 and name HA ))
ASSI { 1266}
(( segid " " and resid 149 and name HA ))
( segid " " and resid 148 and name HD% )
3.600 1.600 1.600 peak 1266 spectrum 1 weight 0.60153E+00 volume 0.19201E-02 ppm1 3.774 ppm2 7.118 CV 1
ASSI { 1271}
(( segid " " and resid 149 and name HA ))
( segid " " and resid 145 and name HD1%)
3.800 3.800 2.200 peak 1271 spectrum 1 weight 0.59019E+00 volume 0.21587E-03 ppm1 3.779 ppm2 -0.071 CV 1
ASSI { 1274}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HN ))
2.200 0.600 0.600 peak 1274 spectrum 1 weight 0.62707E+00 volume 0.77993E-02 ppm1 5.460 ppm2 9.407 CV 1
ASSI { 1288}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 113 and name HB1 ))
3.700 1.700 1.700 peak 1288 spectrum 1 weight 0.54286E+00 volume 0.19741E-02 ppm1 4.972 ppm2 3.095 CV 1
OR { 1288}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 144 and name HB1 ))
ASSI { 1317}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 82 and name HA ))
6.000 4.600 0.000 peak 1317 spectrum 1 weight 0.57971E+00 volume 0.32369E-03 ppm1 5.463 ppm2 4.470 CV 1
ASSI { 1321}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 113 and name HB2 ))
4.600 2.600 1.400 peak 1321 spectrum 1 weight 0.56450E+00 volume 0.58909E-03 ppm1 4.980 ppm2 3.619 CV 1
OR { 1321}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 144 and name HB2 ))
ASSI { 1349}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 87 and name HA ))
4.400 2.400 1.600 peak 1349 spectrum 1 weight 0.53309E+00 volume 0.68688E-03 ppm1 5.042 ppm2 5.175 CV 1
OR { 1349}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 89 and name HA ))
ASSI { 1360}
(( segid " " and resid 90 and name HA ))
( segid " " and resid 119 and name HE% )
5.800 4.300 0.200 peak 1360 spectrum 1 weight 0.42925E+00 volume 0.23742E-03 ppm1 4.672 ppm2 6.755 CV 1
ASSI { 1371}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 87 and name HN ))
3.300 1.400 1.400 peak 1371 spectrum 1 weight 0.54202E+00 volume 0.18827E-02 ppm1 4.588 ppm2 9.158 CV 1
ASSI { 1380}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 12 and name HA ))
3.600 1.600 1.600 peak 1380 spectrum 1 weight 0.44005E+00 volume 0.64120E-02 ppm1 4.323 ppm2 4.775 CV 1
ASSI { 1392}
(( segid " " and resid 144 and name HA ))
(( segid " " and resid 147 and name HB ))
2.600 0.800 0.800 peak 1392 spectrum 1 weight 0.73883E+00 volume 0.11006E-01 ppm1 4.652 ppm2 2.291 CV 1
ASSI { 1395}
(( segid " " and resid 144 and name HA ))
(( segid " " and resid 145 and name HN ))
3.700 1.700 1.700 peak 1395 spectrum 1 weight 0.54353E+00 volume 0.20455E-02 ppm1 4.646 ppm2 9.149 CV 1
ASSI { 1402}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 65 and name HG2 ))
5.100 3.200 0.900 peak 1402 spectrum 1 weight 0.57625E+00 volume 0.84835E-03 ppm1 4.188 ppm2 2.311 CV 1
ASSI { 1405}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 47 and name HB2 ))
3.900 1.900 1.900 peak 1405 spectrum 1 weight 0.59671E+00 volume 0.13524E-02 ppm1 4.831 ppm2 2.526 CV 1
ASSI { 1423}
(( segid " " and resid 141 and name HA ))
(( segid " " and resid 114 and name HA ))
3.500 3.500 2.500 peak 1423 spectrum 1 weight 0.59729E+00 volume 0.14258E-02 ppm1 4.173 ppm2 4.966 CV 1
ASSI { 1429}
(( segid " " and resid 141 and name HA ))
(( segid " " and resid 145 and name HN ))
6.000 6.000 0.000 peak 1429 spectrum 1 weight 0.53058E+00 volume 0.17339E-04 ppm1 4.163 ppm2 9.138 CV 1
ASSI { 1439}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 41 and name HA2 ))
6.000 5.000 0.000 peak 1439 spectrum 1 weight 0.66725E+00 volume 0.25746E-03 ppm1 3.883 ppm2 5.332 CV 1
ASSI { 1441}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 41 and name HA1 ))
4.700 2.800 1.300 peak 1441 spectrum 1 weight 0.53461E+00 volume 0.94058E-03 ppm1 3.884 ppm2 3.604 CV 1
OR { 1441}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 17 and name HA ))
ASSI { 1443}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HN ))
3.500 1.500 1.500 peak 1443 spectrum 1 weight 0.59926E+00 volume 0.16650E-02 ppm1 3.587 ppm2 7.378 CV 1
ASSI { 1450}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 20 and name HB1 ))
3.200 3.200 2.800 peak 1450 spectrum 1 weight 0.59137E+00 volume 0.51313E-03 ppm1 3.578 ppm2 3.338 CV 1
ASSI { 1451}
(( segid " " and resid 66 and name HA ))
( segid " " and resid 59 and name HD1%)
2.700 2.700 3.300 peak 1451 spectrum 1 weight 0.59952E+00 volume 0.16951E-02 ppm1 3.582 ppm2 0.521 CV 1
ASSI { 1461}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 74 and name HN ))
2.200 0.600 0.600 peak 1461 spectrum 1 weight 0.66135E+00 volume 0.63930E-02 ppm1 4.723 ppm2 9.304 CV 1
ASSI { 1466}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 74 and name HG ))
5.700 4.000 0.300 peak 1466 spectrum 1 weight 0.59329E+00 volume 0.86284E-03 ppm1 4.723 ppm2 0.636 CV 1
OR { 1466}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 5 and name HD2%)
OR { 1466}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 7 and name HD1%)
ASSI { 1467}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 89 and name HA ))
2.500 0.800 0.800 peak 1467 spectrum 1 weight 0.66267E+00 volume 0.75151E-02 ppm1 4.432 ppm2 5.140 CV 1
ASSI { 1478}
(( segid " " and resid 1 and name HA ))
(( segid " " and resid 35 and name HA ))
5.300 3.500 0.700 peak 1478 spectrum 1 weight 0.59073E+00 volume 0.36653E-03 ppm1 4.049 ppm2 5.569 CV 1
ASSI { 1490}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 22 and name HN ))
4.000 2.000 2.000 peak 1490 spectrum 1 weight 0.59138E+00 volume 0.95636E-03 ppm1 3.310 ppm2 8.876 CV 1
ASSI { 1491}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 21 and name HN ))
4.100 2.100 1.900 peak 1491 spectrum 1 weight 0.59734E+00 volume 0.14323E-02 ppm1 3.315 ppm2 8.618 CV 1
ASSI { 1492}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 19 and name HN ))
4.500 2.600 1.500 peak 1492 spectrum 1 weight 0.59078E+00 volume 0.37968E-03 ppm1 3.313 ppm2 8.167 CV 1
ASSI { 1500}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 21 and name HD1%)
2.800 1.000 1.000 peak 1500 spectrum 1 weight 0.63300E+00 volume 0.45682E-02 ppm1 3.312 ppm2 0.523 CV 1
ASSI { 1511}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 41 and name HN ))
3.900 1.900 1.900 peak 1511 spectrum 1 weight 0.52512E+00 volume 0.57056E-03 ppm1 4.719 ppm2 8.750 CV 1
ASSI { 1514}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 74 and name HB2 ))
5.100 3.200 0.900 peak 1514 spectrum 1 weight 0.57233E+00 volume 0.13141E-02 ppm1 4.716 ppm2 0.793 CV 1
OR { 1514}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 7 and name HG2%)
ASSI { 1521}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 122 and name HN ))
3.300 1.400 1.400 peak 1521 spectrum 1 weight 0.59412E+00 volume 0.99174E-03 ppm1 4.434 ppm2 8.048 CV 1
ASSI { 1538}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 35 and name HN ))
3.800 1.800 1.800 peak 1538 spectrum 1 weight 0.52892E+00 volume 0.92935E-03 ppm1 4.887 ppm2 7.211 CV 1
ASSI { 1572}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 35 and name HD% )
5.600 3.900 0.400 peak 1572 spectrum 1 weight 0.59071E+00 volume 0.36236E-03 ppm1 4.889 ppm2 7.090 CV 1
ASSI { 1600}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 20 and name HB2 ))
2.400 2.400 3.600 peak 1600 spectrum 1 weight 0.67295E+00 volume 0.23648E-01 ppm1 4.536 ppm2 2.625 CV 1
ASSI { 1614}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 107 and name HA ))
5.400 3.600 0.600 peak 1614 spectrum 1 weight 0.59073E+00 volume 0.36733E-03 ppm1 4.889 ppm2 5.438 CV 1
ASSI { 1618}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 47 and name HB2 ))
6.000 6.000 0.000 peak 1618 spectrum 1 weight 0.58983E+00 volume 0.72889E-04 ppm1 4.807 ppm2 2.511 CV 1
OR { 1618}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 47 and name HB1 ))
OR { 1618}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 49 and name HB1 ))
ASSI { 1631}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 107 and name HA ))
6.000 5.300 0.000 peak 1631 spectrum 1 weight 0.60034E+00 volume 0.12871E-03 ppm1 5.050 ppm2 5.444 CV 1
ASSI { 1635}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 86 and name HN ))
2.400 0.700 0.700 peak 1635 spectrum 1 weight 0.69048E+00 volume 0.80265E-02 ppm1 5.052 ppm2 9.100 CV 1
ASSI { 1649}
(( segid " " and resid 85 and name HA ))
( segid " " and resid 5 and name HD1%)
4.000 2.000 2.000 peak 1649 spectrum 1 weight 0.41479E+00 volume 0.14674E-02 ppm1 5.066 ppm2 0.600 CV 1
ASSI { 1650}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 4 and name HA ))
4.500 2.500 1.500 peak 1650 spectrum 1 weight 0.58316E+00 volume 0.93800E-03 ppm1 4.826 ppm2 4.532 CV 1
ASSI { 1651}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 39 and name HA ))
4.900 3.100 1.100 peak 1651 spectrum 1 weight 0.51362E+00 volume 0.73241E-03 ppm1 4.821 ppm2 5.748 CV 1
ASSI { 1655}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 38 and name HN ))
3.900 1.900 1.900 peak 1655 spectrum 1 weight 0.59133E+00 volume 0.50522E-03 ppm1 4.809 ppm2 8.542 CV 1
ASSI { 1662}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 8 and name HA ))
5.900 4.300 0.100 peak 1662 spectrum 1 weight 0.55113E+00 volume 0.21210E-03 ppm1 5.139 ppm2 5.287 CV 1
ASSI { 1675}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HN ))
2.300 0.700 0.700 peak 1675 spectrum 1 weight 0.64548E+00 volume 0.54096E-02 ppm1 4.820 ppm2 8.669 CV 1
ASSI { 1687}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 73 and name HA ))
4.000 2.000 2.000 peak 1687 spectrum 1 weight 0.48977E+00 volume 0.36571E-02 ppm1 4.589 ppm2 4.749 CV 1
ASSI { 1709}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 47 and name HB2 ))
4.200 2.200 1.800 peak 1709 spectrum 1 weight 0.50000E+00 volume 0.14296E-02 ppm1 4.607 ppm2 2.532 CV 1
OR { 1709}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 47 and name HB1 ))
ASSI { 1713}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 8 and name HB1 ))
4.200 2.200 1.800 peak 1713 spectrum 1 weight 0.55303E+00 volume 0.16250E-02 ppm1 4.600 ppm2 3.413 CV 1
ASSI { 1716}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HA2 ))
6.000 4.900 0.000 peak 1716 spectrum 1 weight 0.59013E+00 volume 0.19581E-03 ppm1 4.585 ppm2 5.329 CV 1
ASSI { 1733}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 5 and name HG ))
4.200 2.200 1.800 peak 1733 spectrum 1 weight 0.47239E+00 volume 0.33662E-02 ppm1 4.736 ppm2 1.145 CV 1
ASSI { 1743}
(( segid " " and resid 115 and name HD2 ))
(( segid " " and resid 114 and name HA ))
2.400 0.700 0.700 peak 1743 spectrum 1 weight 0.65309E+00 volume 0.58914E-02 ppm1 3.470 ppm2 4.977 CV 1
ASSI { 1758}
(( segid " " and resid 123 and name HD2 ))
( segid " " and resid 137 and name HD1%)
3.700 1.700 1.700 peak 1758 spectrum 1 weight 0.63603E+00 volume 0.47793E-02 ppm1 3.287 ppm2 -0.101 CV 1
OR { 1758}
(( segid " " and resid 123 and name HD1 ))
( segid " " and resid 137 and name HD1%)
ASSI { 1770}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 5 and name HD2%)
5.200 3.400 0.800 peak 1770 spectrum 1 weight 0.54127E+00 volume 0.17995E-02 ppm1 4.743 ppm2 0.590 CV 1
OR { 1770}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 5 and name HD1%)
ASSI { 1797}
(( segid " " and resid 16 and name HD1 ))
(( segid " " and resid 12 and name HA ))
6.000 5.100 0.000 peak 1797 spectrum 1 weight 0.37070E+00 volume 0.14706E-03 ppm1 3.165 ppm2 4.785 CV 1
ASSI { 1825}
(( segid " " and resid 125 and name HD2 ))
( segid " " and resid 134 and name HG2%)
5.900 4.300 0.100 peak 1825 spectrum 1 weight 0.53168E+00 volume 0.36979E-03 ppm1 4.195 ppm2 1.134 CV 1
ASSI { 1828}
(( segid " " and resid 125 and name HD1 ))
( segid " " and resid 134 and name HG2%)
5.100 3.200 0.900 peak 1828 spectrum 1 weight 0.53489E+00 volume 0.87736E-03 ppm1 4.105 ppm2 1.124 CV 1
ASSI { 1841}
(( segid " " and resid 108 and name HB1 ))
( segid " " and resid 86 and name HD1%)
4.500 2.600 1.500 peak 1841 spectrum 1 weight 0.59953E+00 volume 0.16965E-02 ppm1 1.685 ppm2 0.452 CV 1
ASSI { 1843}
(( segid " " and resid 108 and name HB2 ))
( segid " " and resid 86 and name HD1%)
3.900 1.900 1.900 peak 1843 spectrum 1 weight 0.59410E+00 volume 0.98814E-03 ppm1 1.575 ppm2 0.459 CV 1
ASSI { 1850}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 12 and name HG11))
3.600 1.600 1.600 peak 1850 spectrum 1 weight 0.56016E+00 volume 0.10256E-02 ppm1 4.299 ppm2 0.533 CV 1
ASSI { 1859}
(( segid " " and resid 10 and name HA1 ))
( segid " " and resid 12 and name HD1%)
6.000 4.700 0.000 peak 1859 spectrum 1 weight 0.58393E+00 volume 0.22736E-03 ppm1 4.309 ppm2 0.340 CV 1
ASSI { 1860}
(( segid " " and resid 10 and name HA1 ))
( segid " " and resid 127 and name HE% )
3.200 1.300 1.300 peak 1860 spectrum 1 weight 0.62781E+00 volume 0.41949E-02 ppm1 4.298 ppm2 6.973 CV 1
ASSI { 1863}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 8 and name HB1 ))
6.000 6.000 0.000 peak 1863 spectrum 1 weight 0.53058E+00 volume 0.17095E-04 ppm1 4.293 ppm2 3.464 CV 1
OR { 1863}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 46 and name HB1 ))
ASSI { 1866}
(( segid " " and resid 10 and name HA2 ))
( segid " " and resid 12 and name HD1%)
6.000 5.200 0.000 peak 1866 spectrum 1 weight 0.59018E+00 volume 0.21258E-03 ppm1 3.737 ppm2 0.325 CV 1
ASSI { 1867}
(( segid " " and resid 10 and name HA2 ))
( segid " " and resid 127 and name HE% )
4.000 2.000 2.000 peak 1867 spectrum 1 weight 0.62465E+00 volume 0.42699E-02 ppm1 3.733 ppm2 6.972 CV 1
ASSI { 1870}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 41 and name HA1 ))
5.100 3.300 0.900 peak 1870 spectrum 1 weight 0.57772E+00 volume 0.80639E-03 ppm1 3.735 ppm2 3.580 CV 1
OR { 1870}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 48 and name HA2 ))
ASSI { 1874}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 12 and name HG11))
3.500 1.500 1.500 peak 1874 spectrum 1 weight 0.52448E+00 volume 0.16247E-02 ppm1 3.718 ppm2 0.554 CV 1
ASSI { 1885}
(( segid " " and resid 44 and name HA1 ))
(( segid " " and resid 73 and name HA ))
2.800 1.000 1.000 peak 1885 spectrum 1 weight 0.61171E+00 volume 0.29078E-02 ppm1 4.330 ppm2 4.723 CV 1
ASSI { 1899}
(( segid " " and resid 44 and name HA2 ))
(( segid " " and resid 43 and name HA ))
4.700 2.800 1.300 peak 1899 spectrum 1 weight 0.53946E+00 volume 0.15913E-02 ppm1 3.917 ppm2 4.473 CV 1
ASSI { 1918}
(( segid " " and resid 48 and name HA1 ))
( segid " " and resid 70 and name HG2%)
3.200 3.200 2.800 peak 1918 spectrum 1 weight 0.75672E+00 volume 0.11241E-01 ppm1 4.386 ppm2 1.059 CV 1
ASSI { 1931}
(( segid " " and resid 48 and name HA2 ))
( segid " " and resid 70 and name HG2%)
2.700 2.700 3.300 peak 1931 spectrum 1 weight 0.79307E+00 volume 0.12819E-01 ppm1 3.536 ppm2 1.059 CV 1
ASSI { 1939}
(( segid " " and resid 48 and name HA2 ))
(( segid " " and resid 71 and name HA ))
4.300 2.300 1.700 peak 1939 spectrum 1 weight 0.45685E+00 volume 0.15858E-02 ppm1 3.519 ppm2 4.527 CV 1
ASSI { 1958}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 85 and name HA ))
3.700 1.700 1.700 peak 1958 spectrum 1 weight 0.59164E+00 volume 0.56734E-03 ppm1 1.933 ppm2 5.058 CV 1
ASSI { 1959}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 4 and name HA ))
6.000 6.000 0.000 peak 1959 spectrum 1 weight 0.66032E+00 volume 0.12618E-03 ppm1 1.931 ppm2 4.527 CV 1
ASSI { 1969}
(( segid " " and resid 54 and name HA2 ))
( segid " " and resid 131 and name HD% )
6.000 4.800 0.000 peak 1969 spectrum 1 weight 0.58224E+00 volume 0.25187E-03 ppm1 2.971 ppm2 6.985 CV 1
ASSI { 1986}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 58 and name HN ))
4.000 2.000 2.000 peak 1986 spectrum 1 weight 0.53329E+00 volume 0.72206E-03 ppm1 1.566 ppm2 7.125 CV 1
ASSI { 1987}
(( segid " " and resid 54 and name HA1 ))
( segid " " and resid 131 and name HD% )
3.600 1.700 1.700 peak 1987 spectrum 1 weight 0.59472E+00 volume 0.10806E-02 ppm1 1.561 ppm2 7.000 CV 1
ASSI { 1992}
(( segid " " and resid 50 and name HA1 ))
(( segid " " and resid 67 and name HN ))
4.500 2.500 1.500 peak 1992 spectrum 1 weight 0.33341E+00 volume 0.42820E-03 ppm1 4.704 ppm2 7.326 CV 1
ASSI { 2056}
(( segid " " and resid 84 and name HB2 ))
(( segid " " and resid 85 and name HN ))
5.700 4.100 0.300 peak 2056 spectrum 1 weight 0.53648E+00 volume 0.52659E-03 ppm1 2.478 ppm2 8.706 CV 1
ASSI { 2059}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 84 and name HN ))
4.300 2.300 1.700 peak 2059 spectrum 1 weight 0.59839E+00 volume 0.15620E-02 ppm1 2.133 ppm2 7.433 CV 1
ASSI { 2094}
(( segid " " and resid 84 and name HB1 ))
( segid " " and resid 4 and name HD1%)
3.700 1.700 1.700 peak 2094 spectrum 1 weight 0.53329E+00 volume 0.49123E-02 ppm1 2.885 ppm2 0.730 CV 1
ASSI { 2098}
(( segid " " and resid 84 and name HB1 ))
( segid " " and resid 86 and name HD1%)
2.900 1.100 1.100 peak 2098 spectrum 1 weight 0.60837E+00 volume 0.26054E-02 ppm1 2.881 ppm2 0.449 CV 1
ASSI { 2099}
(( segid " " and resid 84 and name HB1 ))
( segid " " and resid 4 and name HG2%)
4.300 2.300 1.700 peak 2099 spectrum 1 weight 0.59138E+00 volume 0.51403E-03 ppm1 2.880 ppm2 0.239 CV 1
ASSI { 2109}
(( segid " " and resid 84 and name HB2 ))
( segid " " and resid 6 and name HE% )
5.200 3.300 0.800 peak 2109 spectrum 1 weight 0.43171E+00 volume 0.16154E-02 ppm1 2.491 ppm2 6.950 CV 1
OR { 2109}
(( segid " " and resid 84 and name HB2 ))
( segid " " and resid 6 and name HD% )
ASSI { 2111}
(( segid " " and resid 84 and name HB2 ))
( segid " " and resid 4 and name HD1%)
3.000 1.100 1.100 peak 2111 spectrum 1 weight 0.55703E+00 volume 0.32915E-02 ppm1 2.494 ppm2 0.726 CV 1
ASSI { 2112}
(( segid " " and resid 84 and name HB2 ))
( segid " " and resid 86 and name HD1%)
4.400 2.500 1.600 peak 2112 spectrum 1 weight 0.60087E+00 volume 0.18475E-02 ppm1 2.487 ppm2 0.448 CV 1
ASSI { 2113}
(( segid " " and resid 84 and name HB2 ))
( segid " " and resid 4 and name HG2%)
3.300 1.400 1.400 peak 2113 spectrum 1 weight 0.60599E+00 volume 0.23779E-02 ppm1 2.480 ppm2 0.253 CV 1
ASSI { 2142}
(( segid " " and resid 24 and name HB1 ))
(( segid " " and resid 25 and name HN ))
3.100 1.200 1.200 peak 2142 spectrum 1 weight 0.60667E+00 volume 0.24443E-02 ppm1 3.013 ppm2 8.254 CV 1
ASSI { 2147}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 25 and name HN ))
3.800 1.800 1.800 peak 2147 spectrum 1 weight 0.60366E+00 volume 0.21445E-02 ppm1 2.903 ppm2 8.254 CV 1
ASSI { 2169}
(( segid " " and resid 7 and name HB ))
(( segid " " and resid 6 and name HA ))
4.800 2.900 1.200 peak 2169 spectrum 1 weight 0.59285E+00 volume 0.78924E-03 ppm1 1.376 ppm2 5.354 CV 1
OR { 2169}
(( segid " " and resid 7 and name HB ))
(( segid " " and resid 8 and name HA ))
OR { 2169}
(( segid " " and resid 7 and name HB ))
(( segid " " and resid 86 and name HA ))
ASSI { 2170}
(( segid " " and resid 7 and name HB ))
(( segid " " and resid 87 and name HA ))
2.800 1.000 1.000 peak 2170 spectrum 1 weight 0.61468E+00 volume 0.31643E-02 ppm1 1.380 ppm2 5.185 CV 1
ASSI { 2208}
(( segid " " and resid 117 and name HB1 ))
( segid " " and resid 119 and name HD% )
5.600 3.900 0.400 peak 2208 spectrum 1 weight 0.55157E+00 volume 0.33803E-03 ppm1 1.793 ppm2 7.133 CV 1
ASSI { 2217}
(( segid " " and resid 138 and name HB1 ))
( segid " " and resid 21 and name HD1%)
3.800 1.800 1.800 peak 2217 spectrum 1 weight 0.58949E+00 volume 0.23554E-02 ppm1 0.892 ppm2 0.528 CV 1
ASSI { 2223}
(( segid " " and resid 41 and name HA1 ))
(( segid " " and resid 10 and name HA2 ))
3.700 1.800 1.800 peak 2223 spectrum 1 weight 0.34295E+00 volume 0.20640E-02 ppm1 3.638 ppm2 3.760 CV 1
OR { 2223}
(( segid " " and resid 41 and name HA1 ))
(( segid " " and resid 16 and name HD2 ))
ASSI { 2230}
(( segid " " and resid 117 and name HB1 ))
( segid " " and resid 119 and name HE% )
6.000 5.200 0.000 peak 2230 spectrum 1 weight 0.52017E+00 volume 0.21732E-03 ppm1 1.811 ppm2 6.755 CV 1
ASSI { 2232}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 79 and name HN ))
3.400 1.400 1.400 peak 2232 spectrum 1 weight 0.59737E+00 volume 0.14362E-02 ppm1 1.653 ppm2 7.528 CV 1
ASSI { 2246}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 79 and name HN ))
4.000 2.000 2.000 peak 2246 spectrum 1 weight 0.59158E+00 volume 0.55518E-03 ppm1 1.238 ppm2 7.522 CV 1
ASSI { 2251}
(( segid " " and resid 138 and name HB1 ))
(( segid " " and resid 139 and name HN ))
4.600 2.600 1.400 peak 2251 spectrum 1 weight 0.55784E+00 volume 0.20207E-03 ppm1 0.910 ppm2 8.759 CV 1
ASSI { 2287}
(( segid " " and resid 85 and name HB1 ))
(( segid " " and resid 107 and name HA ))
3.300 1.400 1.400 peak 2287 spectrum 1 weight 0.59580E+00 volume 0.18982E-02 ppm1 1.745 ppm2 5.450 CV 1
ASSI { 2309}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 107 and name HA ))
3.200 1.300 1.300 peak 2309 spectrum 1 weight 0.59455E+00 volume 0.10553E-02 ppm1 1.211 ppm2 5.455 CV 1
ASSI { 2360}
(( segid " " and resid 149 and name HB1 ))
( segid " " and resid 6 and name HD% )
3.600 3.600 2.400 peak 2360 spectrum 1 weight 0.58238E+00 volume 0.27736E-03 ppm1 1.595 ppm2 6.976 CV 1
ASSI { 2362}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 63 and name HB1 ))
5.000 3.100 1.000 peak 2362 spectrum 1 weight 0.50046E+00 volume 0.92527E-03 ppm1 1.457 ppm2 2.724 CV 1
ASSI { 2370}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 86 and name HN ))
6.000 6.000 0.000 peak 2370 spectrum 1 weight 0.58724E+00 volume 0.69609E-04 ppm1 1.204 ppm2 9.141 CV 1
OR { 2370}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 108 and name HN ))
ASSI { 2460}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 3 and name HA ))
4.300 2.300 1.700 peak 2460 spectrum 1 weight 0.60100E+00 volume 0.18622E-02 ppm1 3.220 ppm2 5.456 CV 1
ASSI { 2513}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 3 and name HA ))
3.600 1.700 1.700 peak 2513 spectrum 1 weight 0.60298E+00 volume 0.20744E-02 ppm1 2.917 ppm2 5.457 CV 1
ASSI { 2583}
(( segid " " and resid 92 and name HB1 ))
(( segid " " and resid 89 and name HA ))
5.600 4.000 0.400 peak 2583 spectrum 1 weight 0.59163E+00 volume 0.56692E-03 ppm1 2.639 ppm2 5.186 CV 1
OR { 2583}
(( segid " " and resid 92 and name HB1 ))
(( segid " " and resid 87 and name HA ))
ASSI { 2612}
(( segid " " and resid 58 and name HE1 ))
( segid " " and resid 62 and name HD1%)
4.200 2.200 1.800 peak 2612 spectrum 1 weight 0.58179E+00 volume 0.10411E-02 ppm1 2.720 ppm2 0.302 CV 1
ASSI { 2617}
(( segid " " and resid 58 and name HE2 ))
(( segid " " and resid 132 and name HA ))
3.700 1.700 1.700 peak 2617 spectrum 1 weight 0.59861E+00 volume 0.15876E-02 ppm1 2.386 ppm2 4.398 CV 1
ASSI { 2625}
(( segid " " and resid 58 and name HE2 ))
( segid " " and resid 62 and name HD2%)
4.100 2.100 1.900 peak 2625 spectrum 1 weight 0.59991E+00 volume 0.17394E-02 ppm1 2.387 ppm2 0.559 CV 1
ASSI { 2626}
(( segid " " and resid 58 and name HE2 ))
( segid " " and resid 62 and name HD1%)
3.800 1.800 1.800 peak 2626 spectrum 1 weight 0.61014E+00 volume 0.27680E-02 ppm1 2.386 ppm2 0.302 CV 1
ASSI { 2673}
(( segid " " and resid 146 and name HB1 ))
( segid " " and resid 147 and name HG2%)
5.600 3.900 0.400 peak 2673 spectrum 1 weight 0.59269E+00 volume 0.76136E-03 ppm1 2.051 ppm2 1.135 CV 1
ASSI { 2689}
(( segid " " and resid 146 and name HB2 ))
( segid " " and resid 147 and name HG2%)
6.000 4.600 0.000 peak 2689 spectrum 1 weight 0.39667E+00 volume 0.73911E-03 ppm1 1.309 ppm2 1.142 CV 1
ASSI { 2697}
(( segid " " and resid 146 and name HB2 ))
( segid " " and resid 147 and name HG2%)
5.600 3.900 0.400 peak 2697 spectrum 1 weight 0.38663E+00 volume 0.11800E-02 ppm1 1.265 ppm2 1.121 CV 1
ASSI { 2700}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 56 and name HA ))
3.700 1.700 1.700 peak 2700 spectrum 1 weight 0.55828E+00 volume 0.90216E-03 ppm1 1.121 ppm2 3.280 CV 1
OR { 2700}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 56 and name HA ))
ASSI { 2713}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 41 and name HA2 ))
4.800 2.900 1.200 peak 2713 spectrum 1 weight 0.55452E+00 volume 0.25103E-02 ppm1 3.193 ppm2 5.332 CV 1
ASSI { 2715}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 41 and name HA1 ))
4.500 2.500 1.500 peak 2715 spectrum 1 weight 0.60590E+00 volume 0.44666E-02 ppm1 3.189 ppm2 3.611 CV 1
ASSI { 2730}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 46 and name HA ))
5.100 3.200 0.900 peak 2730 spectrum 1 weight 0.43671E+00 volume 0.46536E-03 ppm1 2.524 ppm2 4.824 CV 1
OR { 2730}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 46 and name HA ))
OR { 2730}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 9 and name HA ))
OR { 2730}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 72 and name HA ))
OR { 2730}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 12 and name HA ))
OR { 2730}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 72 and name HA ))
ASSI { 2734}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 71 and name HA ))
6.000 6.000 0.000 peak 2734 spectrum 1 weight 0.53058E+00 volume 0.17095E-04 ppm1 2.245 ppm2 4.580 CV 1
OR { 2734}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 40 and name HA ))
ASSI { 2735}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 41 and name HA2 ))
4.000 2.000 2.000 peak 2735 spectrum 1 weight 0.60369E+00 volume 0.21485E-02 ppm1 2.232 ppm2 5.324 CV 1
ASSI { 2737}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 41 and name HA1 ))
3.900 1.900 1.900 peak 2737 spectrum 1 weight 0.61162E+00 volume 0.29001E-02 ppm1 2.235 ppm2 3.606 CV 1
ASSI { 2761}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 46 and name HA ))
5.100 3.300 0.900 peak 2761 spectrum 1 weight 0.42987E+00 volume 0.43914E-03 ppm1 2.548 ppm2 4.818 CV 1
OR { 2761}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 46 and name HA ))
OR { 2761}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 9 and name HA ))
OR { 2761}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 72 and name HA ))
OR { 2761}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 12 and name HA ))
OR { 2761}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 72 and name HA ))
ASSI { 2768}
(( segid " " and resid 137 and name HB ))
( segid " " and resid 134 and name HG2%)
3.100 3.100 2.900 peak 2768 spectrum 1 weight 0.49549E+00 volume 0.66958E-03 ppm1 1.361 ppm2 1.141 CV 1
ASSI { 2775}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 90 and name HA ))
2.800 1.000 1.000 peak 2775 spectrum 1 weight 0.62037E+00 volume 0.74344E-02 ppm1 3.324 ppm2 4.666 CV 1
OR { 2775}
(( segid " " and resid 93 and name HB1 ))
(( segid " " and resid 90 and name HA ))
ASSI { 2778}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 87 and name HG2%)
4.100 2.100 1.900 peak 2778 spectrum 1 weight 0.60707E+00 volume 0.24825E-02 ppm1 3.322 ppm2 1.069 CV 1
OR { 2778}
(( segid " " and resid 93 and name HB1 ))
( segid " " and resid 87 and name HG2%)
ASSI { 2786}
(( segid " " and resid 119 and name HB2 ))
( segid " " and resid 137 and name HD1%)
3.500 1.500 1.500 peak 2786 spectrum 1 weight 0.60947E+00 volume 0.27064E-02 ppm1 3.215 ppm2 -0.085 CV 1
ASSI { 2801}
(( segid " " and resid 99 and name HB1 ))
( segid " " and resid 100 and name HE% )
3.800 1.800 1.800 peak 2801 spectrum 1 weight 0.50261E+00 volume 0.13377E-02 ppm1 2.423 ppm2 7.069 CV 1
ASSI { 2802}
(( segid " " and resid 99 and name HB2 ))
( segid " " and resid 100 and name HE% )
4.900 3.000 1.100 peak 2802 spectrum 1 weight 0.48614E+00 volume 0.81786E-03 ppm1 2.064 ppm2 7.071 CV 1
ASSI { 2805}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 3 and name HA ))
5.400 3.600 0.600 peak 2805 spectrum 1 weight 0.59174E+00 volume 0.58807E-03 ppm1 1.785 ppm2 5.458 CV 1
ASSI { 2806}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 37 and name HA ))
3.300 1.400 1.400 peak 2806 spectrum 1 weight 0.60244E+00 volume 0.20176E-02 ppm1 1.788 ppm2 4.732 CV 1
ASSI { 2812}
(( segid " " and resid 137 and name HB ))
(( segid " " and resid 138 and name HN ))
2.600 0.900 0.900 peak 2812 spectrum 1 weight 0.61199E+00 volume 0.29327E-02 ppm1 1.361 ppm2 8.169 CV 1
ASSI { 2826}
(( segid " " and resid 148 and name HB1 ))
( segid " " and resid 145 and name HD1%)
3.000 3.000 3.000 peak 2826 spectrum 1 weight 0.57368E+00 volume 0.78050E-03 ppm1 3.475 ppm2 -0.084 CV 1
ASSI { 2859}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 5 and name HN ))
6.000 4.700 0.000 peak 2859 spectrum 1 weight 0.55129E+00 volume 0.13589E-03 ppm1 1.779 ppm2 8.392 CV 1
ASSI { 2935}
(( segid " " and resid 21 and name HB ))
(( segid " " and resid 18 and name HA ))
4.200 2.200 1.800 peak 2935 spectrum 1 weight 0.60950E+00 volume 0.27092E-02 ppm1 1.757 ppm2 3.313 CV 1
ASSI { 2940}
(( segid " " and resid 21 and name HB ))
(( segid " " and resid 22 and name HG1 ))
6.000 6.000 0.000 peak 2940 spectrum 1 weight 0.48507E+00 volume 0.16880E-04 ppm1 1.747 ppm2 2.521 CV 1
OR { 2940}
(( segid " " and resid 21 and name HB ))
(( segid " " and resid 22 and name HB2 ))
ASSI { 2942}
(( segid " " and resid 37 and name HB ))
(( segid " " and resid 38 and name HN ))
4.300 2.400 1.700 peak 2942 spectrum 1 weight 0.46620E+00 volume 0.49369E-03 ppm1 1.676 ppm2 8.602 CV 1
ASSI { 2944}
(( segid " " and resid 37 and name HB ))
(( segid " " and resid 6 and name HB2 ))
3.500 3.500 2.500 peak 2944 spectrum 1 weight 0.60255E+00 volume 0.20297E-02 ppm1 1.669 ppm2 2.634 CV 1
ASSI { 2955}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 59 and name HB1 ))
3.200 1.200 1.200 peak 2955 spectrum 1 weight 0.58394E+00 volume 0.52551E-02 ppm1 1.579 ppm2 1.141 CV 1
OR { 2955}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 2957}
(( segid " " and resid 64 and name HB ))
( segid " " and resid 59 and name HD1%)
3.700 1.700 1.700 peak 2957 spectrum 1 weight 0.60158E+00 volume 0.19257E-02 ppm1 1.576 ppm2 0.524 CV 1
ASSI { 2973}
(( segid " " and resid 135 and name HB1 ))
(( segid " " and resid 137 and name HG11))
5.900 4.400 0.100 peak 2973 spectrum 1 weight 0.59028E+00 volume 0.24533E-03 ppm1 3.020 ppm2 0.314 CV 1
OR { 2973}
(( segid " " and resid 135 and name HB2 ))
(( segid " " and resid 137 and name HG11))
ASSI { 2984}
(( segid " " and resid 21 and name HB ))
(( segid " " and resid 22 and name HN ))
3.300 1.400 1.400 peak 2984 spectrum 1 weight 0.57698E+00 volume 0.26151E-02 ppm1 1.753 ppm2 8.878 CV 1
ASSI { 2998}
(( segid " " and resid 20 and name HB1 ))
(( segid " " and resid 17 and name HA ))
6.000 4.400 0.000 peak 2998 spectrum 1 weight 0.53064E+00 volume 0.60715E-04 ppm1 3.342 ppm2 3.620 CV 1
ASSI { 3001}
(( segid " " and resid 20 and name HB1 ))
( segid " " and resid 21 and name HD1%)
3.800 1.800 1.800 peak 3001 spectrum 1 weight 0.60649E+00 volume 0.24267E-02 ppm1 3.340 ppm2 0.523 CV 1
OR { 3001}
(( segid " " and resid 20 and name HB1 ))
( segid " " and resid 59 and name HD1%)
ASSI { 3045}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 124 and name HB2 ))
3.300 3.300 2.700 peak 3045 spectrum 1 weight 0.81839E+00 volume 0.19710E-01 ppm1 2.452 ppm2 2.611 CV 1
OR { 3045}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 124 and name HB2 ))
ASSI { 3054}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 93 and name HB2 ))
4.100 2.200 1.900 peak 3054 spectrum 1 weight 0.55356E+00 volume 0.29975E-02 ppm1 2.763 ppm2 3.328 CV 1
OR { 3054}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 93 and name HB1 ))
ASSI { 3066}
(( segid " " and resid 144 and name HB2 ))
(( segid " " and resid 145 and name HN ))
3.700 1.700 1.700 peak 3066 spectrum 1 weight 0.59562E+00 volume 0.12068E-02 ppm1 3.616 ppm2 9.149 CV 1
ASSI { 3147}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 20 and name HB1 ))
3.900 1.900 1.900 peak 3147 spectrum 1 weight 0.56491E+00 volume 0.16870E-02 ppm1 2.737 ppm2 3.361 CV 1
ASSI { 3159}
(( segid " " and resid 110 and name HB ))
(( segid " " and resid 109 and name HA ))
6.000 6.000 0.000 peak 3159 spectrum 1 weight 0.50809E+00 volume 0.36493E-04 ppm1 1.892 ppm2 4.584 CV 1
ASSI { 3160}
(( segid " " and resid 86 and name HB ))
( segid " " and resid 6 and name HD% )
2.900 1.000 1.000 peak 3160 spectrum 1 weight 0.56444E+00 volume 0.42764E-02 ppm1 1.826 ppm2 6.929 CV 1
OR { 3160}
(( segid " " and resid 86 and name HB ))
( segid " " and resid 6 and name HE% )
ASSI { 3176}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 36 and name HA ))
6.000 6.000 0.000 peak 3176 spectrum 1 weight 0.54394E+00 volume 0.73094E-04 ppm1 2.883 ppm2 4.984 CV 1
ASSI { 3178}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 19 and name HA ))
2.600 2.600 3.400 peak 3178 spectrum 1 weight 0.58285E+00 volume 0.19675E-02 ppm1 2.887 ppm2 3.424 CV 1
ASSI { 3220}
(( segid " " and resid 49 and name HG1 ))
(( segid " " and resid 46 and name HB1 ))
3.300 1.400 1.400 peak 3220 spectrum 1 weight 0.59106E+00 volume 0.44494E-03 ppm1 2.246 ppm2 3.433 CV 1
ASSI { 3239}
(( segid " " and resid 45 and name HG1 ))
(( segid " " and resid 43 and name HA ))
6.000 5.800 0.000 peak 3239 spectrum 1 weight 0.57803E+00 volume 0.21118E-03 ppm1 1.937 ppm2 4.505 CV 1
ASSI { 3258}
(( segid " " and resid 121 and name HG2 ))
(( segid " " and resid 92 and name HB1 ))
3.800 1.800 1.800 peak 3258 spectrum 1 weight 0.57938E+00 volume 0.31152E-02 ppm1 2.048 ppm2 2.617 CV 1
ASSI { 3262}
(( segid " " and resid 72 and name HB2 ))
( segid " " and resid 70 and name HG2%)
3.200 3.200 2.800 peak 3262 spectrum 1 weight 0.43906E+00 volume 0.25505E-02 ppm1 1.672 ppm2 1.071 CV 1
ASSI { 3265}
(( segid " " and resid 121 and name HG1 ))
(( segid " " and resid 89 and name HA ))
3.300 1.300 1.300 peak 3265 spectrum 1 weight 0.63023E+00 volume 0.43714E-02 ppm1 2.184 ppm2 5.144 CV 1
ASSI { 3266}
(( segid " " and resid 121 and name HG1 ))
(( segid " " and resid 89 and name HB1 ))
3.200 1.300 1.300 peak 3266 spectrum 1 weight 0.60166E+00 volume 0.19344E-02 ppm1 2.189 ppm2 3.634 CV 1
ASSI { 3269}
(( segid " " and resid 121 and name HG2 ))
(( segid " " and resid 89 and name HA ))
3.700 1.700 1.700 peak 3269 spectrum 1 weight 0.61564E+00 volume 0.32447E-02 ppm1 2.043 ppm2 5.148 CV 1
ASSI { 3277}
(( segid " " and resid 34 and name HG1 ))
( segid " " and resid 35 and name HD% )
6.000 5.600 0.000 peak 3277 spectrum 1 weight 0.54206E+00 volume 0.25490E-03 ppm1 1.983 ppm2 7.081 CV 1
ASSI { 3278}
(( segid " " and resid 34 and name HG1 ))
( segid " " and resid 35 and name HD% )
5.400 3.600 0.600 peak 3278 spectrum 1 weight 0.49953E+00 volume 0.96825E-03 ppm1 1.967 ppm2 7.122 CV 1
ASSI { 3290}
(( segid " " and resid 133 and name HG1 ))
( segid " " and resid 137 and name HD1%)
3.500 1.600 1.600 peak 3290 spectrum 1 weight 0.61037E+00 volume 0.27884E-02 ppm1 2.082 ppm2 -0.096 CV 1
ASSI { 3292}
(( segid " " and resid 34 and name HG1 ))
(( segid " " and resid 31 and name HA ))
3.700 1.700 1.700 peak 3292 spectrum 1 weight 0.64555E+00 volume 0.55748E-02 ppm1 1.980 ppm2 4.891 CV 1
ASSI { 3301}
(( segid " " and resid 133 and name HG2 ))
( segid " " and resid 137 and name HD1%)
3.700 1.800 1.800 peak 3301 spectrum 1 weight 0.61623E+00 volume 0.32939E-02 ppm1 1.886 ppm2 -0.100 CV 1
ASSI { 3302}
(( segid " " and resid 2 and name HB1 ))
(( segid " " and resid 35 and name HA ))
6.000 6.000 0.000 peak 3302 spectrum 1 weight 0.53060E+00 volume 0.34814E-04 ppm1 1.848 ppm2 5.572 CV 1
ASSI { 3304}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 84 and name HA ))
3.900 1.900 1.900 peak 3304 spectrum 1 weight 0.59314E+00 volume 0.83811E-03 ppm1 1.788 ppm2 5.145 CV 1
ASSI { 3362}
(( segid " " and resid 19 and name HG1 ))
(( segid " " and resid 50 and name HA1 ))
5.800 4.100 0.200 peak 3362 spectrum 1 weight 0.55812E+00 volume 0.28758E-03 ppm1 1.517 ppm2 4.723 CV 1
OR { 3362}
(( segid " " and resid 19 and name HG1 ))
(( segid " " and resid 38 and name HA ))
ASSI { 3368}
(( segid " " and resid 19 and name HG1 ))
(( segid " " and resid 20 and name HB2 ))
5.600 3.900 0.400 peak 3368 spectrum 1 weight 0.58428E+00 volume 0.39020E-03 ppm1 1.499 ppm2 2.626 CV 1
ASSI { 3370}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 20 and name HN ))
6.000 4.600 0.000 peak 3370 spectrum 1 weight 0.66731E+00 volume 0.27598E-03 ppm1 0.713 ppm2 7.592 CV 1
ASSI { 3372}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 20 and name HB2 ))
5.100 3.300 0.900 peak 3372 spectrum 1 weight 0.58606E+00 volume 0.70198E-03 ppm1 0.699 ppm2 2.632 CV 1
ASSI { 3400}
(( segid " " and resid 73 and name HB2 ))
(( segid " " and resid 74 and name HN ))
6.000 5.200 0.000 peak 3400 spectrum 1 weight 0.58792E+00 volume 0.11696E-03 ppm1 1.717 ppm2 9.315 CV 1
ASSI { 3415}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 12 and name HD1%)
5.800 4.200 0.200 peak 3415 spectrum 1 weight 0.59079E+00 volume 0.38101E-03 ppm1 2.973 ppm2 0.334 CV 1
ASSI { 3421}
(( segid " " and resid 52 and name HB1 ))
( segid " " and resid 12 and name HD1%)
4.800 2.900 1.200 peak 3421 spectrum 1 weight 0.59040E+00 volume 0.27879E-03 ppm1 2.820 ppm2 0.330 CV 1
ASSI { 3431}
(( segid " " and resid 121 and name HB1 ))
(( segid " " and resid 89 and name HA ))
3.500 1.500 1.500 peak 3431 spectrum 1 weight 0.68069E+00 volume 0.74974E-02 ppm1 2.244 ppm2 5.145 CV 1
ASSI { 3437}
(( segid " " and resid 121 and name HB2 ))
(( segid " " and resid 89 and name HA ))
3.600 1.600 1.600 peak 3437 spectrum 1 weight 0.73697E+00 volume 0.10337E-01 ppm1 1.844 ppm2 5.143 CV 1
ASSI { 3477}
(( segid " " and resid 22 and name HG1 ))
( segid " " and resid 4 and name HG2%)
6.000 6.000 0.000 peak 3477 spectrum 1 weight 0.38576E+00 volume 0.36857E-03 ppm1 2.483 ppm2 0.271 CV 1
OR { 3477}
(( segid " " and resid 22 and name HG2 ))
( segid " " and resid 4 and name HG2%)
OR { 3477}
(( segid " " and resid 22 and name HG1 ))
( segid " " and resid 149 and name HD2%)
OR { 3477}
(( segid " " and resid 22 and name HG2 ))
( segid " " and resid 149 and name HD2%)
ASSI { 3490}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 82 and name HA ))
2.000 0.500 0.500 peak 3490 spectrum 1 weight 0.64249E+00 volume 0.10809E-01 ppm1 1.986 ppm2 4.447 CV 1
ASSI { 3521}
(( segid " " and resid 3 and name HB1 ))
(( segid " " and resid 4 and name HN ))
4.300 2.300 1.700 peak 3521 spectrum 1 weight 0.58639E+00 volume 0.28134E-03 ppm1 2.088 ppm2 9.409 CV 1
ASSI { 3535}
(( segid " " and resid 14 and name HB2 ))
( segid " " and resid 138 and name HD2%)
3.100 1.200 1.200 peak 3535 spectrum 1 weight 0.65955E+00 volume 0.11577E-01 ppm1 2.416 ppm2 0.681 CV 1
ASSI { 3541}
(( segid " " and resid 104 and name HG1 ))
( segid " " and resid 97 and name HD2%)
3.500 1.500 1.500 peak 3541 spectrum 1 weight 0.60024E+00 volume 0.24302E-02 ppm1 2.412 ppm2 0.407 CV 1
ASSI { 3543}
(( segid " " and resid 22 and name HB1 ))
(( segid " " and resid 23 and name HN ))
4.300 2.300 1.700 peak 3543 spectrum 1 weight 0.53117E+00 volume 0.31859E-03 ppm1 2.222 ppm2 8.594 CV 1
OR { 3543}
(( segid " " and resid 22 and name HB1 ))
(( segid " " and resid 21 and name HN ))
ASSI { 3551}
(( segid " " and resid 107 and name HB ))
(( segid " " and resid 108 and name HN ))
3.900 1.900 1.900 peak 3551 spectrum 1 weight 0.60682E+00 volume 0.24588E-02 ppm1 1.867 ppm2 9.155 CV 1
ASSI { 3558}
(( segid " " and resid 14 and name HB1 ))
( segid " " and resid 138 and name HD2%)
2.800 2.800 3.200 peak 3558 spectrum 1 weight 0.58049E+00 volume 0.50263E-02 ppm1 1.864 ppm2 0.685 CV 1
ASSI { 3566}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 23 and name HN ))
6.000 6.000 0.000 peak 3566 spectrum 1 weight 0.58557E+00 volume 0.17593E-04 ppm1 2.465 ppm2 8.593 CV 1
OR { 3566}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 21 and name HN ))
ASSI { 3572}
(( segid " " and resid 17 and name HG2 ))
( segid " " and resid 59 and name HD1%)
2.500 0.800 0.800 peak 3572 spectrum 1 weight 0.36674E+00 volume 0.66568E-02 ppm1 2.395 ppm2 0.527 CV 1
ASSI { 3575}
(( segid " " and resid 22 and name HB1 ))
( segid " " and resid 6 and name HE% )
3.600 1.600 1.600 peak 3575 spectrum 1 weight 0.51578E+00 volume 0.14766E-02 ppm1 2.227 ppm2 6.955 CV 1
ASSI { 3581}
(( segid " " and resid 107 and name HB ))
( segid " " and resid 97 and name HD2%)
2.600 2.600 3.400 peak 3581 spectrum 1 weight 0.53389E+00 volume 0.20887E-02 ppm1 1.881 ppm2 0.406 CV 1
ASSI { 3582}
(( segid " " and resid 14 and name HB1 ))
( segid " " and resid 127 and name HD% )
5.200 3.400 0.800 peak 3582 spectrum 1 weight 0.46545E+00 volume 0.84626E-03 ppm1 1.861 ppm2 7.295 CV 1
ASSI { 3614}
(( segid " " and resid 1 and name HB2 ))
(( segid " " and resid 83 and name HB2 ))
4.500 2.500 1.500 peak 3614 spectrum 1 weight 0.47941E+00 volume 0.15491E-02 ppm1 2.023 ppm2 2.538 CV 1
OR { 3614}
(( segid " " and resid 1 and name HB1 ))
(( segid " " and resid 83 and name HB2 ))
ASSI { 3694}
(( segid " " and resid 49 and name HB1 ))
(( segid " " and resid 46 and name HB1 ))
3.000 3.000 3.000 peak 3694 spectrum 1 weight 0.56713E+00 volume 0.78015E-03 ppm1 2.525 ppm2 3.429 CV 1
ASSI { 3700}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 46 and name HB1 ))
3.200 3.200 2.800 peak 3700 spectrum 1 weight 0.53242E+00 volume 0.55809E-03 ppm1 2.346 ppm2 3.437 CV 1
ASSI { 3732}
(( segid " " and resid 147 and name HB ))
(( segid " " and resid 144 and name HA ))
2.700 0.900 0.900 peak 3732 spectrum 1 weight 0.58929E+00 volume 0.75161E-02 ppm1 2.284 ppm2 4.647 CV 1
ASSI { 3755}
(( segid " " and resid 34 and name HB2 ))
( segid " " and resid 35 and name HD% )
4.000 2.000 2.000 peak 3755 spectrum 1 weight 0.58018E+00 volume 0.13848E-02 ppm1 1.729 ppm2 7.110 CV 1
ASSI { 3783}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 31 and name HA ))
5.000 3.100 1.000 peak 3783 spectrum 1 weight 0.59463E+00 volume 0.10675E-02 ppm1 1.723 ppm2 4.886 CV 1
ASSI { 3789}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 31 and name HA ))
4.600 2.600 1.400 peak 3789 spectrum 1 weight 0.59580E+00 volume 0.12320E-02 ppm1 1.660 ppm2 4.899 CV 1
ASSI { 3813}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 55 and name HA ))
4.700 2.700 1.300 peak 3813 spectrum 1 weight 0.57159E+00 volume 0.36167E-03 ppm1 1.844 ppm2 3.677 CV 1
ASSI { 3910}
(( segid " " and resid 81 and name HB2 ))
( segid " " and resid 78 and name HD2%)
2.300 2.300 3.700 peak 3910 spectrum 1 weight 0.62015E+00 volume 0.36119E-02 ppm1 1.954 ppm2 0.806 CV 1
OR { 3910}
(( segid " " and resid 81 and name HB1 ))
( segid " " and resid 78 and name HD2%)
ASSI { 3933}
(( segid " " and resid 110 and name HG11))
( segid " " and resid 145 and name HD2%)
4.400 2.500 1.600 peak 3933 spectrum 1 weight 0.53756E+00 volume 0.13548E-02 ppm1 1.263 ppm2 0.559 CV 1
OR { 3933}
(( segid " " and resid 110 and name HG12))
( segid " " and resid 145 and name HD2%)
ASSI { 3940}
(( segid " " and resid 16 and name HB1 ))
( segid " " and resid 69 and name HD% )
4.400 2.500 1.600 peak 3940 spectrum 1 weight 0.37954E+00 volume 0.11792E-02 ppm1 0.984 ppm2 7.237 CV 1
OR { 3940}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 69 and name HD% )
ASSI { 3941}
(( segid " " and resid 16 and name HB1 ))
(( segid " " and resid 12 and name HA ))
6.000 6.000 0.000 peak 3941 spectrum 1 weight 0.28565E+00 volume 0.16890E-04 ppm1 0.983 ppm2 4.772 CV 1
OR { 3941}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 12 and name HA ))
ASSI { 3949}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 67 and name HN ))
4.500 2.500 1.500 peak 3949 spectrum 1 weight 0.43941E+00 volume 0.58547E-03 ppm1 0.974 ppm2 7.359 CV 1
OR { 3949}
(( segid " " and resid 16 and name HB1 ))
(( segid " " and resid 67 and name HN ))
ASSI { 3957}
(( segid " " and resid 126 and name HB2 ))
(( segid " " and resid 53 and name HB2 ))
4.100 2.100 1.900 peak 3957 spectrum 1 weight 0.41001E+00 volume 0.90675E-03 ppm1 2.817 ppm2 2.670 CV 1
ASSI { 3963}
(( segid " " and resid 126 and name HB2 ))
( segid " " and resid 53 and name HE% )
3.500 1.600 1.600 peak 3963 spectrum 1 weight 0.55984E+00 volume 0.14313E-02 ppm1 2.788 ppm2 6.752 CV 1
ASSI { 3998}
(( segid " " and resid 73 and name HD2 ))
(( segid " " and resid 74 and name HN ))
3.100 3.100 2.900 peak 3998 spectrum 1 weight 0.59213E+00 volume 0.66115E-03 ppm1 1.682 ppm2 9.299 CV 1
OR { 3998}
(( segid " " and resid 73 and name HD1 ))
(( segid " " and resid 74 and name HN ))
ASSI { 4037}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 18 and name HN ))
6.000 4.800 0.000 peak 4037 spectrum 1 weight 0.59031E+00 volume 0.25239E-03 ppm1 1.656 ppm2 7.752 CV 1
ASSI { 4071}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 49 and name HG2 ))
6.000 6.000 0.000 peak 4071 spectrum 1 weight 0.61167E+00 volume 0.34248E-04 ppm1 3.436 ppm2 2.360 CV 1
OR { 4071}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 49 and name HB2 ))
ASSI { 4079}
(( segid " " and resid 13 and name HB2 ))
( segid " " and resid 127 and name HE% )
4.300 2.300 1.700 peak 4079 spectrum 1 weight 0.53961E+00 volume 0.71991E-03 ppm1 2.717 ppm2 6.994 CV 1
ASSI { 4080}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 16 and name HD1 ))
6.000 4.900 0.000 peak 4080 spectrum 1 weight 0.45284E+00 volume 0.20788E-03 ppm1 2.716 ppm2 3.156 CV 1
OR { 4080}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 14 and name HD2 ))
OR { 4080}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 14 and name HD1 ))
ASSI { 4094}
(( segid " " and resid 21 and name HG12))
(( segid " " and resid 18 and name HA ))
2.600 0.800 0.800 peak 4094 spectrum 1 weight 0.39834E+00 volume 0.47374E-02 ppm1 1.875 ppm2 3.319 CV 1
ASSI { 4098}
(( segid " " and resid 19 and name HB1 ))
(( segid " " and resid 20 and name HN ))
3.600 1.600 1.600 peak 4098 spectrum 1 weight 0.46612E+00 volume 0.56371E-03 ppm1 1.814 ppm2 7.608 CV 1
ASSI { 4142}
(( segid " " and resid 67 and name HD1 ))
(( segid " " and resid 20 and name HB1 ))
2.400 2.400 3.600 peak 4142 spectrum 1 weight 0.46206E+00 volume 0.31517E-02 ppm1 1.559 ppm2 3.305 CV 1
OR { 4142}
(( segid " " and resid 67 and name HD1 ))
(( segid " " and resid 56 and name HA ))
ASSI { 4160}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 12 and name HA ))
4.100 2.100 1.900 peak 4160 spectrum 1 weight 0.36633E+00 volume 0.35293E-02 ppm1 1.189 ppm2 4.774 CV 1
ASSI { 4224}
(( segid " " and resid 137 and name HG11))
( segid " " and resid 117 and name HD1%)
3.300 1.400 1.400 peak 4224 spectrum 1 weight 0.60517E+00 volume 0.22978E-02 ppm1 0.298 ppm2 1.032 CV 1
ASSI { 4238}
(( segid " " and resid 4 and name HG12))
(( segid " " and resid 37 and name HA ))
5.400 3.600 0.600 peak 4238 spectrum 1 weight 0.56038E+00 volume 0.65260E-03 ppm1 1.389 ppm2 4.742 CV 1
ASSI { 4248}
(( segid " " and resid 4 and name HG11))
(( segid " " and resid 3 and name HA ))
4.800 2.900 1.200 peak 4248 spectrum 1 weight 0.59122E+00 volume 0.48160E-03 ppm1 1.217 ppm2 5.468 CV 1
OR { 4248}
(( segid " " and resid 37 and name HG11))
(( segid " " and resid 3 and name HA ))
ASSI { 4265}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 138 and name HD2%)
3.500 1.500 1.500 peak 4265 spectrum 1 weight 0.55724E+00 volume 0.64272E-02 ppm1 2.147 ppm2 0.680 CV 1
ASSI { 4266}
(( segid " " and resid 104 and name HB2 ))
( segid " " and resid 97 and name HD2%)
4.900 3.000 1.100 peak 4266 spectrum 1 weight 0.59598E+00 volume 0.12556E-02 ppm1 2.150 ppm2 0.406 CV 1
ASSI { 4267}
(( segid " " and resid 61 and name HB1 ))
( segid " " and resid 62 and name HD2%)
3.800 1.800 1.800 peak 4267 spectrum 1 weight 0.40923E+00 volume 0.56030E-02 ppm1 2.100 ppm2 0.550 CV 1
ASSI { 4274}
(( segid " " and resid 14 and name HG1 ))
( segid " " and resid 138 and name HD2%)
4.000 2.000 2.000 peak 4274 spectrum 1 weight 0.58136E+00 volume 0.50842E-02 ppm1 2.049 ppm2 0.670 CV 1
ASSI { 4275}
(( segid " " and resid 4 and name HG12))
(( segid " " and resid 38 and name HN ))
6.000 6.000 0.000 peak 4275 spectrum 1 weight 0.42453E+00 volume 0.34658E-04 ppm1 1.397 ppm2 8.573 CV 1
ASSI { 4281}
(( segid " " and resid 4 and name HG12))
(( segid " " and resid 149 and name HA ))
4.400 2.400 1.600 peak 4281 spectrum 1 weight 0.56283E+00 volume 0.12096E-02 ppm1 1.371 ppm2 3.722 CV 1
ASSI { 4282}
(( segid " " and resid 4 and name HG12))
( segid " " and resid 6 and name HD% )
6.000 6.000 0.000 peak 4282 spectrum 1 weight 0.48068E+00 volume 0.12690E-03 ppm1 1.346 ppm2 6.978 CV 1
ASSI { 4289}
(( segid " " and resid 37 and name HG12))
(( segid " " and resid 38 and name HN ))
6.000 4.700 0.000 peak 4289 spectrum 1 weight 0.59047E+00 volume 0.29939E-03 ppm1 1.215 ppm2 8.554 CV 1
OR { 4289}
(( segid " " and resid 37 and name HG11))
(( segid " " and resid 38 and name HN ))
OR { 4289}
(( segid " " and resid 4 and name HG11))
(( segid " " and resid 38 and name HN ))
ASSI { 4293}
( segid " " and resid 117 and name HD1%)
( segid " " and resid 119 and name HE% )
4.900 3.000 1.100 peak 4293 spectrum 1 weight 0.56915E+00 volume 0.85369E-03 ppm1 1.030 ppm2 6.738 CV 1
ASSI { 4313}
(( segid " " and resid 104 and name HB1 ))
( segid " " and resid 97 and name HD2%)
4.300 2.300 1.700 peak 4313 spectrum 1 weight 0.58003E+00 volume 0.10086E-02 ppm1 2.050 ppm2 0.406 CV 1
ASSI { 4327}
( segid " " and resid 117 and name HD1%)
(( segid " " and resid 137 and name HN ))
5.000 3.200 1.000 peak 4327 spectrum 1 weight 0.59146E+00 volume 0.53162E-03 ppm1 1.030 ppm2 7.372 CV 1
ASSI { 4328}
( segid " " and resid 117 and name HD1%)
(( segid " " and resid 114 and name HA ))
5.300 3.500 0.700 peak 4328 spectrum 1 weight 0.59202E+00 volume 0.64194E-03 ppm1 1.028 ppm2 4.979 CV 1
ASSI { 4340}
( segid " " and resid 117 and name HD1%)
(( segid " " and resid 137 and name HG11))
3.200 1.300 1.300 peak 4340 spectrum 1 weight 0.61181E+00 volume 0.30041E-02 ppm1 1.030 ppm2 0.293 CV 1
ASSI { 4341}
( segid " " and resid 117 and name HD1%)
( segid " " and resid 137 and name HD1%)
3.700 1.700 1.700 peak 4341 spectrum 1 weight 0.59821E+00 volume 0.15400E-02 ppm1 1.028 ppm2 -0.100 CV 1
ASSI { 4347}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 20 and name HD% )
3.600 3.600 2.400 peak 4347 spectrum 1 weight 0.54514E+00 volume 0.22118E-02 ppm1 0.524 ppm2 7.394 CV 1
ASSI { 4348}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 20 and name HN ))
3.100 3.100 2.900 peak 4348 spectrum 1 weight 0.59260E+00 volume 0.74580E-03 ppm1 0.513 ppm2 7.620 CV 1
ASSI { 4360}
(( segid " " and resid 142 and name HB1 ))
( segid " " and resid 21 and name HD1%)
5.300 3.500 0.700 peak 4360 spectrum 1 weight 0.59034E+00 volume 0.26167E-03 ppm1 2.831 ppm2 0.573 CV 1
ASSI { 4374}
(( segid " " and resid 123 and name HG1 ))
( segid " " and resid 137 and name HD1%)
4.200 2.200 1.800 peak 4374 spectrum 1 weight 0.59471E+00 volume 0.10790E-02 ppm1 2.041 ppm2 -0.097 CV 1
OR { 4374}
(( segid " " and resid 123 and name HG2 ))
( segid " " and resid 137 and name HD1%)
ASSI { 4375}
(( segid " " and resid 123 and name HG1 ))
( segid " " and resid 119 and name HE% )
4.300 2.300 1.700 peak 4375 spectrum 1 weight 0.56549E+00 volume 0.12005E-02 ppm1 2.037 ppm2 6.754 CV 1
OR { 4375}
(( segid " " and resid 123 and name HG2 ))
( segid " " and resid 119 and name HE% )
ASSI { 4394}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 21 and name HN ))
3.300 3.300 2.700 peak 4394 spectrum 1 weight 0.59106E+00 volume 0.44617E-03 ppm1 0.526 ppm2 8.633 CV 1
OR { 4394}
( segid " " and resid 74 and name HD1%)
(( segid " " and resid 6 and name HN ))
ASSI { 4444}
(( segid " " and resid 140 and name HG ))
(( segid " " and resid 114 and name HA ))
4.400 2.400 1.600 peak 4444 spectrum 1 weight 0.58408E+00 volume 0.13562E-02 ppm1 1.509 ppm2 4.983 CV 1
ASSI { 4482}
(( segid " " and resid 108 and name HG ))
(( segid " " and resid 107 and name HA ))
4.900 3.000 1.100 peak 4482 spectrum 1 weight 0.59128E+00 volume 0.49297E-03 ppm1 1.774 ppm2 5.447 CV 1
ASSI { 4502}
(( segid " " and resid 58 and name HD1 ))
(( segid " " and resid 132 and name HA ))
4.500 2.500 1.500 peak 4502 spectrum 1 weight 0.53543E+00 volume 0.10640E-02 ppm1 1.555 ppm2 4.394 CV 1
ASSI { 4545}
(( segid " " and resid 86 and name HG11))
( segid " " and resid 6 and name HE% )
4.700 2.700 1.300 peak 4545 spectrum 1 weight 0.50695E+00 volume 0.59749E-03 ppm1 0.958 ppm2 6.890 CV 1
OR { 4545}
(( segid " " and resid 145 and name HG ))
( segid " " and resid 6 and name HE% )
ASSI { 4602}
(( segid " " and resid 149 and name HG ))
( segid " " and resid 145 and name HD1%)
2.500 2.500 3.500 peak 4602 spectrum 1 weight 0.58544E+00 volume 0.24663E-02 ppm1 1.662 ppm2 -0.076 CV 1
ASSI { 4609}
(( segid " " and resid 78 and name HG ))
(( segid " " and resid 79 and name HN ))
4.300 2.300 1.700 peak 4609 spectrum 1 weight 0.49903E+00 volume 0.94807E-03 ppm1 0.879 ppm2 7.517 CV 1
ASSI { 4623}
( segid " " and resid 25 and name HD1%)
(( segid " " and resid 22 and name HN ))
3.300 3.300 2.700 peak 4623 spectrum 1 weight 0.46985E+00 volume 0.50208E-03 ppm1 0.722 ppm2 8.844 CV 1
OR { 4623}
( segid " " and resid 146 and name HD1%)
(( segid " " and resid 22 and name HN ))
ASSI { 4634}
( segid " " and resid 145 and name HD2%)
(( segid " " and resid 142 and name HN ))
5.700 4.100 0.300 peak 4634 spectrum 1 weight 0.53058E+00 volume 0.17153E-04 ppm1 0.577 ppm2 8.762 CV 1
OR { 4634}
( segid " " and resid 145 and name HD2%)
(( segid " " and resid 110 and name HN ))
OR { 4634}
( segid " " and resid 145 and name HD2%)
(( segid " " and resid 109 and name HN ))
OR { 4634}
( segid " " and resid 145 and name HD2%)
(( segid " " and resid 141 and name HN ))
ASSI { 4635}
( segid " " and resid 145 and name HD2%)
( segid " " and resid 6 and name HD% )
2.100 2.100 3.900 peak 4635 spectrum 1 weight 0.63245E+00 volume 0.80867E-02 ppm1 0.575 ppm2 6.959 CV 1
ASSI { 4644}
( segid " " and resid 145 and name HD2%)
( segid " " and resid 149 and name HD2%)
2.600 2.600 3.400 peak 4644 spectrum 1 weight 0.82113E+00 volume 0.16263E-01 ppm1 0.576 ppm2 0.245 CV 1
OR { 4644}
( segid " " and resid 145 and name HD2%)
( segid " " and resid 149 and name HD1%)
ASSI { 4652}
( segid " " and resid 149 and name HD2%)
( segid " " and resid 6 and name HD% )
2.700 2.700 3.300 peak 4652 spectrum 1 weight 0.53852E+00 volume 0.14763E-02 ppm1 0.253 ppm2 6.977 CV 1
ASSI { 4659}
( segid " " and resid 149 and name HD2%)
( segid " " and resid 145 and name HD2%)
2.700 2.700 3.300 peak 4659 spectrum 1 weight 0.61272E+00 volume 0.93994E-02 ppm1 0.249 ppm2 0.553 CV 1
ASSI { 4661}
( segid " " and resid 149 and name HD2%)
( segid " " and resid 145 and name HD1%)
2.200 2.200 3.800 peak 4661 spectrum 1 weight 0.59075E+00 volume 0.56929E-02 ppm1 0.249 ppm2 -0.078 CV 1
ASSI { 4663}
(( segid " " and resid 149 and name HG ))
( segid " " and resid 145 and name HD2%)
4.500 2.500 1.500 peak 4663 spectrum 1 weight 0.53385E+00 volume 0.81735E-03 ppm1 1.667 ppm2 0.555 CV 1
ASSI { 4695}
( segid " " and resid 149 and name HD2%)
( segid " " and resid 86 and name HD1%)
1.900 1.900 4.100 peak 4695 spectrum 1 weight 0.59733E+00 volume 0.13582E-01 ppm1 0.247 ppm2 0.419 CV 1
ASSI { 4696}
(( segid " " and resid 79 and name HB1 ))
(( segid " " and resid 80 and name HN ))
3.300 1.400 1.400 peak 4696 spectrum 1 weight 0.60409E+00 volume 0.21885E-02 ppm1 3.225 ppm2 8.524 CV 1
ASSI { 4709}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 80 and name HN ))
5.000 3.100 1.000 peak 4709 spectrum 1 weight 0.57863E+00 volume 0.49549E-03 ppm1 2.434 ppm2 8.526 CV 1
ASSI { 4721}
( segid " " and resid 108 and name HD1%)
(( segid " " and resid 86 and name HA ))
4.800 2.800 1.200 peak 4721 spectrum 1 weight 0.53062E+00 volume 0.51352E-04 ppm1 0.739 ppm2 5.380 CV 1
ASSI { 4722}
( segid " " and resid 108 and name HD1%)
(( segid " " and resid 84 and name HA ))
4.600 2.600 1.400 peak 4722 spectrum 1 weight 0.58982E+00 volume 0.65225E-04 ppm1 0.735 ppm2 5.133 CV 1
ASSI { 4726}
( segid " " and resid 108 and name HD1%)
( segid " " and resid 149 and name HD1%)
3.200 3.200 2.800 peak 4726 spectrum 1 weight 0.57573E+00 volume 0.49212E-02 ppm1 0.735 ppm2 0.195 CV 1
OR { 4726}
( segid " " and resid 108 and name HD1%)
( segid " " and resid 149 and name HD2%)
ASSI { 4727}
( segid " " and resid 108 and name HD1%)
( segid " " and resid 145 and name HD1%)
2.200 2.200 3.800 peak 4727 spectrum 1 weight 0.64755E+00 volume 0.55427E-02 ppm1 0.737 ppm2 -0.082 CV 1
ASSI { 4744}
( segid " " and resid 134 and name HG2%)
(( segid " " and resid 138 and name HN ))
4.700 2.700 1.300 peak 4744 spectrum 1 weight 0.59303E+00 volume 0.81974E-03 ppm1 1.137 ppm2 8.167 CV 1
ASSI { 4760}
( segid " " and resid 108 and name HD1%)
(( segid " " and resid 107 and name HA ))
4.200 2.200 1.800 peak 4760 spectrum 1 weight 0.53072E+00 volume 0.10454E-03 ppm1 0.739 ppm2 5.426 CV 1
ASSI { 4802}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 93 and name HB2 ))
3.600 1.600 1.600 peak 4802 spectrum 1 weight 0.59416E+00 volume 0.99746E-03 ppm1 1.136 ppm2 3.351 CV 1
OR { 4802}
(( segid " " and resid 109 and name HG1 ))
(( segid " " and resid 93 and name HB2 ))
ASSI { 4822}
( segid " " and resid 62 and name HD1%)
( segid " " and resid 135 and name HD% )
5.300 3.500 0.700 peak 4822 spectrum 1 weight 0.59079E+00 volume 0.38188E-03 ppm1 0.301 ppm2 6.997 CV 1
ASSI { 4823}
( segid " " and resid 62 and name HD1%)
( segid " " and resid 135 and name HE% )
3.700 1.700 1.700 peak 4823 spectrum 1 weight 0.60451E+00 volume 0.22312E-02 ppm1 0.304 ppm2 6.590 CV 1
ASSI { 4835}
( segid " " and resid 62 and name HD1%)
(( segid " " and resid 59 and name HB1 ))
4.400 2.400 1.600 peak 4835 spectrum 1 weight 0.60390E+00 volume 0.21696E-02 ppm1 0.304 ppm2 1.081 CV 1
OR { 4835}
( segid " " and resid 62 and name HD1%)
(( segid " " and resid 59 and name HB2 ))
ASSI { 4857}
(( segid " " and resid 33 and name HG1 ))
( segid " " and resid 35 and name HD% )
4.600 2.600 1.400 peak 4857 spectrum 1 weight 0.46585E+00 volume 0.72556E-03 ppm1 1.487 ppm2 7.103 CV 1
ASSI { 4878}
(( segid " " and resid 74 and name HG ))
(( segid " " and resid 79 and name HN ))
4.400 2.400 1.600 peak 4878 spectrum 1 weight 0.56736E+00 volume 0.63270E-03 ppm1 0.620 ppm2 7.527 CV 1
ASSI { 4915}
(( segid " " and resid 73 and name HG1 ))
(( segid " " and resid 74 and name HN ))
2.900 2.900 3.100 peak 4915 spectrum 1 weight 0.56695E+00 volume 0.10819E-02 ppm1 1.203 ppm2 9.317 CV 1
ASSI { 4917}
( segid " " and resid 5 and name HD2%)
( segid " " and resid 6 and name HD% )
6.000 5.500 0.000 peak 4917 spectrum 1 weight 0.41404E+00 volume 0.24461E-03 ppm1 0.613 ppm2 6.933 CV 1
OR { 4917}
( segid " " and resid 5 and name HD1%)
( segid " " and resid 6 and name HD% )
OR { 4917}
( segid " " and resid 5 and name HD2%)
( segid " " and resid 6 and name HE% )
ASSI { 4936}
( segid " " and resid 5 and name HD2%)
(( segid " " and resid 38 and name HN ))
5.100 3.300 0.900 peak 4936 spectrum 1 weight 0.53412E+00 volume 0.86276E-03 ppm1 0.589 ppm2 8.551 CV 1
OR { 4936}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 80 and name HN ))
OR { 4936}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 38 and name HN ))
ASSI { 4938}
( segid " " and resid 5 and name HD2%)
(( segid " " and resid 39 and name HA ))
3.100 1.200 1.200 peak 4938 spectrum 1 weight 0.63153E+00 volume 0.44643E-02 ppm1 0.589 ppm2 5.740 CV 1
ASSI { 4960}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 13 and name HA ))
3.700 1.700 1.700 peak 4960 spectrum 1 weight 0.59634E+00 volume 0.13044E-02 ppm1 1.197 ppm2 5.256 CV 1
ASSI { 4965}
( segid " " and resid 96 and name HG1%)
( segid " " and resid 100 and name HE% )
4.200 2.200 1.800 peak 4965 spectrum 1 weight 0.47722E+00 volume 0.16390E-02 ppm1 0.910 ppm2 7.076 CV 1
ASSI { 4976}
( segid " " and resid 96 and name HG1%)
( segid " " and resid 97 and name HD2%)
2.800 1.000 1.000 peak 4976 spectrum 1 weight 0.86911E+00 volume 0.19014E-01 ppm1 0.911 ppm2 0.339 CV 1
ASSI { 5002}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 25 and name HN ))
6.000 6.000 0.000 peak 5002 spectrum 1 weight 0.46347E+00 volume 0.17095E-04 ppm1 0.846 ppm2 8.277 CV 1
ASSI { 5003}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 27 and name HN ))
4.900 3.100 1.100 peak 5003 spectrum 1 weight 0.59044E+00 volume 0.28990E-03 ppm1 0.843 ppm2 8.038 CV 1
ASSI { 5011}
( segid " " and resid 138 and name HD1%)
(( segid " " and resid 139 and name HN ))
3.000 3.000 3.000 peak 5011 spectrum 1 weight 0.59269E+00 volume 0.76269E-03 ppm1 0.694 ppm2 8.764 CV 1
OR { 5011}
( segid " " and resid 138 and name HD1%)
(( segid " " and resid 142 and name HN ))
ASSI { 5016}
( segid " " and resid 138 and name HD1%)
( segid " " and resid 18 and name HB% )
3.000 1.100 1.100 peak 5016 spectrum 1 weight 0.61652E+00 volume 0.72204E-02 ppm1 0.694 ppm2 0.138 CV 1
OR { 5016}
( segid " " and resid 138 and name HD2%)
( segid " " and resid 18 and name HB% )
ASSI { 5040}
( segid " " and resid 146 and name HD2%)
(( segid " " and resid 149 and name HN ))
4.500 2.600 1.500 peak 5040 spectrum 1 weight 0.59284E+00 volume 0.78809E-03 ppm1 0.529 ppm2 8.698 CV 1
ASSI { 5052}
( segid " " and resid 146 and name HD2%)
( segid " " and resid 149 and name HD2%)
3.200 3.200 2.800 peak 5052 spectrum 1 weight 0.68889E+00 volume 0.10849E-01 ppm1 0.530 ppm2 0.248 CV 1
OR { 5052}
( segid " " and resid 146 and name HD2%)
( segid " " and resid 149 and name HD1%)
ASSI { 5074}
( segid " " and resid 108 and name HD2%)
( segid " " and resid 86 and name HD1%)
2.800 2.800 3.200 peak 5074 spectrum 1 weight 0.60734E+00 volume 0.66965E-02 ppm1 1.004 ppm2 0.455 CV 1
ASSI { 5075}
( segid " " and resid 108 and name HD2%)
( segid " " and resid 149 and name HD1%)
2.900 2.900 3.100 peak 5075 spectrum 1 weight 0.59041E+00 volume 0.11110E-02 ppm1 1.008 ppm2 0.190 CV 1
OR { 5075}
( segid " " and resid 108 and name HD2%)
( segid " " and resid 149 and name HD2%)
ASSI { 5087}
( segid " " and resid 138 and name HD2%)
(( segid " " and resid 14 and name HG2 ))
3.100 1.200 1.200 peak 5087 spectrum 1 weight 0.64385E+00 volume 0.86793E-02 ppm1 0.673 ppm2 2.141 CV 1
ASSI { 5094}
( segid " " and resid 138 and name HD2%)
(( segid " " and resid 14 and name HB2 ))
3.600 1.600 1.600 peak 5094 spectrum 1 weight 0.62998E+00 volume 0.43533E-02 ppm1 0.672 ppm2 2.409 CV 1
ASSI { 5095}
( segid " " and resid 138 and name HD2%)
(( segid " " and resid 14 and name HG1 ))
2.100 2.100 3.900 peak 5095 spectrum 1 weight 0.62703E+00 volume 0.77972E-02 ppm1 0.672 ppm2 2.035 CV 1
ASSI { 5110}
( segid " " and resid 108 and name HD2%)
(( segid " " and resid 84 and name HA ))
2.400 2.400 3.600 peak 5110 spectrum 1 weight 0.47639E+00 volume 0.30401E-02 ppm1 0.993 ppm2 5.178 CV 1
OR { 5110}
( segid " " and resid 122 and name HG1%)
(( segid " " and resid 89 and name HA ))
ASSI { 5125}
( segid " " and resid 40 and name HB% )
(( segid " " and resid 41 and name HA2 ))
5.900 4.300 0.100 peak 5125 spectrum 1 weight 0.34732E+00 volume 0.38256E-03 ppm1 1.142 ppm2 5.331 CV 1
ASSI { 5154}
( segid " " and resid 40 and name HB% )
(( segid " " and resid 74 and name HN ))
2.600 0.900 0.900 peak 5154 spectrum 1 weight 0.55654E+00 volume 0.29999E-02 ppm1 1.143 ppm2 9.309 CV 1
ASSI { 5157}
( segid " " and resid 40 and name HB% )
(( segid " " and resid 39 and name HA ))
4.600 2.700 1.400 peak 5157 spectrum 1 weight 0.52632E+00 volume 0.68811E-03 ppm1 1.144 ppm2 5.746 CV 1
ASSI { 5158}
( segid " " and resid 40 and name HB% )
(( segid " " and resid 7 and name HA ))
4.500 2.500 1.500 peak 5158 spectrum 1 weight 0.54378E+00 volume 0.66704E-03 ppm1 1.146 ppm2 5.510 CV 1
ASSI { 5170}
( segid " " and resid 87 and name HG2%)
(( segid " " and resid 93 and name HB2 ))
3.600 1.600 1.600 peak 5170 spectrum 1 weight 0.55321E+00 volume 0.61860E-02 ppm1 1.071 ppm2 3.334 CV 1
OR { 5170}
( segid " " and resid 87 and name HG2%)
(( segid " " and resid 93 and name HB1 ))
ASSI { 5174}
( segid " " and resid 87 and name HG2%)
(( segid " " and resid 86 and name HA ))
3.300 1.400 1.400 peak 5174 spectrum 1 weight 0.61677E+00 volume 0.72339E-02 ppm1 1.068 ppm2 5.346 CV 1
OR { 5174}
( segid " " and resid 87 and name HG2%)
(( segid " " and resid 107 and name HA ))
ASSI { 5189}
( segid " " and resid 107 and name HG1%)
(( segid " " and resid 93 and name HB2 ))
4.000 2.000 2.000 peak 5189 spectrum 1 weight 0.44794E+00 volume 0.15618E-02 ppm1 0.940 ppm2 3.357 CV 1
OR { 5189}
( segid " " and resid 107 and name HG2%)
(( segid " " and resid 93 and name HB2 ))
ASSI { 5202}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 100 and name HB2 ))
5.200 3.400 0.800 peak 5202 spectrum 1 weight 0.52755E+00 volume 0.12352E-02 ppm1 0.775 ppm2 3.080 CV 1
ASSI { 5228}
( segid " " and resid 107 and name HG1%)
(( segid " " and resid 87 and name HA ))
3.200 3.200 2.800 peak 5228 spectrum 1 weight 0.53407E+00 volume 0.85463E-03 ppm1 0.940 ppm2 5.182 CV 1
OR { 5228}
( segid " " and resid 103 and name HG2%)
(( segid " " and resid 84 and name HA ))
OR { 5228}
( segid " " and resid 107 and name HG2%)
(( segid " " and resid 87 and name HA ))
ASSI { 5247}
( segid " " and resid 96 and name HG2%)
( segid " " and resid 97 and name HD2%)
3.400 1.400 1.400 peak 5247 spectrum 1 weight 0.56434E+00 volume 0.68420E-02 ppm1 0.772 ppm2 0.346 CV 1
OR { 5247}
( segid " " and resid 96 and name HG2%)
( segid " " and resid 74 and name HD2%)
ASSI { 5262}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 36 and name HN ))
4.400 2.400 1.600 peak 5262 spectrum 1 weight 0.59068E+00 volume 0.35503E-03 ppm1 0.868 ppm2 8.869 CV 1
OR { 5262}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 36 and name HN ))
OR { 5262}
( segid " " and resid 25 and name HD2%)
(( segid " " and resid 22 and name HN ))
ASSI { 5283}
( segid " " and resid 62 and name HD2%)
( segid " " and resid 135 and name HE% )
5.100 3.300 0.900 peak 5283 spectrum 1 weight 0.59133E+00 volume 0.50510E-03 ppm1 0.548 ppm2 6.585 CV 1
ASSI { 5313}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 35 and name HA ))
5.500 5.500 0.500 peak 5313 spectrum 1 weight 0.49665E+00 volume 0.61049E-03 ppm1 0.877 ppm2 5.583 CV 1
OR { 5313}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 35 and name HA ))
ASSI { 5320}
( segid " " and resid 59 and name HD2%)
(( segid " " and resid 21 and name HN ))
2.800 2.800 3.200 peak 5320 spectrum 1 weight 0.53772E+00 volume 0.13762E-02 ppm1 0.817 ppm2 8.620 CV 1
ASSI { 5346}
( segid " " and resid 149 and name HD1%)
( segid " " and resid 86 and name HD1%)
4.100 2.100 1.900 peak 5346 spectrum 1 weight 0.53418E+00 volume 0.87287E-03 ppm1 0.177 ppm2 0.444 CV 1
ASSI { 5348}
( segid " " and resid 149 and name HD1%)
( segid " " and resid 145 and name HD1%)
2.200 2.200 3.800 peak 5348 spectrum 1 weight 0.59699E+00 volume 0.60803E-02 ppm1 0.179 ppm2 -0.080 CV 1
ASSI { 5354}
( segid " " and resid 145 and name HD1%)
( segid " " and resid 6 and name HE% )
5.400 3.700 0.600 peak 5354 spectrum 1 weight 0.53666E+00 volume 0.18261E-03 ppm1 -0.080 ppm2 6.864 CV 1
ASSI { 5367}
( segid " " and resid 145 and name HD1%)
( segid " " and resid 149 and name HD1%)
2.800 2.800 3.200 peak 5367 spectrum 1 weight 0.73445E+00 volume 0.14704E-01 ppm1 -0.083 ppm2 0.219 CV 1
OR { 5367}
( segid " " and resid 145 and name HD1%)
( segid " " and resid 149 and name HD2%)
ASSI { 5384}
( segid " " and resid 149 and name HD1%)
( segid " " and resid 145 and name HD2%)
3.600 3.600 2.400 peak 5384 spectrum 1 weight 0.51685E+00 volume 0.20497E-02 ppm1 0.180 ppm2 0.554 CV 1
ASSI { 5386}
( segid " " and resid 75 and name HG2%)
( segid " " and resid 100 and name HE% )
5.200 3.300 0.800 peak 5386 spectrum 1 weight 0.56997E+00 volume 0.12090E-02 ppm1 1.272 ppm2 7.071 CV 1
ASSI { 5389}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 43 and name HA ))
2.500 2.500 3.500 peak 5389 spectrum 1 weight 0.50091E+00 volume 0.27352E-02 ppm1 1.269 ppm2 4.500 CV 1
ASSI { 5395}
( segid " " and resid 110 and name HG2%)
(( segid " " and resid 88 and name HA ))
2.700 0.900 0.900 peak 5395 spectrum 1 weight 0.64008E+00 volume 0.90766E-02 ppm1 1.213 ppm2 5.044 CV 1
ASSI { 5407}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 74 and name HA ))
5.000 3.100 1.000 peak 5407 spectrum 1 weight 0.57821E+00 volume 0.96776E-03 ppm1 1.274 ppm2 3.715 CV 1
ASSI { 5422}
( segid " " and resid 147 and name HG1%)
(( segid " " and resid 144 and name HA ))
3.800 1.800 1.800 peak 5422 spectrum 1 weight 0.59717E+00 volume 0.14110E-02 ppm1 0.997 ppm2 4.643 CV 1
ASSI { 5439}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 41 and name HA2 ))
5.300 3.600 0.700 peak 5439 spectrum 1 weight 0.52895E+00 volume 0.84226E-03 ppm1 1.199 ppm2 5.328 CV 1
ASSI { 5451}
( segid " " and resid 42 and name HG2%)
( segid " " and resid 74 and name HD2%)
3.500 3.500 2.500 peak 5451 spectrum 1 weight 0.69847E+00 volume 0.13144E-01 ppm1 1.195 ppm2 0.334 CV 1
ASSI { 5459}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 36 and name HN ))
3.300 1.300 1.300 peak 5459 spectrum 1 weight 0.59135E+00 volume 0.50925E-03 ppm1 1.148 ppm2 8.869 CV 1
ASSI { 5460}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 6 and name HN ))
5.200 3.400 0.800 peak 5460 spectrum 1 weight 0.59188E+00 volume 0.61517E-03 ppm1 1.145 ppm2 8.704 CV 1
OR { 5460}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 39 and name HN ))
ASSI { 5461}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 38 and name HN ))
3.900 1.900 1.900 peak 5461 spectrum 1 weight 0.63766E+00 volume 0.48907E-02 ppm1 1.147 ppm2 8.566 CV 1
ASSI { 5477}
( segid " " and resid 37 and name HG2%)
( segid " " and resid 4 and name HG2%)
3.900 1.900 1.900 peak 5477 spectrum 1 weight 0.61532E+00 volume 0.32186E-02 ppm1 1.144 ppm2 0.258 CV 1
ASSI { 5551}
( segid " " and resid 141 and name HB% )
(( segid " " and resid 138 and name HN ))
3.200 3.200 2.800 peak 5551 spectrum 1 weight 0.57369E+00 volume 0.54140E-03 ppm1 1.380 ppm2 8.168 CV 1
ASSI { 5589}
( segid " " and resid 29 and name HB% )
( segid " " and resid 146 and name HD2%)
2.100 2.100 3.900 peak 5589 spectrum 1 weight 0.56418E+00 volume 0.68329E-02 ppm1 1.441 ppm2 0.540 CV 1
ASSI { 5591}
( segid " " and resid 141 and name HB% )
(( segid " " and resid 145 and name HN ))
5.000 3.100 1.000 peak 5591 spectrum 1 weight 0.59152E+00 volume 0.54279E-03 ppm1 1.379 ppm2 9.153 CV 1
ASSI { 5593}
( segid " " and resid 141 and name HB% )
( segid " " and resid 113 and name HD% )
4.200 2.200 1.800 peak 5593 spectrum 1 weight 0.59598E+00 volume 0.12555E-02 ppm1 1.380 ppm2 7.119 CV 1
ASSI { 5651}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 110 and name HN ))
3.900 1.900 1.900 peak 5651 spectrum 1 weight 0.61118E+00 volume 0.28606E-02 ppm1 0.922 ppm2 8.744 CV 1
OR { 5651}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 109 and name HN ))
ASSI { 5656}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 87 and name HA ))
6.000 5.900 0.000 peak 5656 spectrum 1 weight 0.52224E+00 volume 0.64962E-04 ppm1 0.921 ppm2 5.199 CV 1
ASSI { 5662}
( segid " " and resid 86 and name HG2%)
( segid " " and resid 145 and name HD2%)
2.600 2.600 3.400 peak 5662 spectrum 1 weight 0.67149E+00 volume 0.12099E-01 ppm1 0.921 ppm2 0.589 CV 1
ASSI { 5665}
( segid " " and resid 86 and name HG2%)
( segid " " and resid 145 and name HD1%)
3.500 1.600 1.600 peak 5665 spectrum 1 weight 0.59881E+00 volume 0.16120E-02 ppm1 0.921 ppm2 -0.081 CV 1
ASSI { 5666}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 88 and name HA ))
5.700 4.000 0.300 peak 5666 spectrum 1 weight 0.49656E+00 volume 0.24153E-03 ppm1 0.916 ppm2 5.069 CV 1
OR { 5666}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 85 and name HA ))
ASSI { 5675}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 109 and name HA ))
4.300 2.300 1.700 peak 5675 spectrum 1 weight 0.53638E+00 volume 0.15220E-02 ppm1 0.920 ppm2 4.587 CV 1
OR { 5675}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 87 and name HB ))
ASSI { 5686}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 8 and name HA ))
3.700 1.700 1.700 peak 5686 spectrum 1 weight 0.57135E+00 volume 0.43923E-02 ppm1 0.828 ppm2 5.334 CV 1
OR { 5686}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 41 and name HA2 ))
OR { 5686}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 6 and name HA ))
ASSI { 5687}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 92 and name HA ))
4.800 2.900 1.200 peak 5687 spectrum 1 weight 0.59381E+00 volume 0.94436E-03 ppm1 0.829 ppm2 4.746 CV 1
OR { 5687}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 73 and name HA ))
ASSI { 5694}
( segid " " and resid 7 and name HG2%)
( segid " " and resid 74 and name HD2%)
3.100 1.200 1.200 peak 5694 spectrum 1 weight 0.74447E+00 volume 0.10685E-01 ppm1 0.829 ppm2 0.340 CV 1
ASSI { 5704}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 20 and name HD% )
6.000 4.800 0.000 peak 5704 spectrum 1 weight 0.58995E+00 volume 0.12946E-03 ppm1 0.876 ppm2 7.426 CV 1
ASSI { 5706}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 56 and name HA ))
2.600 2.600 3.400 peak 5706 spectrum 1 weight 0.62194E+00 volume 0.37517E-02 ppm1 0.874 ppm2 3.335 CV 1
OR { 5706}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 20 and name HB1 ))
ASSI { 5709}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 20 and name HB2 ))
3.200 3.200 2.800 peak 5709 spectrum 1 weight 0.56298E+00 volume 0.40361E-02 ppm1 0.873 ppm2 2.607 CV 1
ASSI { 5713}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 8 and name HN ))
3.900 1.900 1.900 peak 5713 spectrum 1 weight 0.59728E+00 volume 0.14254E-02 ppm1 0.826 ppm2 7.937 CV 1
ASSI { 5714}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 87 and name HA ))
4.500 2.600 1.500 peak 5714 spectrum 1 weight 0.53971E+00 volume 0.16204E-02 ppm1 0.827 ppm2 5.188 CV 1
ASSI { 5715}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 87 and name HB ))
5.000 3.100 1.000 peak 5715 spectrum 1 weight 0.53531E+00 volume 0.10451E-02 ppm1 0.829 ppm2 4.554 CV 1
OR { 5715}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 40 and name HA ))
ASSI { 5716}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 92 and name HB1 ))
4.500 2.600 1.500 peak 5716 spectrum 1 weight 0.54447E+00 volume 0.21429E-02 ppm1 0.831 ppm2 2.632 CV 1
OR { 5716}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 6 and name HB2 ))
ASSI { 5731}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 38 and name HN ))
5.500 3.800 0.500 peak 5731 spectrum 1 weight 0.59083E+00 volume 0.39246E-03 ppm1 0.253 ppm2 8.558 CV 1
ASSI { 5733}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 86 and name HN ))
6.000 6.000 0.000 peak 5733 spectrum 1 weight 0.54623E+00 volume 0.69609E-04 ppm1 0.251 ppm2 9.125 CV 1
OR { 5733}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 87 and name HN ))
ASSI { 5734}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 6 and name HN ))
5.100 3.300 0.900 peak 5734 spectrum 1 weight 0.59162E+00 volume 0.56372E-03 ppm1 0.247 ppm2 8.682 CV 1
OR { 5734}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 85 and name HN ))
OR { 5734}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 149 and name HN ))
ASSI { 5735}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 5 and name HN ))
3.400 1.400 1.400 peak 5735 spectrum 1 weight 0.61558E+00 volume 0.32400E-02 ppm1 0.251 ppm2 8.402 CV 1
ASSI { 5736}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 84 and name HN ))
6.000 6.000 0.000 peak 5736 spectrum 1 weight 0.53066E+00 volume 0.70741E-04 ppm1 0.245 ppm2 7.431 CV 1
ASSI { 5753}
( segid " " and resid 4 and name HG2%)
( segid " " and resid 145 and name HD2%)
3.600 3.600 2.400 peak 5753 spectrum 1 weight 0.58684E+00 volume 0.54439E-02 ppm1 0.250 ppm2 0.569 CV 1
OR { 5753}
( segid " " and resid 4 and name HG2%)
( segid " " and resid 5 and name HD1%)
OR { 5753}
( segid " " and resid 4 and name HG2%)
( segid " " and resid 5 and name HD2%)
ASSI { 5754}
( segid " " and resid 4 and name HG2%)
( segid " " and resid 86 and name HD1%)
2.300 2.300 3.700 peak 5754 spectrum 1 weight 0.79195E+00 volume 0.15156E-01 ppm1 0.249 ppm2 0.442 CV 1
ASSI { 5791}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 22 and name HN ))
4.700 2.700 1.300 peak 5791 spectrum 1 weight 0.54453E+00 volume 0.21487E-02 ppm1 0.734 ppm2 8.870 CV 1
ASSI { 5796}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 18 and name HA ))
4.300 2.400 1.700 peak 5796 spectrum 1 weight 0.54379E+00 volume 0.20724E-02 ppm1 0.735 ppm2 3.322 CV 1
ASSI { 5799}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 22 and name HB2 ))
4.600 2.700 1.400 peak 5799 spectrum 1 weight 0.53988E+00 volume 0.16400E-02 ppm1 0.739 ppm2 2.536 CV 1
OR { 5799}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 22 and name HG1 ))
OR { 5799}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 17 and name HG1 ))
ASSI { 5805}
( segid " " and resid 137 and name HG2%)
(( segid " " and resid 141 and name HN ))
4.900 3.000 1.100 peak 5805 spectrum 1 weight 0.55313E+00 volume 0.56638E-03 ppm1 0.641 ppm2 8.747 CV 1
OR { 5805}
( segid " " and resid 137 and name HG2%)
(( segid " " and resid 139 and name HN ))
ASSI { 5806}
( segid " " and resid 137 and name HG2%)
(( segid " " and resid 138 and name HN ))
4.400 2.400 1.600 peak 5806 spectrum 1 weight 0.54904E+00 volume 0.15790E-02 ppm1 0.639 ppm2 8.174 CV 1
ASSI { 5906}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 86 and name HN ))
3.500 1.500 1.500 peak 5906 spectrum 1 weight 0.54756E+00 volume 0.24500E-02 ppm1 0.690 ppm2 9.112 CV 1
OR { 5906}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 87 and name HN ))
ASSI { 5909}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 6 and name HA ))
4.500 2.600 1.500 peak 5909 spectrum 1 weight 0.53537E+00 volume 0.10549E-02 ppm1 0.690 ppm2 5.348 CV 1
OR { 5909}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 86 and name HA ))
OR { 5909}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 8 and name HA ))
ASSI { 5910}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 87 and name HA ))
4.600 2.700 1.400 peak 5910 spectrum 1 weight 0.53492E+00 volume 0.98837E-03 ppm1 0.690 ppm2 5.181 CV 1
ASSI { 5911}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 85 and name HA ))
3.800 1.800 1.800 peak 5911 spectrum 1 weight 0.54431E+00 volume 0.21264E-02 ppm1 0.691 ppm2 5.055 CV 1
ASSI { 5918}
( segid " " and resid 7 and name HD1%)
( segid " " and resid 74 and name HD2%)
2.500 2.500 3.500 peak 5918 spectrum 1 weight 0.77340E+00 volume 0.14430E-01 ppm1 0.691 ppm2 0.339 CV 1
ASSI { 5919}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 22 and name HN ))
4.900 3.000 1.100 peak 5919 spectrum 1 weight 0.55499E+00 volume 0.80649E-03 ppm1 0.526 ppm2 8.881 CV 1
ASSI { 5923}
( segid " " and resid 21 and name HD1%)
( segid " " and resid 18 and name HB% )
4.500 2.500 1.500 peak 5923 spectrum 1 weight 0.56221E+00 volume 0.13109E-02 ppm1 0.526 ppm2 0.134 CV 1
ASSI { 5935}
( segid " " and resid 18 and name HB% )
( segid " " and resid 21 and name HD1%)
3.700 1.700 1.700 peak 5935 spectrum 1 weight 0.56619E+00 volume 0.40133E-02 ppm1 0.136 ppm2 0.548 CV 1
ASSI { 5936}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 21 and name HN ))
6.000 6.000 0.000 peak 5936 spectrum 1 weight 0.55523E+00 volume 0.35371E-04 ppm1 0.131 ppm2 8.648 CV 1
ASSI { 5937}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 19 and name HN ))
3.200 1.300 1.300 peak 5937 spectrum 1 weight 0.62268E+00 volume 0.38090E-02 ppm1 0.133 ppm2 8.168 CV 1
ASSI { 5941}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 19 and name HA ))
4.200 2.300 1.800 peak 5941 spectrum 1 weight 0.59512E+00 volume 0.11374E-02 ppm1 0.132 ppm2 3.462 CV 1
ASSI { 5950}
( segid " " and resid 18 and name HB% )
( segid " " and resid 138 and name HD2%)
2.600 0.800 0.800 peak 5950 spectrum 1 weight 0.86391E+00 volume 0.24015E-01 ppm1 0.134 ppm2 0.718 CV 1
ASSI { 5954}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 142 and name HN ))
4.300 2.400 1.700 peak 5954 spectrum 1 weight 0.59974E+00 volume 0.17205E-02 ppm1 0.522 ppm2 8.754 CV 1
OR { 5954}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 139 and name HN ))
ASSI { 5956}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 19 and name HN ))
6.000 4.700 0.000 peak 5956 spectrum 1 weight 0.59074E+00 volume 0.36950E-03 ppm1 0.524 ppm2 8.164 CV 1
OR { 5956}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 138 and name HN ))
ASSI { 5959}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 19 and name HA ))
4.600 2.600 1.400 peak 5959 spectrum 1 weight 0.51258E+00 volume 0.15721E-02 ppm1 0.525 ppm2 3.433 CV 1
OR { 5959}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 139 and name HB1 ))
ASSI { 5960}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 18 and name HA ))
2.900 1.000 1.000 peak 5960 spectrum 1 weight 0.55610E+00 volume 0.37028E-02 ppm1 0.523 ppm2 3.317 CV 1
ASSI { 5978}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 14 and name HD2 ))
6.000 6.000 0.000 peak 5978 spectrum 1 weight 0.46369E+00 volume 0.35205E-04 ppm1 0.138 ppm2 3.161 CV 1
OR { 5978}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 14 and name HD1 ))
ASSI { 6007}
( segid " " and resid 110 and name HD1%)
( segid " " and resid 145 and name HD1%)
3.700 1.700 1.700 peak 6007 spectrum 1 weight 0.57386E+00 volume 0.18738E-02 ppm1 0.928 ppm2 -0.080 CV 1
ASSI { 6011}
( segid " " and resid 110 and name HD1%)
(( segid " " and resid 145 and name HN ))
4.600 2.700 1.400 peak 6011 spectrum 1 weight 0.59157E+00 volume 0.55346E-03 ppm1 0.926 ppm2 9.143 CV 1
ASSI { 6030}
( segid " " and resid 4 and name HD1%)
( segid " " and resid 86 and name HD1%)
3.900 1.900 1.900 peak 6030 spectrum 1 weight 0.55189E+00 volume 0.59880E-02 ppm1 0.710 ppm2 0.432 CV 1
ASSI { 6032}
( segid " " and resid 4 and name HD1%)
(( segid " " and resid 5 and name HN ))
5.900 4.400 0.100 peak 6032 spectrum 1 weight 0.58527E+00 volume 0.55224E-03 ppm1 0.707 ppm2 8.407 CV 1
ASSI { 6033}
( segid " " and resid 4 and name HD1%)
(( segid " " and resid 84 and name HN ))
4.700 2.800 1.300 peak 6033 spectrum 1 weight 0.55430E+00 volume 0.56925E-03 ppm1 0.704 ppm2 7.439 CV 1
ASSI { 6042}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 5 and name HN ))
4.500 2.600 1.500 peak 6042 spectrum 1 weight 0.57882E+00 volume 0.53575E-03 ppm1 0.451 ppm2 8.411 CV 1
ASSI { 6045}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 87 and name HA ))
4.000 2.000 2.000 peak 6045 spectrum 1 weight 0.49972E+00 volume 0.72410E-03 ppm1 0.457 ppm2 5.164 CV 1
OR { 6045}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 84 and name HA ))
ASSI { 6046}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 85 and name HA ))
4.000 2.000 2.000 peak 6046 spectrum 1 weight 0.48307E+00 volume 0.11329E-02 ppm1 0.454 ppm2 5.073 CV 1
ASSI { 6056}
( segid " " and resid 86 and name HD1%)
( segid " " and resid 4 and name HG2%)
2.100 0.600 0.600 peak 6056 spectrum 1 weight 0.81839E+00 volume 0.34831E-01 ppm1 0.451 ppm2 0.252 CV 1
OR { 6056}
( segid " " and resid 86 and name HD1%)
( segid " " and resid 149 and name HD1%)
ASSI { 6065}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 126 and name HD1 ))
5.600 3.900 0.400 peak 6065 spectrum 1 weight 0.59038E+00 volume 0.27552E-03 ppm1 0.330 ppm2 5.809 CV 1
ASSI { 6067}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 16 and name HD2 ))
4.400 2.400 1.600 peak 6067 spectrum 1 weight 0.58001E+00 volume 0.75907E-03 ppm1 0.327 ppm2 3.722 CV 1
ASSI { 6074}
( segid " " and resid 137 and name HD1%)
(( segid " " and resid 138 and name HN ))
3.000 3.000 3.000 peak 6074 spectrum 1 weight 0.59093E+00 volume 0.88588E-03 ppm1 -0.105 ppm2 8.168 CV 1
ASSI { 6096}
( segid " " and resid 4 and name HD1%)
(( segid " " and resid 36 and name HN ))
4.800 2.900 1.200 peak 6096 spectrum 1 weight 0.45482E+00 volume 0.38118E-03 ppm1 0.708 ppm2 8.871 CV 1
ASSI { 6117}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 26 and name HN ))
2.700 2.700 3.300 peak 6117 spectrum 1 weight 0.47650E+00 volume 0.14638E-02 ppm1 0.703 ppm2 8.688 CV 1
OR { 6117}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 39 and name HN ))
ASSI { 6118}
( segid " " and resid 4 and name HD1%)
(( segid " " and resid 35 and name HA ))
6.000 5.500 0.000 peak 6118 spectrum 1 weight 0.45683E+00 volume 0.13823E-03 ppm1 0.702 ppm2 5.554 CV 1
ASSI { 6119}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 36 and name HA ))
3.700 3.700 2.300 peak 6119 spectrum 1 weight 0.55179E+00 volume 0.24864E-03 ppm1 0.703 ppm2 4.997 CV 1
ASSI { 6130}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 38 and name HN ))
2.600 2.600 3.400 peak 6130 spectrum 1 weight 0.54428E+00 volume 0.21234E-02 ppm1 0.702 ppm2 8.570 CV 1
ASSI { 6149}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 5 and name HN ))
4.100 2.100 1.900 peak 6149 spectrum 1 weight 0.59070E+00 volume 0.36034E-03 ppm1 5.039 ppm2 8.387 CV 1
ASSI { 31}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 77 and name HN ))
2.700 0.900 0.900 peak 31 spectrum 1 weight 0.55122E+00 volume 0.57860E-02 ppm1 4.644 ppm2 8.146 CV 1
ASSI { 222}
(( segid " " and resid 114 and name HB1 ))
( segid " " and resid 140 and name HD2%)
3.700 1.700 1.700 peak 222 spectrum 1 weight 0.61409E+00 volume 0.29715E-02 ppm1 3.224 ppm2 0.888 CV 1
ASSI { 223}
(( segid " " and resid 114 and name HB1 ))
( segid " " and resid 141 and name HB% )
5.000 3.100 1.000 peak 223 spectrum 1 weight 0.66835E+00 volume 0.50030E-03 ppm1 3.219 ppm2 1.361 CV 1
ASSI { 278}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 102 and name HN ))
2.400 0.700 0.700 peak 278 spectrum 1 weight 0.85171E+00 volume 0.16587E-01 ppm1 4.396 ppm2 9.139 CV 1
ASSI { 366}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 59 and name HD2%)
3.100 1.200 1.200 peak 366 spectrum 1 weight 0.58620E+00 volume 0.51544E-02 ppm1 3.625 ppm2 0.775 CV 1
ASSI { 367}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 59 and name HD1%)
3.000 1.100 1.100 peak 367 spectrum 1 weight 0.60868E+00 volume 0.64631E-02 ppm1 3.623 ppm2 0.515 CV 1
ASSI { 373}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 31 and name HN ))
3.200 1.200 1.200 peak 373 spectrum 1 weight 0.60589E+00 volume 0.22597E-02 ppm1 4.185 ppm2 8.257 CV 1
ASSI { 383}
(( segid " " and resid 143 and name HA ))
( segid " " and resid 146 and name HD1%)
2.600 0.800 0.800 peak 383 spectrum 1 weight 0.86391E+00 volume 0.35268E-01 ppm1 3.846 ppm2 0.670 CV 1
ASSI { 406}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HN ))
3.800 1.800 1.800 peak 406 spectrum 1 weight 0.60112E+00 volume 0.17891E-02 ppm1 4.499 ppm2 9.405 CV 1
ASSI { 410}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 83 and name HN ))
2.000 0.500 0.500 peak 410 spectrum 1 weight 0.74552E+00 volume 0.10240E-01 ppm1 4.433 ppm2 8.978 CV 1
ASSI { 438}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 63 and name HN ))
3.700 1.800 1.800 peak 438 spectrum 1 weight 0.76992E+00 volume 0.11283E-01 ppm1 3.896 ppm2 7.934 CV 1
ASSI { 439}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HN ))
3.300 1.300 1.300 peak 439 spectrum 1 weight 0.62756E+00 volume 0.39847E-02 ppm1 3.894 ppm2 7.047 CV 1
ASSI { 445}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 120 and name HN ))
2.600 0.800 0.800 peak 445 spectrum 1 weight 0.67759E+00 volume 0.98526E-02 ppm1 4.611 ppm2 9.040 CV 1
ASSI { 449}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 120 and name HB1 ))
3.600 1.600 1.600 peak 449 spectrum 1 weight 0.65313E+00 volume 0.87271E-02 ppm1 4.611 ppm2 2.638 CV 1
ASSI { 476}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HN ))
2.600 0.900 0.900 peak 476 spectrum 1 weight 0.67701E+00 volume 0.69589E-02 ppm1 4.248 ppm2 8.051 CV 1
ASSI { 515}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 99 and name HN ))
3.000 1.100 1.100 peak 515 spectrum 1 weight 0.69919E+00 volume 0.80932E-02 ppm1 4.212 ppm2 7.867 CV 1
ASSI { 588}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HN ))
1.900 0.500 0.500 peak 588 spectrum 1 weight 0.86391E+00 volume 0.17260E-01 ppm1 3.928 ppm2 8.524 CV 1
ASSI { 594}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 107 and name HN ))
3.300 1.400 1.400 peak 594 spectrum 1 weight 0.61789E+00 volume 0.32732E-02 ppm1 4.626 ppm2 7.137 CV 1
ASSI { 616}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HA2 ))
6.000 4.800 0.000 peak 616 spectrum 1 weight 0.53123E+00 volume 0.26662E-03 ppm1 3.919 ppm2 3.516 CV 1
ASSI { 623}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name HN ))
2.700 0.900 0.900 peak 623 spectrum 1 weight 0.59400E+00 volume 0.80680E-02 ppm1 4.291 ppm2 7.232 CV 1
ASSI { 641}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name HN ))
2.600 0.900 0.900 peak 641 spectrum 1 weight 0.64905E+00 volume 0.53793E-02 ppm1 4.301 ppm2 8.662 CV 1
ASSI { 651}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 75 and name HN ))
2.400 0.700 0.700 peak 651 spectrum 1 weight 0.66771E+00 volume 0.64555E-02 ppm1 3.684 ppm2 6.320 CV 1
ASSI { 694}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HN ))
3.000 1.100 1.100 peak 694 spectrum 1 weight 0.64201E+00 volume 0.49444E-02 ppm1 3.569 ppm2 7.410 CV 1
ASSI { 724}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 89 and name HA ))
2.800 1.000 1.000 peak 724 spectrum 1 weight 0.62222E+00 volume 0.36004E-02 ppm1 4.415 ppm2 5.117 CV 1
ASSI { 726}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 122 and name HN ))
2.100 0.600 0.600 peak 726 spectrum 1 weight 0.82626E+00 volume 0.15699E-01 ppm1 4.411 ppm2 8.035 CV 1
ASSI { 730}
(( segid " " and resid 121 and name HA ))
( segid " " and resid 122 and name HG1%)
3.000 1.100 1.100 peak 730 spectrum 1 weight 0.71642E+00 volume 0.11519E-01 ppm1 4.408 ppm2 0.808 CV 1
ASSI { 749}
(( segid " " and resid 118 and name HA ))
(( segid " " and resid 119 and name HN ))
2.400 0.700 0.700 peak 749 spectrum 1 weight 0.79225E+00 volume 0.14471E-01 ppm1 4.519 ppm2 7.785 CV 1
ASSI { 756}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 69 and name HN ))
2.400 0.700 0.700 peak 756 spectrum 1 weight 0.81839E+00 volume 0.23003E-01 ppm1 4.466 ppm2 8.123 CV 1
ASSI { 762}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 67 and name HA ))
4.200 2.200 1.800 peak 762 spectrum 1 weight 0.60866E+00 volume 0.25111E-02 ppm1 4.460 ppm2 3.946 CV 1
ASSI { 766}
(( segid " " and resid 120 and name HA ))
(( segid " " and resid 121 and name HN ))
3.300 1.400 1.400 peak 766 spectrum 1 weight 0.61392E+00 volume 0.29577E-02 ppm1 4.643 ppm2 7.647 CV 1
ASSI { 807}
(( segid " " and resid 123 and name HD1 ))
( segid " " and resid 122 and name HG1%)
4.700 2.700 1.300 peak 807 spectrum 1 weight 0.59886E+00 volume 0.15430E-02 ppm1 3.262 ppm2 0.825 CV 1
ASSI { 811}
(( segid " " and resid 115 and name HD2 ))
(( segid " " and resid 114 and name HN ))
5.100 3.200 0.900 peak 811 spectrum 1 weight 0.59705E+00 volume 0.13313E-02 ppm1 3.228 ppm2 7.598 CV 1
ASSI { 812}
(( segid " " and resid 115 and name HD2 ))
(( segid " " and resid 114 and name HA ))
4.100 2.100 1.900 peak 812 spectrum 1 weight 0.59138E+00 volume 0.49106E-03 ppm1 3.225 ppm2 4.945 CV 1
ASSI { 815}
(( segid " " and resid 115 and name HD1 ))
(( segid " " and resid 114 and name HA ))
2.900 1.000 1.000 peak 815 spectrum 1 weight 0.60646E+00 volume 0.23126E-02 ppm1 3.442 ppm2 4.949 CV 1
ASSI { 847}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 12 and name HA ))
4.200 2.300 1.800 peak 847 spectrum 1 weight 0.61106E+00 volume 0.32311E-02 ppm1 3.716 ppm2 4.693 CV 1
OR { 847}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 46 and name HA ))
OR { 847}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 50 and name HA2 ))
ASSI { 866}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 47 and name HA ))
2.900 1.000 1.000 peak 866 spectrum 1 weight 0.86391E+00 volume 0.28910E-01 ppm1 4.291 ppm2 3.910 CV 1
ASSI { 867}
(( segid " " and resid 44 and name HA1 ))
(( segid " " and resid 73 and name HB1 ))
2.100 0.500 0.500 peak 867 spectrum 1 weight 0.61716E+00 volume 0.32159E-02 ppm1 4.289 ppm2 2.019 CV 1
ASSI { 872}
(( segid " " and resid 44 and name HA2 ))
(( segid " " and resid 73 and name HA ))
3.100 1.200 1.200 peak 872 spectrum 1 weight 0.64906E+00 volume 0.53795E-02 ppm1 3.888 ppm2 4.698 CV 1
ASSI { 884}
(( segid " " and resid 44 and name HA2 ))
(( segid " " and resid 73 and name HB1 ))
4.200 2.200 1.800 peak 884 spectrum 1 weight 0.60474E+00 volume 0.21511E-02 ppm1 3.896 ppm2 1.998 CV 1
ASSI { 888}
(( segid " " and resid 48 and name HA2 ))
(( segid " " and resid 47 and name HA ))
4.000 2.000 2.000 peak 888 spectrum 1 weight 0.62129E+00 volume 0.35316E-02 ppm1 3.507 ppm2 3.916 CV 1
ASSI { 903}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 124 and name HB2 ))
3.800 1.800 1.800 peak 903 spectrum 1 weight 0.51226E+00 volume 0.38944E-03 ppm1 2.957 ppm2 3.356 CV 1
ASSI { 905}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 57 and name HB1 ))
3.900 1.900 1.900 peak 905 spectrum 1 weight 0.62987E+00 volume 0.41456E-02 ppm1 2.955 ppm2 2.485 CV 1
OR { 905}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 57 and name HB2 ))
ASSI { 940}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 35 and name HN ))
6.000 4.700 0.000 peak 940 spectrum 1 weight 0.53123E+00 volume 0.26716E-03 ppm1 2.134 ppm2 7.182 CV 1
OR { 940}
(( segid " " and resid 31 and name HB1 ))
( segid " " and resid 35 and name HD% )
ASSI { 941}
(( segid " " and resid 83 and name HB1 ))
( segid " " and resid 84 and name HD% )
5.500 3.700 0.500 peak 941 spectrum 1 weight 0.59323E+00 volume 0.81273E-03 ppm1 2.125 ppm2 7.057 CV 1
ASSI { 958}
(( segid " " and resid 84 and name HB1 ))
( segid " " and resid 4 and name HG2%)
3.900 1.900 1.900 peak 958 spectrum 1 weight 0.58210E+00 volume 0.10361E-02 ppm1 2.466 ppm2 0.241 CV 1
OR { 958}
(( segid " " and resid 84 and name HB1 ))
( segid " " and resid 149 and name HD2%)
ASSI { 974}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 73 and name HA ))
5.400 3.600 0.600 peak 974 spectrum 1 weight 0.59271E+00 volume 0.72957E-03 ppm1 3.588 ppm2 4.704 CV 1
ASSI { 991}
(( segid " " and resid 89 and name HB1 ))
(( segid " " and resid 90 and name HN ))
3.400 1.500 1.500 peak 991 spectrum 1 weight 0.61098E+00 volume 0.27123E-02 ppm1 3.608 ppm2 9.886 CV 1
ASSI { 996}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 42 and name HN ))
3.000 1.200 1.200 peak 996 spectrum 1 weight 0.58352E+00 volume 0.25569E-02 ppm1 3.577 ppm2 8.935 CV 1
ASSI { 1032}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 90 and name HN ))
4.000 2.000 2.000 peak 1032 spectrum 1 weight 0.60565E+00 volume 0.22370E-02 ppm1 2.446 ppm2 9.888 CV 1
ASSI { 1101}
(( segid " " and resid 100 and name HB1 ))
( segid " " and resid 103 and name HG2%)
3.300 1.300 1.300 peak 1101 spectrum 1 weight 0.65224E+00 volume 0.10734E-01 ppm1 2.853 ppm2 0.941 CV 1
ASSI { 1114}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 74 and name HA ))
5.000 3.200 1.000 peak 1114 spectrum 1 weight 0.41542E+00 volume 0.85069E-03 ppm1 2.718 ppm2 3.690 CV 1
OR { 1114}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 74 and name HA ))
ASSI { 1147}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 3 and name HA ))
4.900 3.100 1.100 peak 1147 spectrum 1 weight 0.57362E+00 volume 0.93476E-03 ppm1 3.195 ppm2 5.445 CV 1
ASSI { 1152}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 101 and name HN ))
2.400 0.700 0.700 peak 1152 spectrum 1 weight 0.64054E+00 volume 0.81187E-02 ppm1 3.068 ppm2 9.472 CV 1
ASSI { 1265}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 3 and name HA ))
3.500 1.600 1.600 peak 1265 spectrum 1 weight 0.52230E+00 volume 0.27845E-02 ppm1 2.855 ppm2 5.411 CV 1
ASSI { 1300}
(( segid " " and resid 100 and name HB1 ))
(( segid " " and resid 101 and name HN ))
6.000 4.900 0.000 peak 1300 spectrum 1 weight 0.33535E+00 volume 0.26927E-03 ppm1 2.847 ppm2 9.484 CV 1
ASSI { 1302}
(( segid " " and resid 58 and name HE1 ))
(( segid " " and resid 139 and name HB1 ))
4.200 2.200 1.800 peak 1302 spectrum 1 weight 0.53579E+00 volume 0.24182E-02 ppm1 2.683 ppm2 3.380 CV 1
ASSI { 1326}
(( segid " " and resid 58 and name HE2 ))
( segid " " and resid 62 and name HD2%)
5.600 4.000 0.400 peak 1326 spectrum 1 weight 0.49813E+00 volume 0.27088E-03 ppm1 2.378 ppm2 0.296 CV 1
ASSI { 1352}
(( segid " " and resid 132 and name HB2 ))
(( segid " " and resid 133 and name HN ))
3.800 1.800 1.800 peak 1352 spectrum 1 weight 0.33914E+00 volume 0.30921E-02 ppm1 2.913 ppm2 7.666 CV 1
OR { 1352}
(( segid " " and resid 132 and name HB2 ))
(( segid " " and resid 130 and name HD21))
ASSI { 1357}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 48 and name HN ))
6.000 4.700 0.000 peak 1357 spectrum 1 weight 0.51250E+00 volume 0.25492E-03 ppm1 2.528 ppm2 8.508 CV 1
OR { 1357}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 48 and name HN ))
ASSI { 1359}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 12 and name HA ))
4.900 3.000 1.100 peak 1359 spectrum 1 weight 0.59284E+00 volume 0.75165E-03 ppm1 2.208 ppm2 4.708 CV 1
ASSI { 1371}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 90 and name HA ))
3.400 1.500 1.500 peak 1371 spectrum 1 weight 0.58095E+00 volume 0.34338E-02 ppm1 3.307 ppm2 4.650 CV 1
OR { 1371}
(( segid " " and resid 93 and name HB1 ))
(( segid " " and resid 90 and name HA ))
OR { 1371}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 92 and name HA ))
ASSI { 1392}
(( segid " " and resid 99 and name HB2 ))
(( segid " " and resid 100 and name HN ))
3.100 1.200 1.200 peak 1392 spectrum 1 weight 0.61698E+00 volume 0.69134E-02 ppm1 2.415 ppm2 7.275 CV 1
ASSI { 1400}
(( segid " " and resid 99 and name HB1 ))
(( segid " " and resid 100 and name HN ))
3.900 1.900 1.900 peak 1400 spectrum 1 weight 0.60606E+00 volume 0.22750E-02 ppm1 2.039 ppm2 7.272 CV 1
ASSI { 1404}
(( segid " " and resid 137 and name HB ))
(( segid " " and resid 138 and name HN ))
2.800 1.000 1.000 peak 1404 spectrum 1 weight 0.56050E+00 volume 0.20849E-02 ppm1 1.342 ppm2 8.165 CV 1
ASSI { 1449}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 37 and name HA ))
4.700 2.800 1.300 peak 1449 spectrum 1 weight 0.48596E+00 volume 0.25943E-03 ppm1 1.756 ppm2 4.741 CV 1
ASSI { 1470}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 59 and name HB1 ))
3.900 1.900 1.900 peak 1470 spectrum 1 weight 0.45087E+00 volume 0.15766E-02 ppm1 1.569 ppm2 1.112 CV 1
OR { 1470}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 1477}
(( segid " " and resid 21 and name HB ))
(( segid " " and resid 18 and name HA ))
6.000 4.400 0.000 peak 1477 spectrum 1 weight 0.56674E+00 volume 0.37322E-03 ppm1 1.730 ppm2 3.302 CV 1
ASSI { 1496}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 89 and name HB2 ))
4.800 2.900 1.200 peak 1496 spectrum 1 weight 0.41985E+00 volume 0.25090E-02 ppm1 2.759 ppm2 2.440 CV 1
ASSI { 1534}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 56 and name HA ))
4.600 2.600 1.400 peak 1534 spectrum 1 weight 0.60124E+00 volume 0.18021E-02 ppm1 2.708 ppm2 3.306 CV 1
OR { 1534}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 56 and name HA ))
ASSI { 1631}
(( segid " " and resid 45 and name HG2 ))
(( segid " " and resid 46 and name HA ))
5.200 3.400 0.800 peak 1631 spectrum 1 weight 0.52425E+00 volume 0.16236E-02 ppm1 1.918 ppm2 4.725 CV 1
OR { 1631}
(( segid " " and resid 45 and name HG2 ))
(( segid " " and resid 73 and name HA ))
ASSI { 1632}
(( segid " " and resid 32 and name HG1 ))
(( segid " " and resid 33 and name HN ))
6.000 5.900 0.000 peak 1632 spectrum 1 weight 0.29639E+00 volume 0.13355E-03 ppm1 2.317 ppm2 8.496 CV 1
ASSI { 1660}
(( segid " " and resid 121 and name HG1 ))
(( segid " " and resid 90 and name HA ))
4.700 2.800 1.300 peak 1660 spectrum 1 weight 0.32038E+00 volume 0.66709E-04 ppm1 2.197 ppm2 4.712 CV 1
OR { 1660}
(( segid " " and resid 121 and name HG1 ))
(( segid " " and resid 92 and name HA ))
ASSI { 1663}
(( segid " " and resid 121 and name HG1 ))
(( segid " " and resid 89 and name HA ))
4.400 2.400 1.600 peak 1663 spectrum 1 weight 0.55062E+00 volume 0.85258E-03 ppm1 2.166 ppm2 5.120 CV 1
ASSI { 1668}
(( segid " " and resid 121 and name HG1 ))
(( segid " " and resid 90 and name HN ))
3.200 1.300 1.300 peak 1668 spectrum 1 weight 0.59833E+00 volume 0.14835E-02 ppm1 2.165 ppm2 9.903 CV 1
ASSI { 1671}
(( segid " " and resid 121 and name HG2 ))
(( segid " " and resid 92 and name HB1 ))
4.500 2.600 1.500 peak 1671 spectrum 1 weight 0.59200E+00 volume 0.13901E-02 ppm1 2.028 ppm2 2.585 CV 1
ASSI { 1678}
(( segid " " and resid 34 and name HG1 ))
(( segid " " and resid 35 and name HN ))
4.600 2.600 1.400 peak 1678 spectrum 1 weight 0.61360E+00 volume 0.29310E-02 ppm1 1.963 ppm2 7.226 CV 1
OR { 1678}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 35 and name HN ))
ASSI { 1681}
(( segid " " and resid 34 and name HG1 ))
(( segid " " and resid 31 and name HA ))
5.200 3.400 0.800 peak 1681 spectrum 1 weight 0.59340E+00 volume 0.84002E-03 ppm1 1.946 ppm2 4.859 CV 1
ASSI { 1690}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 31 and name HA ))
5.600 4.000 0.400 peak 1690 spectrum 1 weight 0.59044E+00 volume 0.27695E-03 ppm1 1.972 ppm2 4.886 CV 1
ASSI { 1693}
(( segid " " and resid 133 and name HG1 ))
( segid " " and resid 137 and name HD1%)
4.800 2.900 1.200 peak 1693 spectrum 1 weight 0.59307E+00 volume 0.78851E-03 ppm1 1.878 ppm2 -0.115 CV 1
ASSI { 1694}
(( segid " " and resid 133 and name HG1 ))
(( segid " " and resid 124 and name HA ))
3.100 1.200 1.200 peak 1694 spectrum 1 weight 0.62387E+00 volume 0.60035E-02 ppm1 1.873 ppm2 4.713 CV 1
ASSI { 1715}
(( segid " " and resid 73 and name HB1 ))
(( segid " " and resid 44 and name HA2 ))
4.200 2.200 1.800 peak 1715 spectrum 1 weight 0.54620E+00 volume 0.22109E-02 ppm1 2.022 ppm2 3.912 CV 1
ASSI { 1747}
(( segid " " and resid 121 and name HB2 ))
(( segid " " and resid 90 and name HN ))
6.000 5.800 0.000 peak 1747 spectrum 1 weight 0.48794E+00 volume 0.13213E-03 ppm1 1.828 ppm2 9.864 CV 1
ASSI { 1748}
(( segid " " and resid 121 and name HB2 ))
(( segid " " and resid 89 and name HA ))
4.000 2.000 2.000 peak 1748 spectrum 1 weight 0.62998E+00 volume 0.57399E-02 ppm1 1.828 ppm2 5.129 CV 1
ASSI { 1749}
(( segid " " and resid 121 and name HB2 ))
(( segid " " and resid 89 and name HB1 ))
3.900 1.900 1.900 peak 1749 spectrum 1 weight 0.62837E+00 volume 0.40420E-02 ppm1 1.826 ppm2 3.616 CV 1
ASSI { 1757}
(( segid " " and resid 121 and name HB1 ))
(( segid " " and resid 90 and name HN ))
5.100 3.200 0.900 peak 1757 spectrum 1 weight 0.59462E+00 volume 0.10167E-02 ppm1 2.230 ppm2 9.872 CV 1
ASSI { 1758}
(( segid " " and resid 121 and name HB1 ))
(( segid " " and resid 89 and name HB1 ))
3.400 1.500 1.500 peak 1758 spectrum 1 weight 0.62142E+00 volume 0.35407E-02 ppm1 2.228 ppm2 3.624 CV 1
ASSI { 1759}
(( segid " " and resid 121 and name HB1 ))
(( segid " " and resid 89 and name HA ))
4.000 2.000 2.000 peak 1759 spectrum 1 weight 0.62149E+00 volume 0.35459E-02 ppm1 2.225 ppm2 5.118 CV 1
ASSI { 1783}
(( segid " " and resid 61 and name HG1 ))
(( segid " " and resid 62 and name HN ))
3.800 1.800 1.800 peak 1783 spectrum 1 weight 0.62074E+00 volume 0.71123E-02 ppm1 2.483 ppm2 6.992 CV 1
ASSI { 1785}
(( segid " " and resid 14 and name HB1 ))
( segid " " and resid 138 and name HD2%)
2.900 1.100 1.100 peak 1785 spectrum 1 weight 0.81839E+00 volume 0.17754E-01 ppm1 2.412 ppm2 0.665 CV 1
ASSI { 1792}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 68 and name HN ))
3.900 1.900 1.900 peak 1792 spectrum 1 weight 0.60403E+00 volume 0.20823E-02 ppm1 1.645 ppm2 8.585 CV 1
OR { 1792}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 68 and name HN ))
ASSI { 1816}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 21 and name HD1%)
4.800 2.900 1.200 peak 1816 spectrum 1 weight 0.51413E+00 volume 0.20461E-02 ppm1 2.474 ppm2 0.512 CV 1
OR { 1816}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 146 and name HD2%)
ASSI { 1819}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 23 and name HN ))
4.200 2.200 1.800 peak 1819 spectrum 1 weight 0.59432E+00 volume 0.97547E-03 ppm1 2.453 ppm2 8.598 CV 1
OR { 1819}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 21 and name HN ))
ASSI { 1822}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 63 and name HB1 ))
3.900 1.900 1.900 peak 1822 spectrum 1 weight 0.63874E+00 volume 0.47358E-02 ppm1 2.416 ppm2 3.060 CV 1
OR { 1822}
(( segid " " and resid 17 and name HG1 ))
(( segid " " and resid 63 and name HB1 ))
ASSI { 1835}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 29 and name HN ))
4.400 2.400 1.600 peak 1835 spectrum 1 weight 0.59850E+00 volume 0.15027E-02 ppm1 1.810 ppm2 7.432 CV 1
ASSI { 1839}
(( segid " " and resid 17 and name HG1 ))
(( segid " " and resid 138 and name HN ))
5.100 3.300 0.900 peak 1839 spectrum 1 weight 0.45783E+00 volume 0.11863E-02 ppm1 2.388 ppm2 8.199 CV 1
OR { 1839}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 138 and name HN ))
ASSI { 1846}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 30 and name HN ))
4.200 2.200 1.800 peak 1846 spectrum 1 weight 0.55505E+00 volume 0.60072E-02 ppm1 1.804 ppm2 8.132 CV 1
ASSI { 1857}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 16 and name HG2 ))
5.200 3.300 0.800 peak 1857 spectrum 1 weight 0.38060E+00 volume 0.24735E-03 ppm1 2.127 ppm2 1.144 CV 1
OR { 1857}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 16 and name HG2 ))
ASSI { 1869}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 28 and name HN ))
3.200 1.300 1.300 peak 1869 spectrum 1 weight 0.50343E+00 volume 0.37412E-02 ppm1 2.123 ppm2 8.271 CV 1
ASSI { 1878}
(( segid " " and resid 123 and name HB2 ))
(( segid " " and resid 124 and name HA ))
3.100 1.200 1.200 peak 1878 spectrum 1 weight 0.68951E+00 volume 0.76084E-02 ppm1 1.626 ppm2 4.697 CV 1
ASSI { 1898}
(( segid " " and resid 147 and name HB ))
(( segid " " and resid 144 and name HA ))
2.900 1.000 1.000 peak 1898 spectrum 1 weight 0.60377E+00 volume 0.61894E-02 ppm1 2.268 ppm2 4.636 CV 1
ASSI { 1922}
(( segid " " and resid 96 and name HB ))
(( segid " " and resid 97 and name HN ))
3.100 1.200 1.200 peak 1922 spectrum 1 weight 0.63945E+00 volume 0.47820E-02 ppm1 1.967 ppm2 7.262 CV 1
ASSI { 1946}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 35 and name HN ))
3.900 1.900 1.900 peak 1946 spectrum 1 weight 0.61360E+00 volume 0.29312E-02 ppm1 1.709 ppm2 7.239 CV 1
ASSI { 1948}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HN ))
4.700 2.700 1.300 peak 1948 spectrum 1 weight 0.59561E+00 volume 0.11499E-02 ppm1 1.642 ppm2 7.202 CV 1
ASSI { 1992}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 66 and name HN ))
3.500 1.600 1.600 peak 1992 spectrum 1 weight 0.61524E+00 volume 0.30637E-02 ppm1 1.997 ppm2 8.154 CV 1
OR { 1992}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 66 and name HN ))
ASSI { 2026}
(( segid " " and resid 126 and name HB1 ))
(( segid " " and resid 124 and name HA ))
3.900 1.900 1.900 peak 2026 spectrum 1 weight 0.63038E+00 volume 0.54059E-02 ppm1 2.767 ppm2 4.696 CV 1
ASSI { 2046}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 33 and name HN ))
3.400 1.400 1.400 peak 2046 spectrum 1 weight 0.60875E+00 volume 0.25190E-02 ppm1 2.106 ppm2 8.466 CV 1
OR { 2046}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 33 and name HN ))
ASSI { 2104}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 12 and name HA ))
4.200 2.200 1.800 peak 2104 spectrum 1 weight 0.39413E+00 volume 0.32347E-02 ppm1 1.174 ppm2 4.739 CV 1
ASSI { 2139}
(( segid " " and resid 3 and name HD2 ))
(( segid " " and resid 5 and name HN ))
6.000 6.000 0.000 peak 2139 spectrum 1 weight 0.45065E+00 volume 0.67347E-04 ppm1 1.742 ppm2 8.372 CV 1
ASSI { 2191}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 62 and name HN ))
3.600 1.600 1.600 peak 2191 spectrum 1 weight 0.55583E+00 volume 0.14615E-02 ppm1 2.080 ppm2 7.035 CV 1
ASSI { 2192}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 62 and name HD1%)
4.200 2.200 1.800 peak 2192 spectrum 1 weight 0.57746E+00 volume 0.34586E-02 ppm1 2.082 ppm2 0.530 CV 1
ASSI { 2206}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 138 and name HD2%)
3.800 1.800 1.800 peak 2206 spectrum 1 weight 0.62891E+00 volume 0.40796E-02 ppm1 2.126 ppm2 0.635 CV 1
ASSI { 2207}
(( segid " " and resid 14 and name HG1 ))
( segid " " and resid 138 and name HD2%)
4.000 2.000 2.000 peak 2207 spectrum 1 weight 0.64284E+00 volume 0.49964E-02 ppm1 2.031 ppm2 0.667 CV 1
ASSI { 2275}
( segid " " and resid 74 and name HD2%)
( segid " " and resid 100 and name HE% )
2.800 1.000 1.000 peak 2275 spectrum 1 weight 0.59098E+00 volume 0.54456E-02 ppm1 0.315 ppm2 7.067 CV 1
ASSI { 2276}
( segid " " and resid 74 and name HD2%)
(( segid " " and resid 75 and name HN ))
6.000 6.000 0.000 peak 2276 spectrum 1 weight 0.58998E+00 volume 0.13696E-03 ppm1 0.316 ppm2 6.315 CV 1
ASSI { 2311}
( segid " " and resid 117 and name HD2%)
(( segid " " and resid 137 and name HG11))
3.200 1.300 1.300 peak 2311 spectrum 1 weight 0.44342E+00 volume 0.49515E-02 ppm1 1.013 ppm2 0.306 CV 1
ASSI { 2344}
(( segid " " and resid 58 and name HD2 ))
( segid " " and resid 62 and name HD2%)
4.600 2.600 1.400 peak 2344 spectrum 1 weight 0.49807E+00 volume 0.94668E-03 ppm1 1.528 ppm2 0.283 CV 1
OR { 2344}
(( segid " " and resid 58 and name HD1 ))
( segid " " and resid 62 and name HD2%)
ASSI { 2349}
(( segid " " and resid 86 and name HG11))
( segid " " and resid 4 and name HG2%)
2.900 1.100 1.100 peak 2349 spectrum 1 weight 0.59613E+00 volume 0.10849E-01 ppm1 0.984 ppm2 0.243 CV 1
OR { 2349}
(( segid " " and resid 86 and name HG11))
( segid " " and resid 149 and name HD2%)
ASSI { 2425}
(( segid " " and resid 149 and name HG ))
( segid " " and resid 4 and name HD1%)
4.300 2.300 1.700 peak 2425 spectrum 1 weight 0.55614E+00 volume 0.10947E-02 ppm1 1.629 ppm2 0.633 CV 1
ASSI { 2431}
( segid " " and resid 9 and name HD2%)
(( segid " " and resid 10 and name HN ))
4.900 3.000 1.100 peak 2431 spectrum 1 weight 0.59327E+00 volume 0.81963E-03 ppm1 1.023 ppm2 8.903 CV 1
OR { 2431}
( segid " " and resid 9 and name HD2%)
(( segid " " and resid 42 and name HN ))
ASSI { 2438}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 75 and name HN ))
3.200 1.300 1.300 peak 2438 spectrum 1 weight 0.66826E+00 volume 0.94311E-02 ppm1 0.864 ppm2 6.331 CV 1
OR { 2438}
(( segid " " and resid 78 and name HG ))
(( segid " " and resid 75 and name HN ))
ASSI { 2576}
(( segid " " and resid 74 and name HG ))
(( segid " " and resid 75 and name HN ))
2.600 0.900 0.900 peak 2576 spectrum 1 weight 0.60783E+00 volume 0.64161E-02 ppm1 0.596 ppm2 6.321 CV 1
ASSI { 2581}
( segid " " and resid 62 and name HD2%)
(( segid " " and resid 63 and name HN ))
5.000 3.100 1.000 peak 2581 spectrum 1 weight 0.53123E+00 volume 0.39077E-03 ppm1 0.290 ppm2 7.931 CV 1
ASSI { 2602}
(( segid " " and resid 67 and name HG1 ))
(( segid " " and resid 66 and name HD2 ))
5.800 4.200 0.200 peak 2602 spectrum 1 weight 0.53065E+00 volume 0.66344E-04 ppm1 1.248 ppm2 6.622 CV 1
ASSI { 2629}
(( segid " " and resid 73 and name HG1 ))
(( segid " " and resid 44 and name HA2 ))
4.800 2.900 1.200 peak 2629 spectrum 1 weight 0.59995E+00 volume 0.16641E-02 ppm1 1.180 ppm2 3.877 CV 1
ASSI { 2638}
( segid " " and resid 5 and name HD2%)
(( segid " " and resid 39 and name HA ))
3.200 1.200 1.200 peak 2638 spectrum 1 weight 0.48213E+00 volume 0.48057E-02 ppm1 0.574 ppm2 5.724 CV 1
ASSI { 2640}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 78 and name HA ))
4.800 2.900 1.200 peak 2640 spectrum 1 weight 0.32660E+00 volume 0.82631E-03 ppm1 0.577 ppm2 3.957 CV 1
OR { 2640}
( segid " " and resid 5 and name HD2%)
(( segid " " and resid 78 and name HA ))
ASSI { 2649}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 81 and name HG1 ))
4.800 2.900 1.200 peak 2649 spectrum 1 weight 0.42723E+00 volume 0.51853E-03 ppm1 1.374 ppm2 2.291 CV 1
OR { 2649}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 81 and name HG2 ))
ASSI { 2658}
( segid " " and resid 55 and name HG2%)
( segid " " and resid 59 and name HD1%)
2.800 1.000 1.000 peak 2658 spectrum 1 weight 0.81604E+00 volume 0.16924E-01 ppm1 1.181 ppm2 0.503 CV 1
ASSI { 2688}
( segid " " and resid 9 and name HD1%)
(( segid " " and resid 42 and name HN ))
3.000 1.200 1.200 peak 2688 spectrum 1 weight 0.58840E+00 volume 0.52891E-02 ppm1 0.945 ppm2 8.918 CV 1
ASSI { 2695}
( segid " " and resid 138 and name HD2%)
(( segid " " and resid 14 and name HB2 ))
2.200 0.600 0.600 peak 2695 spectrum 1 weight 0.86391E+00 volume 0.23080E-01 ppm1 0.674 ppm2 1.836 CV 1
ASSI { 2696}
( segid " " and resid 138 and name HD1%)
( segid " " and resid 18 and name HB% )
3.100 1.200 1.200 peak 2696 spectrum 1 weight 0.66104E+00 volume 0.60814E-02 ppm1 0.677 ppm2 0.108 CV 1
OR { 2696}
( segid " " and resid 138 and name HD2%)
( segid " " and resid 18 and name HB% )
ASSI { 2697}
( segid " " and resid 138 and name HD1%)
(( segid " " and resid 14 and name HB2 ))
2.700 0.900 0.900 peak 2697 spectrum 1 weight 0.63139E+00 volume 0.42496E-02 ppm1 0.663 ppm2 2.393 CV 1
OR { 2697}
( segid " " and resid 97 and name HD2%)
(( segid " " and resid 104 and name HG1 ))
ASSI { 2790}
( segid " " and resid 78 and name HD2%)
(( segid " " and resid 75 and name HN ))
4.300 2.300 1.700 peak 2790 spectrum 1 weight 0.47329E+00 volume 0.14742E-02 ppm1 0.782 ppm2 6.344 CV 1
ASSI { 2813}
( segid " " and resid 103 and name HG2%)
(( segid " " and resid 100 and name HB2 ))
2.500 0.800 0.800 peak 2813 spectrum 1 weight 0.78540E+00 volume 0.14217E-01 ppm1 0.925 ppm2 3.096 CV 1
ASSI { 2822}
( segid " " and resid 40 and name HB% )
(( segid " " and resid 74 and name HN ))
2.500 0.800 0.800 peak 2822 spectrum 1 weight 0.63094E+00 volume 0.42193E-02 ppm1 1.122 ppm2 9.289 CV 1
ASSI { 2824}
( segid " " and resid 40 and name HB% )
(( segid " " and resid 75 and name HN ))
4.300 2.300 1.700 peak 2824 spectrum 1 weight 0.52612E+00 volume 0.38331E-02 ppm1 1.123 ppm2 6.337 CV 1
ASSI { 2850}
( segid " " and resid 122 and name HG1%)
(( segid " " and resid 123 and name HD1 ))
3.500 1.500 1.500 peak 2850 spectrum 1 weight 0.60082E+00 volume 0.60219E-02 ppm1 0.806 ppm2 3.207 CV 1
OR { 2850}
( segid " " and resid 122 and name HG1%)
(( segid " " and resid 123 and name HD2 ))
ASSI { 2934}
( segid " " and resid 62 and name HD1%)
(( segid " " and resid 63 and name HN ))
5.300 3.500 0.700 peak 2934 spectrum 1 weight 0.52775E+00 volume 0.12047E-02 ppm1 0.536 ppm2 7.890 CV 1
OR { 2934}
( segid " " and resid 62 and name HD1%)
(( segid " " and resid 61 and name HN ))
ASSI { 2956}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 71 and name HN ))
4.000 2.000 2.000 peak 2956 spectrum 1 weight 0.61876E+00 volume 0.70077E-02 ppm1 1.043 ppm2 8.893 CV 1
ASSI { 2971}
( segid " " and resid 117 and name HD1%)
(( segid " " and resid 140 and name HN ))
3.700 1.700 1.700 peak 2971 spectrum 1 weight 0.59240E+00 volume 0.55306E-02 ppm1 0.854 ppm2 6.410 CV 1
ASSI { 3012}
( segid " " and resid 145 and name HD1%)
( segid " " and resid 149 and name HD2%)
2.900 1.000 1.000 peak 3012 spectrum 1 weight 0.76880E+00 volume 0.13968E-01 ppm1 -0.100 ppm2 0.197 CV 1
OR { 3012}
( segid " " and resid 145 and name HD1%)
( segid " " and resid 149 and name HD1%)
ASSI { 3077}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 74 and name HA ))
5.100 3.300 0.900 peak 3077 spectrum 1 weight 0.59377E+00 volume 0.89558E-03 ppm1 1.270 ppm2 3.662 CV 1
ASSI { 3114}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 92 and name HD22))
3.800 1.800 1.800 peak 3114 spectrum 1 weight 0.58566E+00 volume 0.51211E-02 ppm1 1.181 ppm2 8.506 CV 1
ASSI { 3123}
( segid " " and resid 147 and name HG1%)
(( segid " " and resid 144 and name HA ))
3.700 1.700 1.700 peak 3123 spectrum 1 weight 0.58195E+00 volume 0.20222E-02 ppm1 0.982 ppm2 4.642 CV 1
ASSI { 3149}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 38 and name HN ))
4.000 2.000 2.000 peak 3149 spectrum 1 weight 0.63299E+00 volume 0.43575E-02 ppm1 1.124 ppm2 8.554 CV 1
ASSI { 3167}
( segid " " and resid 37 and name HG2%)
( segid " " and resid 4 and name HG2%)
6.000 5.800 0.000 peak 3167 spectrum 1 weight 0.47401E+00 volume 0.13374E-03 ppm1 1.118 ppm2 0.236 CV 1
ASSI { 3187}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 46 and name HB2 ))
3.800 1.800 1.800 peak 3187 spectrum 1 weight 0.56956E+00 volume 0.17088E-02 ppm1 0.915 ppm2 3.411 CV 1
OR { 3187}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 8 and name HB2 ))
ASSI { 3197}
( segid " " and resid 29 and name HB% )
(( segid " " and resid 30 and name HN ))
3.700 1.700 1.700 peak 3197 spectrum 1 weight 0.57857E+00 volume 0.46716E-02 ppm1 1.427 ppm2 8.101 CV 1
ASSI { 3206}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 49 and name HB2 ))
3.500 1.500 1.500 peak 3206 spectrum 1 weight 0.57421E+00 volume 0.71115E-03 ppm1 0.912 ppm2 2.306 CV 1
ASSI { 3216}
( segid " " and resid 29 and name HB% )
(( segid " " and resid 30 and name HA ))
4.100 2.100 1.900 peak 3216 spectrum 1 weight 0.52308E+00 volume 0.21744E-02 ppm1 1.418 ppm2 4.841 CV 1
ASSI { 3267}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 8 and name HN ))
4.200 2.200 1.800 peak 3267 spectrum 1 weight 0.59495E+00 volume 0.10619E-02 ppm1 0.812 ppm2 7.923 CV 1
ASSI { 3273}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 65 and name HN ))
3.200 1.300 1.300 peak 3273 spectrum 1 weight 0.63747E+00 volume 0.46538E-02 ppm1 0.853 ppm2 8.834 CV 1
ASSI { 3278}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 20 and name HB2 ))
4.800 2.900 1.200 peak 3278 spectrum 1 weight 0.53170E+00 volume 0.38307E-03 ppm1 0.855 ppm2 2.576 CV 1
ASSI { 3283}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 8 and name HA ))
4.500 2.600 1.500 peak 3283 spectrum 1 weight 0.59552E+00 volume 0.11392E-02 ppm1 0.809 ppm2 5.279 CV 1
OR { 3283}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 41 and name HA1 ))
ASSI { 3284}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 92 and name HA ))
6.000 6.000 0.000 peak 3284 spectrum 1 weight 0.47386E+00 volume 0.65888E-04 ppm1 0.804 ppm2 4.643 CV 1
OR { 3284}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 73 and name HA ))
ASSI { 3294}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 61 and name HN ))
2.700 0.900 0.900 peak 3294 spectrum 1 weight 0.73584E+00 volume 0.98113E-02 ppm1 1.441 ppm2 7.936 CV 1
ASSI { 3305}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 5 and name HN ))
3.500 1.500 1.500 peak 3305 spectrum 1 weight 0.61336E+00 volume 0.29117E-02 ppm1 0.234 ppm2 8.386 CV 1
ASSI { 3307}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 84 and name HB1 ))
3.700 1.700 1.700 peak 3307 spectrum 1 weight 0.58219E+00 volume 0.14380E-02 ppm1 0.235 ppm2 2.471 CV 1
OR { 3307}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 83 and name HB2 ))
ASSI { 3310}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 86 and name HG12))
2.900 1.000 1.000 peak 3310 spectrum 1 weight 0.63409E+00 volume 0.77979E-02 ppm1 0.236 ppm2 0.942 CV 1
ASSI { 3315}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 59 and name HB2 ))
4.300 2.300 1.700 peak 3315 spectrum 1 weight 0.54225E+00 volume 0.33406E-02 ppm1 1.423 ppm2 1.102 CV 1
OR { 3315}
( segid " " and resid 60 and name HB% )
(( segid " " and resid 59 and name HB1 ))
ASSI { 3417}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 85 and name HA ))
6.000 4.700 0.000 peak 3417 spectrum 1 weight 0.39778E+00 volume 0.13257E-03 ppm1 0.679 ppm2 5.052 CV 1
ASSI { 3432}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 86 and name HN ))
3.900 1.900 1.900 peak 3432 spectrum 1 weight 0.59792E+00 volume 0.14360E-02 ppm1 0.672 ppm2 9.112 CV 1
OR { 3432}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 87 and name HN ))
ASSI { 3465}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 18 and name HA ))
3.000 1.100 1.100 peak 3465 spectrum 1 weight 0.52685E+00 volume 0.31329E-02 ppm1 0.504 ppm2 3.317 CV 1
ASSI { 3474}
( segid " " and resid 21 and name HD1%)
( segid " " and resid 18 and name HB% )
4.400 2.400 1.600 peak 3474 spectrum 1 weight 0.53197E+00 volume 0.16024E-02 ppm1 0.499 ppm2 0.143 CV 1
ASSI { 3477}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 21 and name HA ))
6.000 4.500 0.000 peak 3477 spectrum 1 weight 0.56751E+00 volume 0.53358E-03 ppm1 0.112 ppm2 3.705 CV 1
ASSI { 3495}
( segid " " and resid 18 and name HB% )
( segid " " and resid 21 and name HD1%)
3.700 1.700 1.700 peak 3495 spectrum 1 weight 0.42439E+00 volume 0.44303E-02 ppm1 0.105 ppm2 0.434 CV 1
ASSI { 3645}
(( segid " " and resid 125 and name HA ))
(( segid " " and resid 124 and name HA ))
4.200 2.200 1.800 peak 3645 spectrum 1 weight 0.59335E+00 volume 0.83207E-03 ppm1 4.917 ppm2 4.714 CV 1
ASSI { 3648}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 88 and name HN ))
3.100 1.200 1.200 peak 3648 spectrum 1 weight 0.63121E+00 volume 0.42373E-02 ppm1 5.160 ppm2 7.542 CV 1
ASSI { 3665}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 55 and name HG2%)
3.800 1.800 1.800 peak 3665 spectrum 1 weight 0.59768E+00 volume 0.14074E-02 ppm1 5.234 ppm2 1.178 CV 1
ASSI { 3667}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 87 and name HN ))
2.100 0.500 0.500 peak 3667 spectrum 1 weight 0.80614E+00 volume 0.14978E-01 ppm1 5.325 ppm2 9.133 CV 1
ASSI { 3669}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 12 and name HA ))
5.100 3.300 0.900 peak 3669 spectrum 1 weight 0.59045E+00 volume 0.28100E-03 ppm1 5.229 ppm2 4.698 CV 1
ASSI { 3673}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 76 and name HN ))
4.700 2.700 1.300 peak 3673 spectrum 1 weight 0.59042E+00 volume 0.27269E-03 ppm1 4.823 ppm2 9.486 CV 1
ASSI { 3674}
(( segid " " and resid 75 and name HA ))
( segid " " and resid 100 and name HE% )
2.800 1.000 1.000 peak 3674 spectrum 1 weight 0.65667E+00 volume 0.88944E-02 ppm1 4.820 ppm2 7.071 CV 1
ASSI { 3688}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 10 and name HN ))
3.300 1.300 1.300 peak 3688 spectrum 1 weight 0.61377E+00 volume 0.29453E-02 ppm1 4.807 ppm2 8.923 CV 1
ASSI { 3715}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 144 and name HD21))
5.600 3.900 0.400 peak 3715 spectrum 1 weight 0.53116E+00 volume 0.24732E-03 ppm1 4.949 ppm2 6.702 CV 1
ASSI { 3724}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 115 and name HD1 ))
2.400 0.700 0.700 peak 3724 spectrum 1 weight 0.61900E+00 volume 0.70207E-02 ppm1 4.948 ppm2 3.447 CV 1
ASSI { 3733}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 110 and name HG2%)
2.600 0.900 0.900 peak 3733 spectrum 1 weight 0.76031E+00 volume 0.13268E-01 ppm1 5.019 ppm2 1.190 CV 1
ASSI { 3741}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 29 and name HN ))
5.600 4.000 0.400 peak 3741 spectrum 1 weight 0.53228E+00 volume 0.50617E-03 ppm1 4.823 ppm2 7.469 CV 1
ASSI { 3743}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 106 and name HN ))
3.300 1.400 1.400 peak 3743 spectrum 1 weight 0.62269E+00 volume 0.36352E-02 ppm1 4.837 ppm2 7.848 CV 1
ASSI { 3751}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 109 and name HN ))
2.400 0.700 0.700 peak 3751 spectrum 1 weight 0.78952E+00 volume 0.12087E-01 ppm1 4.865 ppm2 8.700 CV 1
ASSI { 3763}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 122 and name HN ))
4.000 2.000 2.000 peak 3763 spectrum 1 weight 0.60284E+00 volume 0.19655E-02 ppm1 5.121 ppm2 8.030 CV 1
ASSI { 3764}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 121 and name HA ))
3.500 1.500 1.500 peak 3764 spectrum 1 weight 0.59502E+00 volume 0.10717E-02 ppm1 5.120 ppm2 4.417 CV 1
ASSI { 3773}
(( segid " " and resid 130 and name HA ))
(( segid " " and resid 131 and name HN ))
2.400 0.700 0.700 peak 3773 spectrum 1 weight 0.70727E+00 volume 0.84867E-02 ppm1 5.107 ppm2 8.766 CV 1
ASSI { 3778}
(( segid " " and resid 130 and name HA ))
( segid " " and resid 131 and name HD% )
6.000 6.000 0.000 peak 3778 spectrum 1 weight 0.48514E+00 volume 0.66131E-04 ppm1 5.105 ppm2 7.035 CV 1
ASSI { 3782}
(( segid " " and resid 41 and name HA1 ))
(( segid " " and resid 42 and name HN ))
3.200 1.300 1.300 peak 3782 spectrum 1 weight 0.60733E+00 volume 0.23921E-02 ppm1 5.302 ppm2 8.934 CV 1
ASSI { 3798}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 3 and name HN ))
5.900 4.300 0.100 peak 3798 spectrum 1 weight 0.59038E+00 volume 0.26273E-03 ppm1 4.440 ppm2 10.085 CV 1
ASSI { 3806}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 85 and name HA ))
4.300 2.400 1.700 peak 3806 spectrum 1 weight 0.46724E+00 volume 0.39277E-03 ppm1 1.253 ppm2 5.017 CV 1
ASSI { 3814}
(( segid " " and resid 5 and name HG ))
(( segid " " and resid 4 and name HN ))
6.000 5.300 0.000 peak 3814 spectrum 1 weight 0.55502E+00 volume 0.18815E-03 ppm1 1.184 ppm2 9.380 CV 1
ASSI { 3821}
(( segid " " and resid 7 and name HB ))
(( segid " " and resid 87 and name HA ))
2.900 1.100 1.100 peak 3821 spectrum 1 weight 0.53748E+00 volume 0.27111E-02 ppm1 1.359 ppm2 5.147 CV 1
ASSI { 3826}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HB1 ))
5.000 3.100 1.000 peak 3826 spectrum 1 weight 0.55169E+00 volume 0.27024E-02 ppm1 5.277 ppm2 2.165 CV 1
ASSI { 3829}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 92 and name HD21))
3.800 1.800 1.800 peak 3829 spectrum 1 weight 0.54208E+00 volume 0.18028E-02 ppm1 5.280 ppm2 5.877 CV 1
ASSI { 3832}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 92 and name HD22))
4.400 2.400 1.600 peak 3832 spectrum 1 weight 0.53274E+00 volume 0.59226E-03 ppm1 5.283 ppm2 8.505 CV 1
ASSI { 3840}
(( segid " " and resid 8 and name HB1 ))
(( segid " " and resid 9 and name HN ))
4.700 2.800 1.300 peak 3840 spectrum 1 weight 0.49162E+00 volume 0.13531E-02 ppm1 3.189 ppm2 7.332 CV 1
ASSI { 3841}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 92 and name HD22))
4.700 2.800 1.300 peak 3841 spectrum 1 weight 0.59352E+00 volume 0.85712E-03 ppm1 4.810 ppm2 8.444 CV 1
ASSI { 3853}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 41 and name HN ))
4.400 2.400 1.600 peak 3853 spectrum 1 weight 0.55261E+00 volume 0.27807E-02 ppm1 3.181 ppm2 8.688 CV 1
ASSI { 3854}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 41 and name HN ))
3.900 1.900 1.900 peak 3854 spectrum 1 weight 0.60862E+00 volume 0.25075E-02 ppm1 2.225 ppm2 8.731 CV 1
ASSI { 3855}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 41 and name HA1 ))
5.100 3.300 0.900 peak 3855 spectrum 1 weight 0.49771E+00 volume 0.19578E-02 ppm1 3.168 ppm2 5.294 CV 1
ASSI { 3858}
(( segid " " and resid 12 and name HG12))
(( segid " " and resid 10 and name HA1 ))
3.600 1.700 1.700 peak 3858 spectrum 1 weight 0.48844E+00 volume 0.17188E-02 ppm1 0.527 ppm2 3.689 CV 1
OR { 3858}
(( segid " " and resid 12 and name HG12))
(( segid " " and resid 16 and name HD2 ))
ASSI { 3878}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 12 and name HG11))
3.400 1.400 1.400 peak 3878 spectrum 1 weight 0.54833E+00 volume 0.24074E-02 ppm1 5.236 ppm2 1.791 CV 1
ASSI { 3881}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 55 and name HA ))
5.500 3.800 0.500 peak 3881 spectrum 1 weight 0.48756E+00 volume 0.65266E-03 ppm1 5.234 ppm2 3.673 CV 1
ASSI { 3883}
(( segid " " and resid 13 and name HB1 ))
(( segid " " and resid 10 and name HA1 ))
4.000 2.000 2.000 peak 3883 spectrum 1 weight 0.59006E+00 volume 0.16385E-03 ppm1 4.171 ppm2 3.708 CV 1
ASSI { 3884}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 10 and name HA1 ))
4.000 2.000 2.000 peak 3884 spectrum 1 weight 0.59006E+00 volume 0.16585E-03 ppm1 2.685 ppm2 3.701 CV 1
ASSI { 3885}
(( segid " " and resid 13 and name HB1 ))
(( segid " " and resid 12 and name HA ))
4.300 2.300 1.700 peak 3885 spectrum 1 weight 0.53981E+00 volume 0.15571E-02 ppm1 4.174 ppm2 4.681 CV 1
ASSI { 3886}
(( segid " " and resid 13 and name HB1 ))
(( segid " " and resid 14 and name HN ))
4.500 2.500 1.500 peak 3886 spectrum 1 weight 0.59037E+00 volume 0.25923E-03 ppm1 4.167 ppm2 10.330 CV 1
ASSI { 3887}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 14 and name HN ))
4.800 2.900 1.200 peak 3887 spectrum 1 weight 0.59012E+00 volume 0.18292E-03 ppm1 2.679 ppm2 10.337 CV 1
ASSI { 3897}
(( segid " " and resid 16 and name HB1 ))
(( segid " " and resid 12 and name HA ))
4.900 3.000 1.100 peak 3897 spectrum 1 weight 0.51773E+00 volume 0.11518E-02 ppm1 0.967 ppm2 4.742 CV 1
OR { 3897}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 12 and name HA ))
ASSI { 3898}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 17 and name HN ))
4.900 3.100 1.100 peak 3898 spectrum 1 weight 0.50595E+00 volume 0.36447E-03 ppm1 0.962 ppm2 6.571 CV 1
OR { 3898}
(( segid " " and resid 16 and name HB1 ))
(( segid " " and resid 17 and name HN ))
ASSI { 3939}
(( segid " " and resid 20 and name HB1 ))
( segid " " and resid 21 and name HD1%)
3.900 1.900 1.900 peak 3939 spectrum 1 weight 0.47686E+00 volume 0.23948E-02 ppm1 3.308 ppm2 0.487 CV 1
OR { 3939}
(( segid " " and resid 20 and name HB1 ))
( segid " " and resid 59 and name HD1%)
ASSI { 3954}
(( segid " " and resid 22 and name HB1 ))
( segid " " and resid 6 and name HE% )
3.300 1.300 1.300 peak 3954 spectrum 1 weight 0.56006E+00 volume 0.33757E-02 ppm1 2.198 ppm2 6.918 CV 1
ASSI { 3979}
(( segid " " and resid 41 and name HA1 ))
(( segid " " and resid 73 and name HA ))
4.400 2.500 1.600 peak 3979 spectrum 1 weight 0.59209E+00 volume 0.62537E-03 ppm1 5.307 ppm2 4.704 CV 1
ASSI { 3986}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 74 and name HN ))
4.700 2.800 1.300 peak 3986 spectrum 1 weight 0.59186E+00 volume 0.58259E-03 ppm1 4.344 ppm2 9.304 CV 1
ASSI { 3990}
(( segid " " and resid 44 and name HA2 ))
(( segid " " and resid 73 and name HG1 ))
4.700 2.800 1.300 peak 3990 spectrum 1 weight 0.54324E+00 volume 0.19224E-02 ppm1 3.902 ppm2 1.221 CV 1
ASSI { 3991}
(( segid " " and resid 44 and name HA2 ))
(( segid " " and resid 46 and name HN ))
3.700 1.700 1.700 peak 3991 spectrum 1 weight 0.53836E+00 volume 0.13895E-02 ppm1 3.896 ppm2 8.007 CV 1
ASSI { 3992}
(( segid " " and resid 44 and name HA2 ))
(( segid " " and resid 45 and name HN ))
3.000 1.100 1.100 peak 3992 spectrum 1 weight 0.55265E+00 volume 0.27840E-02 ppm1 3.898 ppm2 8.194 CV 1
ASSI { 3993}
(( segid " " and resid 44 and name HA2 ))
(( segid " " and resid 43 and name HA ))
4.600 2.600 1.400 peak 3993 spectrum 1 weight 0.59846E+00 volume 0.14982E-02 ppm1 3.895 ppm2 4.487 CV 1
ASSI { 4002}
(( segid " " and resid 51 and name HB1 ))
( segid " " and resid 69 and name HE% )
5.100 3.200 0.900 peak 4002 spectrum 1 weight 0.59081E+00 volume 0.36804E-03 ppm1 1.873 ppm2 7.278 CV 1
ASSI { 4004}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 52 and name HN ))
5.500 3.800 0.500 peak 4004 spectrum 1 weight 0.59242E+00 volume 0.68229E-03 ppm1 1.751 ppm2 8.647 CV 1
ASSI { 4005}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 52 and name HN ))
5.400 3.600 0.600 peak 4005 spectrum 1 weight 0.53486E+00 volume 0.93396E-03 ppm1 1.887 ppm2 8.632 CV 1
ASSI { 4011}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 124 and name HA ))
5.800 4.200 0.200 peak 4011 spectrum 1 weight 0.53156E+00 volume 0.35101E-03 ppm1 2.958 ppm2 4.706 CV 1
OR { 4011}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 12 and name HA ))
ASSI { 4012}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 12 and name HA ))
5.200 3.400 0.800 peak 4012 spectrum 1 weight 0.42626E+00 volume 0.32480E-03 ppm1 2.801 ppm2 4.735 CV 1
OR { 4012}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 124 and name HA ))
ASSI { 4015}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 55 and name HN ))
6.000 5.200 0.000 peak 4015 spectrum 1 weight 0.37352E+00 volume 0.22299E-03 ppm1 2.803 ppm2 6.628 CV 1
ASSI { 4017}
(( segid " " and resid 54 and name HA2 ))
(( segid " " and resid 55 and name HN ))
4.000 2.000 2.000 peak 4017 spectrum 1 weight 0.53203E+00 volume 0.17509E-02 ppm1 1.543 ppm2 6.677 CV 1
OR { 4017}
(( segid " " and resid 54 and name HA2 ))
(( segid " " and resid 57 and name HD22))
ASSI { 4018}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 55 and name HN ))
3.000 1.100 1.100 peak 4018 spectrum 1 weight 0.47788E+00 volume 0.17440E-02 ppm1 2.955 ppm2 6.637 CV 1
ASSI { 4032}
( segid " " and resid 55 and name HG2%)
(( segid " " and resid 13 and name HA ))
3.400 1.500 1.500 peak 4032 spectrum 1 weight 0.52783E+00 volume 0.24783E-02 ppm1 1.180 ppm2 5.243 CV 1
ASSI { 4049}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 56 and name HA ))
4.500 2.500 1.500 peak 4049 spectrum 1 weight 0.58098E+00 volume 0.31333E-03 ppm1 1.108 ppm2 3.259 CV 1
OR { 4049}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 56 and name HA ))
ASSI { 4079}
(( segid " " and resid 79 and name HB1 ))
(( segid " " and resid 80 and name HN ))
3.600 1.600 1.600 peak 4079 spectrum 1 weight 0.59821E+00 volume 0.14693E-02 ppm1 3.196 ppm2 8.503 CV 1
ASSI { 4080}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 80 and name HN ))
5.900 4.300 0.100 peak 4080 spectrum 1 weight 0.57111E+00 volume 0.21686E-03 ppm1 2.425 ppm2 8.520 CV 1
ASSI { 4086}
(( segid " " and resid 79 and name HB2 ))
( segid " " and resid 74 and name HD2%)
5.800 4.200 0.200 peak 4086 spectrum 1 weight 0.53717E+00 volume 0.14857E-03 ppm1 2.430 ppm2 0.310 CV 1
ASSI { 4111}
(( segid " " and resid 85 and name HB1 ))
(( segid " " and resid 107 and name HA ))
3.000 1.100 1.100 peak 4111 spectrum 1 weight 0.57198E+00 volume 0.42335E-02 ppm1 1.729 ppm2 5.413 CV 1
ASSI { 4112}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 107 and name HA ))
3.100 1.200 1.200 peak 4112 spectrum 1 weight 0.59872E+00 volume 0.15279E-02 ppm1 1.185 ppm2 5.396 CV 1
ASSI { 4119}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 110 and name HN ))
2.500 0.800 0.800 peak 4119 spectrum 1 weight 0.55897E+00 volume 0.32924E-02 ppm1 5.015 ppm2 8.683 CV 1
ASSI { 4120}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 87 and name HN ))
6.000 4.600 0.000 peak 4120 spectrum 1 weight 0.59020E+00 volume 0.21027E-03 ppm1 5.018 ppm2 9.114 CV 1
ASSI { 4136}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 107 and name HN ))
3.800 1.800 1.800 peak 4136 spectrum 1 weight 0.55605E+00 volume 0.30630E-02 ppm1 1.617 ppm2 7.149 CV 1
ASSI { 4140}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 85 and name HG ))
4.700 2.800 1.300 peak 4140 spectrum 1 weight 0.53985E+00 volume 0.15620E-02 ppm1 5.413 ppm2 1.445 CV 1
ASSI { 4142}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 85 and name HB2 ))
2.700 0.900 0.900 peak 4142 spectrum 1 weight 0.56118E+00 volume 0.34613E-02 ppm1 5.417 ppm2 1.183 CV 1
ASSI { 4144}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 107 and name HA ))
5.300 3.500 0.700 peak 4144 spectrum 1 weight 0.59115E+00 volume 0.44305E-03 ppm1 4.871 ppm2 5.454 CV 1
ASSI { 4158}
(( segid " " and resid 114 and name HB1 ))
(( segid " " and resid 115 and name HA ))
4.500 2.600 1.500 peak 4158 spectrum 1 weight 0.53988E+00 volume 0.15655E-02 ppm1 3.209 ppm2 4.663 CV 1
ASSI { 4159}
(( segid " " and resid 114 and name HB1 ))
(( segid " " and resid 141 and name HN ))
4.500 2.500 1.500 peak 4159 spectrum 1 weight 0.59396E+00 volume 0.92388E-03 ppm1 3.225 ppm2 8.699 CV 1
ASSI { 4172}
(( segid " " and resid 117 and name HB1 ))
(( segid " " and resid 118 and name HB1 ))
5.200 3.300 0.800 peak 4172 spectrum 1 weight 0.56287E+00 volume 0.10924E-02 ppm1 1.796 ppm2 2.646 CV 1
OR { 4172}
(( segid " " and resid 117 and name HB1 ))
(( segid " " and resid 119 and name HB2 ))
ASSI { 4176}
(( segid " " and resid 119 and name HB1 ))
( segid " " and resid 137 and name HD1%)
4.600 2.600 1.400 peak 4176 spectrum 1 weight 0.56615E+00 volume 0.57482E-03 ppm1 3.199 ppm2 -0.109 CV 1
ASSI { 4179}
(( segid " " and resid 115 and name HD1 ))
(( segid " " and resid 114 and name HN ))
6.000 5.700 0.000 peak 4179 spectrum 1 weight 0.59000E+00 volume 0.14452E-03 ppm1 3.456 ppm2 7.611 CV 1
ASSI { 4180}
(( segid " " and resid 115 and name HD2 ))
(( segid " " and resid 144 and name HD21))
6.000 4.600 0.000 peak 4180 spectrum 1 weight 0.59050E+00 volume 0.29382E-03 ppm1 3.231 ppm2 6.667 CV 1
ASSI { 4189}
(( segid " " and resid 125 and name HA ))
(( segid " " and resid 129 and name HN ))
2.400 0.700 0.700 peak 4189 spectrum 1 weight 0.60790E+00 volume 0.24438E-02 ppm1 4.910 ppm2 8.340 CV 1
ASSI { 4221}
(( segid " " and resid 130 and name HA ))
(( segid " " and resid 124 and name HA ))
5.500 3.800 0.500 peak 4221 spectrum 1 weight 0.55715E+00 volume 0.40754E-03 ppm1 5.107 ppm2 4.741 CV 1
ASSI { 4222}
(( segid " " and resid 130 and name HA ))
(( segid " " and resid 132 and name HN ))
4.800 2.800 1.200 peak 4222 spectrum 1 weight 0.55134E+00 volume 0.26724E-02 ppm1 5.106 ppm2 8.294 CV 1
ASSI { 4223}
(( segid " " and resid 131 and name HA ))
(( segid " " and resid 132 and name HN ))
4.500 2.600 1.500 peak 4223 spectrum 1 weight 0.53177E+00 volume 0.39916E-03 ppm1 4.330 ppm2 8.290 CV 1
ASSI { 4229}
(( segid " " and resid 133 and name HG2 ))
( segid " " and resid 137 and name HD1%)
4.800 2.800 1.200 peak 4229 spectrum 1 weight 0.55060E+00 volume 0.52764E-03 ppm1 2.076 ppm2 -0.125 CV 1
ASSI { 4243}
( segid " " and resid 137 and name HD1%)
( segid " " and resid 119 and name HD% )
4.700 2.800 1.300 peak 4243 spectrum 1 weight 0.59070E+00 volume 0.34267E-03 ppm1 -0.110 ppm2 7.118 CV 1
ASSI { 4299}
(( segid " " and resid 146 and name HB2 ))
(( segid " " and resid 147 and name HN ))
6.000 4.600 0.000 peak 4299 spectrum 1 weight 0.58997E+00 volume 0.13314E-03 ppm1 1.265 ppm2 7.448 CV 1
ASSI { 4300}
(( segid " " and resid 146 and name HB1 ))
(( segid " " and resid 147 and name HN ))
3.500 1.500 1.500 peak 4300 spectrum 1 weight 0.59422E+00 volume 0.96058E-03 ppm1 2.027 ppm2 7.474 CV 1
ASSI { 4322}
(( segid " " and resid 55 and name HB ))
(( segid " " and resid 13 and name HA ))
4.600 2.700 1.400 peak 4322 spectrum 1 weight 0.53111E+00 volume 0.23263E-03 ppm1 4.210 ppm2 5.246 CV 1
ASSI { 4324}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 8 and name HN ))
4.000 2.000 2.000 peak 4324 spectrum 1 weight 0.59087E+00 volume 0.38266E-03 ppm1 3.565 ppm2 7.895 CV 1
ASSI { 4325}
(( segid " " and resid 41 and name HA1 ))
(( segid " " and resid 8 and name HN ))
5.100 3.300 0.900 peak 4325 spectrum 1 weight 0.59469E+00 volume 0.10269E-02 ppm1 5.304 ppm2 7.894 CV 1
ASSI { 4335}
(( segid " " and resid 113 and name HB1 ))
(( segid " " and resid 145 and name HN ))
4.900 3.000 1.100 peak 4335 spectrum 1 weight 0.53245E+00 volume 0.53889E-03 ppm1 3.591 ppm2 9.145 CV 1
ASSI { 4336}
(( segid " " and resid 113 and name HB2 ))
(( segid " " and resid 145 and name HN ))
4.300 2.400 1.700 peak 4336 spectrum 1 weight 0.54092E+00 volume 0.16792E-02 ppm1 3.070 ppm2 9.164 CV 1
ASSI { 4340}
(( segid " " and resid 148 and name HB1 ))
( segid " " and resid 145 and name HD1%)
3.600 1.600 1.600 peak 4340 spectrum 1 weight 0.50503E+00 volume 0.31453E-03 ppm1 3.471 ppm2 -0.113 CV 1
ASSI { 4344}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 30 and name HN ))
5.400 3.700 0.600 peak 4344 spectrum 1 weight 0.53225E+00 volume 0.49960E-03 ppm1 2.110 ppm2 8.059 CV 1
OR { 4344}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 30 and name HN ))
ASSI { 4345}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 29 and name HN ))
6.000 6.000 0.000 peak 4345 spectrum 1 weight 0.58996E+00 volume 0.12886E-03 ppm1 2.113 ppm2 7.490 CV 1
ASSI { 4346}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 29 and name HN ))
4.000 2.000 2.000 peak 4346 spectrum 1 weight 0.53515E+00 volume 0.97467E-03 ppm1 1.639 ppm2 7.449 CV 1
ASSI { 4347}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 34 and name HN ))
4.800 2.900 1.200 peak 4347 spectrum 1 weight 0.59114E+00 volume 0.44218E-03 ppm1 3.979 ppm2 7.829 CV 1
ASSI { 4348}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 35 and name HN ))
6.000 5.500 0.000 peak 4348 spectrum 1 weight 0.59030E+00 volume 0.24044E-03 ppm1 2.120 ppm2 7.224 CV 1
OR { 4348}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 35 and name HN ))
ASSI { 4349}
(( segid " " and resid 73 and name HG2 ))
(( segid " " and resid 44 and name HA2 ))
5.600 3.900 0.400 peak 4349 spectrum 1 weight 0.60138E+00 volume 0.18161E-02 ppm1 1.758 ppm2 3.905 CV 1
ASSI { 4350}
(( segid " " and resid 45 and name HB1 ))
(( segid " " and resid 47 and name HN ))
6.000 6.000 0.000 peak 4350 spectrum 1 weight 0.53160E+00 volume 0.35956E-03 ppm1 1.657 ppm2 6.962 CV 1
ASSI { 4351}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 47 and name HN ))
6.000 5.100 0.000 peak 4351 spectrum 1 weight 0.59045E+00 volume 0.27924E-03 ppm1 1.538 ppm2 6.954 CV 1
ASSI { 4353}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 47 and name HN ))
5.900 4.400 0.100 peak 4353 spectrum 1 weight 0.59107E+00 volume 0.42795E-03 ppm1 4.273 ppm2 6.950 CV 1
ASSI { 4354}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 46 and name HN ))
4.900 3.000 1.100 peak 4354 spectrum 1 weight 0.49592E+00 volume 0.17352E-02 ppm1 2.551 ppm2 8.085 CV 1
ASSI { 4355}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 46 and name HN ))
5.800 4.300 0.200 peak 4355 spectrum 1 weight 0.53147E+00 volume 0.32976E-03 ppm1 2.514 ppm2 8.084 CV 1
ASSI { 4357}
(( segid " " and resid 67 and name HD1 ))
(( segid " " and resid 66 and name HN ))
3.300 1.400 1.400 peak 4357 spectrum 1 weight 0.54261E+00 volume 0.52725E-02 ppm1 1.639 ppm2 8.153 CV 1
ASSI { 4358}
(( segid " " and resid 67 and name HD2 ))
(( segid " " and resid 66 and name HN ))
3.200 1.200 1.200 peak 4358 spectrum 1 weight 0.51069E+00 volume 0.30755E-02 ppm1 1.572 ppm2 8.158 CV 1
ASSI { 4360}
(( segid " " and resid 124 and name HB2 ))
(( segid " " and resid 52 and name HD2 ))
4.700 2.800 1.300 peak 4360 spectrum 1 weight 0.59093E+00 volume 0.39543E-03 ppm1 3.399 ppm2 7.106 CV 1
ASSI { 4361}
(( segid " " and resid 129 and name HA1 ))
(( segid " " and resid 130 and name HN ))
5.200 3.400 0.800 peak 4361 spectrum 1 weight 0.59057E+00 volume 0.31250E-03 ppm1 4.126 ppm2 7.715 CV 1
ASSI { 4362}
(( segid " " and resid 129 and name HA2 ))
(( segid " " and resid 130 and name HN ))
5.700 4.000 0.300 peak 4362 spectrum 1 weight 0.59055E+00 volume 0.30662E-03 ppm1 3.775 ppm2 7.739 CV 1
ASSI { 4363}
(( segid " " and resid 129 and name HA1 ))
(( segid " " and resid 128 and name HA ))
3.600 1.600 1.600 peak 4363 spectrum 1 weight 0.52165E+00 volume 0.38985E-02 ppm1 4.121 ppm2 4.315 CV 1
ASSI { 38}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HA ))
2.200 0.600 0.600 peak 38 spectrum 1 weight 0.10000E+01 volume 0.22842E-01 ppm1 8.781 ppm2 4.976 CV 1
ASSI { 54}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HA ))
2.500 0.800 0.800 peak 54 spectrum 1 weight 0.99900E+00 volume 0.54719E-02 ppm1 9.749 ppm2 4.488 CV 1
ASSI { 61}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 124 and name HA ))
5.500 3.800 0.500 peak 61 spectrum 1 weight 0.69386E+00 volume 0.10313E-02 ppm1 8.048 ppm2 4.700 CV 1
ASSI { 64}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 54 and name HN ))
3.700 1.700 1.700 peak 64 spectrum 1 weight 0.76328E+00 volume 0.24013E-02 ppm1 8.048 ppm2 -0.725 CV 1
ASSI { 75}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HA ))
2.300 0.700 0.700 peak 75 spectrum 1 weight 0.10000E+01 volume 0.22035E-01 ppm1 8.047 ppm2 4.247 CV 1
ASSI { 78}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 54 and name HA2 ))
5.500 3.800 0.500 peak 78 spectrum 1 weight 0.61161E+00 volume 0.89187E-03 ppm1 8.045 ppm2 1.521 CV 1
ASSI { 88}
(( segid " " and resid 108 and name HN ))
(( segid " " and resid 109 and name HN ))
4.300 2.300 1.700 peak 88 spectrum 1 weight 0.77537E+00 volume 0.25976E-02 ppm1 9.130 ppm2 8.688 CV 1
OR { 88}
(( segid " " and resid 108 and name HN ))
(( segid " " and resid 85 and name HN ))
ASSI { 89}
(( segid " " and resid 108 and name HN ))
(( segid " " and resid 107 and name HN ))
5.000 3.200 1.000 peak 89 spectrum 1 weight 0.69767E+00 volume 0.11256E-02 ppm1 9.134 ppm2 7.137 CV 1
ASSI { 90}
(( segid " " and resid 108 and name HN ))
(( segid " " and resid 107 and name HA ))
2.000 0.500 0.500 peak 90 spectrum 1 weight 0.92308E+00 volume 0.29806E-01 ppm1 9.131 ppm2 5.416 CV 1
ASSI { 92}
(( segid " " and resid 108 and name HN ))
( segid " " and resid 107 and name HG1%)
2.600 0.900 0.900 peak 92 spectrum 1 weight 0.86391E+00 volume 0.20352E-01 ppm1 9.130 ppm2 0.890 CV 1
OR { 92}
(( segid " " and resid 108 and name HN ))
( segid " " and resid 107 and name HG2%)
ASSI { 95}
(( segid " " and resid 108 and name HN ))
( segid " " and resid 86 and name HD1%)
4.900 3.000 1.100 peak 95 spectrum 1 weight 0.68713E+00 volume 0.85325E-03 ppm1 9.127 ppm2 0.434 CV 1
ASSI { 146}
(( segid " " and resid 145 and name HN ))
(( segid " " and resid 146 and name HN ))
2.600 0.900 0.900 peak 146 spectrum 1 weight 0.92308E+00 volume 0.84340E-02 ppm1 9.120 ppm2 8.028 CV 1
ASSI { 147}
(( segid " " and resid 145 and name HN ))
(( segid " " and resid 144 and name HN ))
2.700 0.900 0.900 peak 147 spectrum 1 weight 0.92308E+00 volume 0.75117E-02 ppm1 9.120 ppm2 7.886 CV 1
ASSI { 150}
(( segid " " and resid 145 and name HN ))
(( segid " " and resid 142 and name HA ))
3.300 1.400 1.400 peak 150 spectrum 1 weight 0.98474E+00 volume 0.53142E-02 ppm1 9.120 ppm2 3.888 CV 1
ASSI { 171}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HN ))
6.000 6.000 0.000 peak 171 spectrum 1 weight 0.66755E+00 volume 0.10517E-03 ppm1 9.389 ppm2 10.086 CV 1
ASSI { 177}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 39 and name HA ))
2.700 0.900 0.900 peak 177 spectrum 1 weight 0.10000E+01 volume 0.64643E-02 ppm1 8.644 ppm2 5.715 CV 1
ASSI { 185}
(( segid " " and resid 6 and name HN ))
( segid " " and resid 4 and name HG2%)
6.000 6.000 0.000 peak 185 spectrum 1 weight 0.59004E+00 volume 0.50645E-04 ppm1 8.643 ppm2 0.246 CV 1
ASSI { 190}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 36 and name HN ))
4.600 2.700 1.400 peak 190 spectrum 1 weight 0.70352E+00 volume 0.12631E-02 ppm1 9.387 ppm2 8.851 CV 1
ASSI { 191}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 38 and name HN ))
6.000 5.200 0.000 peak 191 spectrum 1 weight 0.59118E+00 volume 0.14507E-03 ppm1 9.387 ppm2 8.545 CV 1
ASSI { 192}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HA ))
2.000 0.500 0.500 peak 192 spectrum 1 weight 0.10000E+01 volume 0.21260E-01 ppm1 9.387 ppm2 5.438 CV 1
ASSI { 193}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 37 and name HA ))
2.800 1.000 1.000 peak 193 spectrum 1 weight 0.87386E+00 volume 0.39934E-02 ppm1 9.387 ppm2 4.707 CV 1
ASSI { 224}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 41 and name HN ))
3.900 1.900 1.900 peak 224 spectrum 1 weight 0.68349E+00 volume 0.74889E-03 ppm1 9.286 ppm2 8.725 CV 1
ASSI { 227}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 42 and name HA ))
4.200 2.200 1.800 peak 227 spectrum 1 weight 0.71591E+00 volume 0.15321E-02 ppm1 9.286 ppm2 4.347 CV 1
ASSI { 229}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 73 and name HB1 ))
5.400 3.700 0.600 peak 229 spectrum 1 weight 0.68143E+00 volume 0.68630E-03 ppm1 9.288 ppm2 2.012 CV 1
ASSI { 237}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 108 and name HN ))
4.000 2.000 2.000 peak 237 spectrum 1 weight 0.84239E+00 volume 0.35781E-02 ppm1 8.685 ppm2 9.118 CV 1
ASSI { 239}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 107 and name HA ))
3.400 1.500 1.500 peak 239 spectrum 1 weight 0.83329E+00 volume 0.34534E-02 ppm1 8.686 ppm2 5.422 CV 1
ASSI { 255}
(( segid " " and resid 110 and name HN ))
(( segid " " and resid 87 and name HN ))
4.000 2.000 2.000 peak 255 spectrum 1 weight 0.74018E+00 volume 0.34188E-02 ppm1 8.705 ppm2 9.126 CV 1
OR { 255}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 108 and name HN ))
ASSI { 257}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 86 and name HD1%)
5.100 3.300 0.900 peak 257 spectrum 1 weight 0.64746E+00 volume 0.39561E-03 ppm1 8.695 ppm2 0.424 CV 1
ASSI { 267}
(( segid " " and resid 110 and name HN ))
(( segid " " and resid 90 and name HA ))
5.000 3.200 1.000 peak 267 spectrum 1 weight 0.67491E+00 volume 0.46528E-03 ppm1 8.712 ppm2 4.724 CV 1
ASSI { 268}
(( segid " " and resid 110 and name HN ))
(( segid " " and resid 109 and name HA ))
2.100 0.500 0.500 peak 268 spectrum 1 weight 0.10000E+01 volume 0.16522E-01 ppm1 8.710 ppm2 4.560 CV 1
ASSI { 279}
(( segid " " and resid 2 and name HN ))
(( segid " " and resid 3 and name HN ))
6.000 6.000 0.000 peak 279 spectrum 1 weight 0.48509E+00 volume 0.12864E-04 ppm1 8.263 ppm2 10.084 CV 1
ASSI { 280}
(( segid " " and resid 2 and name HN ))
(( segid " " and resid 36 and name HN ))
4.400 2.400 1.600 peak 280 spectrum 1 weight 0.69748E+00 volume 0.11208E-02 ppm1 8.263 ppm2 8.849 CV 1
ASSI { 284}
(( segid " " and resid 2 and name HN ))
(( segid " " and resid 35 and name HA ))
2.900 1.000 1.000 peak 284 spectrum 1 weight 0.10000E+01 volume 0.76033E-02 ppm1 8.262 ppm2 5.535 CV 1
ASSI { 300}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 83 and name HN ))
4.000 2.000 2.000 peak 300 spectrum 1 weight 0.68303E+00 volume 0.73523E-03 ppm1 10.081 ppm2 8.953 CV 1
ASSI { 310}
(( segid " " and resid 126 and name HN ))
( segid " " and resid 53 and name HE% )
6.000 6.000 0.000 peak 310 spectrum 1 weight 0.66940E+00 volume 0.22290E-03 ppm1 8.040 ppm2 6.724 CV 1
ASSI { 312}
(( segid " " and resid 126 and name HN ))
(( segid " " and resid 125 and name HD1 ))
3.800 1.800 1.800 peak 312 spectrum 1 weight 0.85688E+00 volume 0.37721E-02 ppm1 8.039 ppm2 4.147 CV 1
ASSI { 316}
(( segid " " and resid 126 and name HN ))
(( segid " " and resid 125 and name HG2 ))
3.400 1.400 1.400 peak 316 spectrum 1 weight 0.70711E+00 volume 0.13437E-02 ppm1 8.035 ppm2 1.328 CV 1
ASSI { 332}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 82 and name HA ))
4.500 2.600 1.500 peak 332 spectrum 1 weight 0.72665E+00 volume 0.17476E-02 ppm1 10.079 ppm2 4.423 CV 1
ASSI { 337}
(( segid " " and resid 131 and name HN ))
(( segid " " and resid 124 and name HA ))
4.000 2.000 2.000 peak 337 spectrum 1 weight 0.82838E+00 volume 0.33853E-02 ppm1 8.766 ppm2 4.692 CV 1
ASSI { 340}
(( segid " " and resid 131 and name HN ))
(( segid " " and resid 132 and name HN ))
2.500 0.800 0.800 peak 340 spectrum 1 weight 0.10000E+01 volume 0.74656E-02 ppm1 8.763 ppm2 8.283 CV 1
ASSI { 343}
(( segid " " and resid 131 and name HN ))
(( segid " " and resid 130 and name HA ))
2.400 0.700 0.700 peak 343 spectrum 1 weight 0.10000E+01 volume 0.13237E-01 ppm1 8.765 ppm2 5.106 CV 1
ASSI { 347}
(( segid " " and resid 126 and name HN ))
(( segid " " and resid 127 and name HN ))
2.900 1.000 1.000 peak 347 spectrum 1 weight 0.98368E+00 volume 0.53025E-02 ppm1 8.038 ppm2 7.078 CV 1
ASSI { 353}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 4 and name HN ))
4.600 2.600 1.400 peak 353 spectrum 1 weight 0.70014E+00 volume 0.11846E-02 ppm1 8.532 ppm2 9.388 CV 1
ASSI { 366}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 4 and name HG2%)
5.900 4.400 0.100 peak 366 spectrum 1 weight 0.67174E+00 volume 0.33679E-03 ppm1 8.531 ppm2 0.231 CV 1
ASSI { 385}
(( segid " " and resid 133 and name HN ))
(( segid " " and resid 130 and name HB1 ))
6.000 6.000 0.000 peak 385 spectrum 1 weight 0.51392E+00 volume 0.50994E-04 ppm1 7.659 ppm2 2.535 CV 1
ASSI { 392}
(( segid " " and resid 140 and name HN ))
(( segid " " and resid 139 and name HA ))
4.400 2.500 1.600 peak 392 spectrum 1 weight 0.69456E+00 volume 0.10490E-02 ppm1 6.411 ppm2 3.571 CV 1
ASSI { 405}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 5 and name HN ))
4.800 2.800 1.200 peak 405 spectrum 1 weight 0.68387E+00 volume 0.76014E-03 ppm1 9.074 ppm2 8.386 CV 1
ASSI { 408}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HA ))
2.200 0.600 0.600 peak 408 spectrum 1 weight 0.98088E+00 volume 0.19654E-01 ppm1 9.071 ppm2 5.023 CV 1
ASSI { 416}
(( segid " " and resid 124 and name HN ))
(( segid " " and resid 137 and name HG11))
5.500 3.800 0.500 peak 416 spectrum 1 weight 0.58950E+00 volume 0.80836E-03 ppm1 9.071 ppm2 0.255 CV 1
OR { 416}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 4 and name HG2%)
ASSI { 418}
(( segid " " and resid 124 and name HN ))
(( segid " " and resid 123 and name HA ))
2.600 0.800 0.800 peak 418 spectrum 1 weight 0.86391E+00 volume 0.21061E-01 ppm1 9.062 ppm2 4.390 CV 1
ASSI { 421}
(( segid " " and resid 136 and name HN ))
(( segid " " and resid 138 and name HN ))
5.600 4.000 0.400 peak 421 spectrum 1 weight 0.59258E+00 volume 0.22876E-03 ppm1 8.387 ppm2 8.140 CV 1
ASSI { 422}
(( segid " " and resid 136 and name HN ))
(( segid " " and resid 137 and name HN ))
2.900 1.100 1.100 peak 422 spectrum 1 weight 0.90980E+00 volume 0.44428E-02 ppm1 8.387 ppm2 7.352 CV 1
ASSI { 427}
(( segid " " and resid 136 and name HN ))
(( segid " " and resid 135 and name HN ))
3.000 1.100 1.100 peak 427 spectrum 1 weight 0.85568E+00 volume 0.37562E-02 ppm1 8.384 ppm2 7.773 CV 1
ASSI { 440}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HA ))
2.000 0.500 0.500 peak 440 spectrum 1 weight 0.92308E+00 volume 0.35468E-01 ppm1 7.734 ppm2 4.789 CV 1
ASSI { 441}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 71 and name HN ))
6.000 5.200 0.000 peak 441 spectrum 1 weight 0.59135E+00 volume 0.15644E-03 ppm1 7.732 ppm2 8.907 CV 1
ASSI { 442}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HN ))
4.900 3.000 1.100 peak 442 spectrum 1 weight 0.70139E+00 volume 0.12139E-02 ppm1 7.732 ppm2 8.104 CV 1
ASSI { 444}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 50 and name HA1 ))
3.800 1.800 1.800 peak 444 spectrum 1 weight 0.71692E+00 volume 0.28842E-02 ppm1 7.732 ppm2 4.648 CV 1
ASSI { 450}
(( segid " " and resid 133 and name HN ))
(( segid " " and resid 132 and name HN ))
2.600 0.900 0.900 peak 450 spectrum 1 weight 0.10000E+01 volume 0.65103E-02 ppm1 7.657 ppm2 8.280 CV 1
ASSI { 452}
(( segid " " and resid 133 and name HN ))
(( segid " " and resid 134 and name HN ))
2.800 1.000 1.000 peak 452 spectrum 1 weight 0.10000E+01 volume 0.62245E-02 ppm1 7.658 ppm2 7.047 CV 1
ASSI { 457}
(( segid " " and resid 133 and name HN ))
(( segid " " and resid 124 and name HA ))
4.200 2.200 1.800 peak 457 spectrum 1 weight 0.71531E+00 volume 0.15198E-02 ppm1 7.655 ppm2 4.696 CV 1
ASSI { 475}
(( segid " " and resid 124 and name HN ))
(( segid " " and resid 123 and name HB1 ))
3.100 1.200 1.200 peak 475 spectrum 1 weight 0.94111E+00 volume 0.48165E-02 ppm1 9.061 ppm2 2.382 CV 1
ASSI { 476}
(( segid " " and resid 124 and name HN ))
(( segid " " and resid 123 and name HG2 ))
4.100 2.100 1.900 peak 476 spectrum 1 weight 0.78012E+00 volume 0.37743E-02 ppm1 9.062 ppm2 1.978 CV 1
OR { 476}
(( segid " " and resid 124 and name HN ))
(( segid " " and resid 123 and name HG1 ))
ASSI { 480}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HA ))
2.200 0.600 0.600 peak 480 spectrum 1 weight 0.92308E+00 volume 0.30866E-01 ppm1 8.852 ppm2 5.540 CV 1
ASSI { 488}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 2 and name HN ))
4.000 2.000 2.000 peak 488 spectrum 1 weight 0.71560E+00 volume 0.15258E-02 ppm1 8.847 ppm2 8.260 CV 1
ASSI { 493}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 22 and name HN ))
2.900 1.000 1.000 peak 493 spectrum 1 weight 0.10000E+01 volume 0.66672E-02 ppm1 8.601 ppm2 8.840 CV 1
ASSI { 495}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HN ))
2.800 1.000 1.000 peak 495 spectrum 1 weight 0.10000E+01 volume 0.57805E-02 ppm1 8.600 ppm2 7.578 CV 1
ASSI { 498}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HB1 ))
3.100 1.200 1.200 peak 498 spectrum 1 weight 0.91647E+00 volume 0.45237E-02 ppm1 8.599 ppm2 3.290 CV 1
OR { 498}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 18 and name HA ))
ASSI { 510}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 37 and name HA ))
6.000 6.000 0.000 peak 510 spectrum 1 weight 0.54853E+00 volume 0.77347E-04 ppm1 8.852 ppm2 4.761 CV 1
ASSI { 511}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 4 and name HN ))
4.400 2.500 1.600 peak 511 spectrum 1 weight 0.72347E+00 volume 0.16852E-02 ppm1 8.849 ppm2 9.388 CV 1
ASSI { 518}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 100 and name HD% )
5.900 4.400 0.100 peak 518 spectrum 1 weight 0.59550E+00 volume 0.36631E-03 ppm1 9.468 ppm2 7.166 CV 1
ASSI { 520}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 77 and name HN ))
3.700 1.700 1.700 peak 520 spectrum 1 weight 0.69717E+00 volume 0.11134E-02 ppm1 9.460 ppm2 8.148 CV 1
ASSI { 533}
(( segid " " and resid 132 and name HN ))
(( segid " " and resid 130 and name HD22))
4.400 2.500 1.600 peak 533 spectrum 1 weight 0.71674E+00 volume 0.15493E-02 ppm1 8.281 ppm2 7.034 CV 1
ASSI { 535}
(( segid " " and resid 132 and name HN ))
(( segid " " and resid 131 and name HN ))
2.500 0.800 0.800 peak 535 spectrum 1 weight 0.10000E+01 volume 0.69477E-02 ppm1 8.279 ppm2 8.761 CV 1
ASSI { 539}
(( segid " " and resid 132 and name HN ))
(( segid " " and resid 133 and name HN ))
2.500 0.800 0.800 peak 539 spectrum 1 weight 0.10000E+01 volume 0.94496E-02 ppm1 8.280 ppm2 7.661 CV 1
ASSI { 540}
(( segid " " and resid 132 and name HN ))
(( segid " " and resid 130 and name HA ))
5.300 3.500 0.700 peak 540 spectrum 1 weight 0.73520E+00 volume 0.19099E-02 ppm1 8.279 ppm2 5.099 CV 1
ASSI { 541}
(( segid " " and resid 132 and name HN ))
(( segid " " and resid 124 and name HA ))
4.200 2.200 1.800 peak 541 spectrum 1 weight 0.87401E+00 volume 0.39953E-02 ppm1 8.280 ppm2 4.705 CV 1
ASSI { 545}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HN ))
6.000 6.000 0.000 peak 545 spectrum 1 weight 0.59005E+00 volume 0.51789E-04 ppm1 7.904 ppm2 9.173 CV 1
ASSI { 546}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 42 and name HN ))
4.700 2.800 1.300 peak 546 spectrum 1 weight 0.70544E+00 volume 0.13066E-02 ppm1 7.904 ppm2 8.955 CV 1
ASSI { 548}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 15 and name HA ))
5.400 3.700 0.600 peak 548 spectrum 1 weight 0.68191E+00 volume 0.70129E-03 ppm1 7.907 ppm2 4.072 CV 1
ASSI { 549}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 41 and name HA2 ))
2.900 1.100 1.100 peak 549 spectrum 1 weight 0.83327E+00 volume 0.34531E-02 ppm1 7.903 ppm2 3.600 CV 1
ASSI { 551}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 40 and name HN ))
3.800 1.800 1.800 peak 551 spectrum 1 weight 0.75308E+00 volume 0.22291E-02 ppm1 7.901 ppm2 8.727 CV 1
ASSI { 553}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HA ))
2.100 0.600 0.600 peak 553 spectrum 1 weight 0.92308E+00 volume 0.23849E-01 ppm1 7.901 ppm2 5.480 CV 1
ASSI { 558}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 7 and name HG2%)
2.800 1.000 1.000 peak 558 spectrum 1 weight 0.92308E+00 volume 0.17453E-01 ppm1 7.901 ppm2 0.802 CV 1
ASSI { 562}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB2 ))
5.000 3.100 1.000 peak 562 spectrum 1 weight 0.66896E+00 volume 0.19820E-03 ppm1 10.336 ppm2 2.709 CV 1
ASSI { 563}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB1 ))
3.600 1.600 1.600 peak 563 spectrum 1 weight 0.70472E+00 volume 0.12904E-02 ppm1 10.340 ppm2 4.172 CV 1
ASSI { 566}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 12 and name HA ))
4.500 2.600 1.500 peak 566 spectrum 1 weight 0.85035E+00 volume 0.36853E-02 ppm1 10.334 ppm2 4.715 CV 1
OR { 566}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 50 and name HA1 ))
ASSI { 569}
(( segid " " and resid 132 and name HN ))
(( segid " " and resid 130 and name HB1 ))
6.000 4.500 0.000 peak 569 spectrum 1 weight 0.61505E+00 volume 0.98307E-03 ppm1 8.284 ppm2 2.565 CV 1
ASSI { 585}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 106 and name HN ))
6.000 5.000 0.000 peak 585 spectrum 1 weight 0.58815E+00 volume 0.21500E-03 ppm1 8.674 ppm2 7.840 CV 1
ASSI { 586}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 103 and name HN ))
2.200 0.600 0.600 peak 586 spectrum 1 weight 0.10000E+01 volume 0.20884E-01 ppm1 8.668 ppm2 8.204 CV 1
ASSI { 594}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 29 and name HN ))
4.900 3.100 1.100 peak 594 spectrum 1 weight 0.66334E+00 volume 0.74139E-03 ppm1 8.024 ppm2 7.487 CV 1
ASSI { 596}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 32 and name HG2 ))
6.000 5.400 0.000 peak 596 spectrum 1 weight 0.65741E+00 volume 0.23138E-03 ppm1 8.020 ppm2 2.328 CV 1
OR { 596}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 32 and name HG1 ))
ASSI { 598}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 3 and name HN ))
3.100 1.200 1.200 peak 598 spectrum 1 weight 0.84317E+00 volume 0.35886E-02 ppm1 8.972 ppm2 10.086 CV 1
ASSI { 600}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 84 and name HN ))
2.200 0.600 0.600 peak 600 spectrum 1 weight 0.10000E+01 volume 0.11987E-01 ppm1 8.970 ppm2 7.411 CV 1
ASSI { 609}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 84 and name HA ))
5.300 3.500 0.700 peak 609 spectrum 1 weight 0.54270E+00 volume 0.11146E-02 ppm1 8.965 ppm2 5.063 CV 1
ASSI { 611}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 102 and name HN ))
5.200 3.300 0.800 peak 611 spectrum 1 weight 0.68301E+00 volume 0.87827E-03 ppm1 8.668 ppm2 9.124 CV 1
ASSI { 620}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HN ))
2.700 0.900 0.900 peak 620 spectrum 1 weight 0.10000E+01 volume 0.91537E-02 ppm1 8.022 ppm2 8.676 CV 1
ASSI { 622}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 28 and name HN ))
2.600 0.800 0.800 peak 622 spectrum 1 weight 0.92308E+00 volume 0.11663E-01 ppm1 8.022 ppm2 8.290 CV 1
ASSI { 631}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 61 and name HE22))
4.400 2.400 1.600 peak 631 spectrum 1 weight 0.65562E+00 volume 0.39506E-03 ppm1 7.795 ppm2 6.808 CV 1
OR { 631}
(( segid " " and resid 56 and name HN ))
( segid " " and resid 53 and name HD% )
ASSI { 643}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 33 and name HN ))
2.600 0.800 0.800 peak 643 spectrum 1 weight 0.10000E+01 volume 0.82804E-02 ppm1 9.217 ppm2 8.457 CV 1
ASSI { 644}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HN ))
2.300 0.600 0.600 peak 644 spectrum 1 weight 0.92308E+00 volume 0.15745E-01 ppm1 9.217 ppm2 8.249 CV 1
ASSI { 645}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 34 and name HN ))
4.300 2.300 1.700 peak 645 spectrum 1 weight 0.68891E+00 volume 0.13640E-02 ppm1 9.220 ppm2 7.820 CV 1
ASSI { 656}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 85 and name HA ))
6.000 6.000 0.000 peak 656 spectrum 1 weight 0.52669E+00 volume 0.51712E-04 ppm1 9.186 ppm2 5.033 CV 1
ASSI { 662}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HA ))
2.200 0.600 0.600 peak 662 spectrum 1 weight 0.92308E+00 volume 0.15332E-01 ppm1 9.184 ppm2 5.336 CV 1
ASSI { 663}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 87 and name HA ))
3.300 1.400 1.400 peak 663 spectrum 1 weight 0.82956E+00 volume 0.34017E-02 ppm1 9.185 ppm2 5.164 CV 1
ASSI { 670}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 2 and name HA ))
6.000 6.000 0.000 peak 670 spectrum 1 weight 0.63405E+00 volume 0.22173E-03 ppm1 8.971 ppm2 4.809 CV 1
ASSI { 676}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 24 and name HA ))
3.200 1.300 1.300 peak 676 spectrum 1 weight 0.88568E+00 volume 0.50647E-02 ppm1 8.024 ppm2 4.521 CV 1
ASSI { 682}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 53 and name HA ))
3.700 1.700 1.700 peak 682 spectrum 1 weight 0.75548E+00 volume 0.22703E-02 ppm1 7.792 ppm2 3.931 CV 1
ASSI { 685}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 57 and name HN ))
2.800 1.000 1.000 peak 685 spectrum 1 weight 0.10000E+01 volume 0.60380E-02 ppm1 7.789 ppm2 8.563 CV 1
ASSI { 686}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HN ))
2.700 0.900 0.900 peak 686 spectrum 1 weight 0.10000E+01 volume 0.70343E-02 ppm1 7.790 ppm2 6.642 CV 1
ASSI { 704}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 49 and name HN ))
4.200 2.200 1.800 peak 704 spectrum 1 weight 0.76651E+00 volume 0.24546E-02 ppm1 8.906 ppm2 8.224 CV 1
ASSI { 708}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HA ))
2.100 0.600 0.600 peak 708 spectrum 1 weight 0.92308E+00 volume 0.31701E-01 ppm1 8.906 ppm2 4.101 CV 1
ASSI { 720}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 74 and name HN ))
6.000 6.000 0.000 peak 720 spectrum 1 weight 0.41685E+00 volume 0.25800E-04 ppm1 8.032 ppm2 9.308 CV 1
ASSI { 729}
(( segid " " and resid 120 and name HN ))
(( segid " " and resid 121 and name HN ))
3.000 1.100 1.100 peak 729 spectrum 1 weight 0.10000E+01 volume 0.98258E-02 ppm1 9.031 ppm2 7.660 CV 1
ASSI { 745}
(( segid " " and resid 92 and name HN ))
( segid " " and resid 87 and name HG2%)
6.000 4.600 0.000 peak 745 spectrum 1 weight 0.59959E+00 volume 0.52403E-03 ppm1 9.110 ppm2 1.039 CV 1
ASSI { 747}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 90 and name HN ))
5.300 3.500 0.700 peak 747 spectrum 1 weight 0.67393E+00 volume 0.42780E-03 ppm1 9.106 ppm2 9.868 CV 1
ASSI { 751}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HN ))
2.300 0.700 0.700 peak 751 spectrum 1 weight 0.92308E+00 volume 0.14753E-01 ppm1 9.108 ppm2 8.627 CV 1
ASSI { 752}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 93 and name HN ))
2.600 0.900 0.900 peak 752 spectrum 1 weight 0.10000E+01 volume 0.73640E-02 ppm1 9.108 ppm2 8.005 CV 1
ASSI { 754}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 87 and name HB ))
5.000 3.200 1.000 peak 754 spectrum 1 weight 0.64419E+00 volume 0.16384E-02 ppm1 9.107 ppm2 4.522 CV 1
ASSI { 760}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 108 and name HN ))
4.700 2.800 1.300 peak 760 spectrum 1 weight 0.70837E+00 volume 0.13716E-02 ppm1 8.690 ppm2 9.129 CV 1
OR { 760}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 87 and name HN ))
ASSI { 763}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 88 and name HA ))
6.000 6.000 0.000 peak 763 spectrum 1 weight 0.62084E+00 volume 0.20292E-03 ppm1 8.690 ppm2 5.043 CV 1
ASSI { 764}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 108 and name HA ))
2.300 0.600 0.600 peak 764 spectrum 1 weight 0.10000E+01 volume 0.21766E-01 ppm1 8.691 ppm2 4.868 CV 1
ASSI { 772}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 112 and name HB2 ))
5.700 4.100 0.300 peak 772 spectrum 1 weight 0.59406E+00 volume 0.30245E-03 ppm1 8.693 ppm2 2.576 CV 1
ASSI { 783}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HN ))
2.600 0.900 0.900 peak 783 spectrum 1 weight 0.10000E+01 volume 0.10084E-01 ppm1 8.288 ppm2 8.034 CV 1
ASSI { 784}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 29 and name HN ))
2.800 0.900 0.900 peak 784 spectrum 1 weight 0.10000E+01 volume 0.92062E-02 ppm1 8.289 ppm2 7.468 CV 1
ASSI { 790}
(( segid " " and resid 122 and name HN ))
(( segid " " and resid 121 and name HN ))
4.900 3.000 1.100 peak 790 spectrum 1 weight 0.68017E+00 volume 0.64685E-03 ppm1 8.024 ppm2 7.677 CV 1
ASSI { 791}
(( segid " " and resid 122 and name HN ))
(( segid " " and resid 89 and name HA ))
3.600 1.700 1.700 peak 791 spectrum 1 weight 0.83240E+00 volume 0.44369E-02 ppm1 8.023 ppm2 5.114 CV 1
ASSI { 803}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 88 and name HN ))
2.900 1.000 1.000 peak 803 spectrum 1 weight 0.10000E+01 volume 0.67298E-02 ppm1 8.634 ppm2 7.526 CV 1
ASSI { 833}
(( segid " " and resid 148 and name HN ))
(( segid " " and resid 152 and name HN ))
5.600 3.900 0.400 peak 833 spectrum 1 weight 0.67069E+00 volume 0.28834E-03 ppm1 7.704 ppm2 7.865 CV 1
ASSI { 843}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HB2 ))
5.100 3.300 0.900 peak 843 spectrum 1 weight 0.67471E+00 volume 0.45792E-03 ppm1 6.922 ppm2 2.955 CV 1
ASSI { 848}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HN ))
3.300 1.400 1.400 peak 848 spectrum 1 weight 0.81972E+00 volume 0.32632E-02 ppm1 8.116 ppm2 8.568 CV 1
ASSI { 859}
(( segid " " and resid 148 and name HN ))
(( segid " " and resid 149 and name HN ))
2.900 1.100 1.100 peak 859 spectrum 1 weight 0.99439E+00 volume 0.54212E-02 ppm1 7.704 ppm2 8.654 CV 1
ASSI { 861}
(( segid " " and resid 148 and name HN ))
(( segid " " and resid 147 and name HN ))
2.600 0.800 0.800 peak 861 spectrum 1 weight 0.10000E+01 volume 0.10147E-01 ppm1 7.704 ppm2 7.453 CV 1
ASSI { 872}
(( segid " " and resid 148 and name HN ))
( segid " " and resid 149 and name HD2%)
5.700 4.100 0.300 peak 872 spectrum 1 weight 0.62301E+00 volume 0.80199E-03 ppm1 7.703 ppm2 0.205 CV 1
OR { 872}
(( segid " " and resid 148 and name HN ))
( segid " " and resid 149 and name HD1%)
ASSI { 881}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HN ))
4.700 2.800 1.300 peak 881 spectrum 1 weight 0.62418E+00 volume 0.12071E-02 ppm1 6.923 ppm2 8.519 CV 1
ASSI { 886}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 10 and name HA2 ))
5.700 4.100 0.300 peak 886 spectrum 1 weight 0.68157E+00 volume 0.69065E-03 ppm1 6.923 ppm2 4.272 CV 1
ASSI { 888}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HB1 ))
6.000 5.700 0.000 peak 888 spectrum 1 weight 0.66828E+00 volume 0.15692E-03 ppm1 6.923 ppm2 3.419 CV 1
ASSI { 893}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 71 and name HN ))
4.700 2.700 1.300 peak 893 spectrum 1 weight 0.71822E+00 volume 0.15798E-02 ppm1 8.221 ppm2 8.896 CV 1
ASSI { 895}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HA2 ))
3.200 1.300 1.300 peak 895 spectrum 1 weight 0.10000E+01 volume 0.55465E-02 ppm1 8.221 ppm2 3.501 CV 1
ASSI { 912}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HN ))
2.600 0.800 0.800 peak 912 spectrum 1 weight 0.10000E+01 volume 0.10710E-01 ppm1 8.621 ppm2 9.876 CV 1
ASSI { 913}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 92 and name HN ))
2.300 0.700 0.700 peak 913 spectrum 1 weight 0.10000E+01 volume 0.16004E-01 ppm1 8.621 ppm2 9.106 CV 1
ASSI { 928}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HN ))
2.400 0.700 0.700 peak 928 spectrum 1 weight 0.10000E+01 volume 0.69889E-02 ppm1 8.221 ppm2 8.505 CV 1
ASSI { 931}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 12 and name HA ))
3.400 1.400 1.400 peak 931 spectrum 1 weight 0.92308E+00 volume 0.93532E-02 ppm1 8.215 ppm2 4.707 CV 1
OR { 931}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HA1 ))
ASSI { 934}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HA ))
2.400 0.700 0.700 peak 934 spectrum 1 weight 0.92308E+00 volume 0.25550E-01 ppm1 8.155 ppm2 3.833 CV 1
ASSI { 936}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HG2 ))
3.700 1.700 1.700 peak 936 spectrum 1 weight 0.92308E+00 volume 0.56350E-02 ppm1 8.157 ppm2 2.236 CV 1
OR { 936}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HG1 ))
ASSI { 938}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HN ))
3.200 1.300 1.300 peak 938 spectrum 1 weight 0.86391E+00 volume 0.12091E-01 ppm1 8.153 ppm2 7.419 CV 1
ASSI { 944}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HA ))
3.600 1.600 1.600 peak 944 spectrum 1 weight 0.62059E+00 volume 0.11218E-02 ppm1 7.349 ppm2 5.291 CV 1
ASSI { 946}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HB1 ))
4.500 2.500 1.500 peak 946 spectrum 1 weight 0.70478E+00 volume 0.12917E-02 ppm1 7.352 ppm2 3.445 CV 1
ASSI { 947}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HB2 ))
5.200 3.400 0.800 peak 947 spectrum 1 weight 0.69229E+00 volume 0.99122E-03 ppm1 7.352 ppm2 3.164 CV 1
ASSI { 958}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 61 and name HN ))
2.300 0.700 0.700 peak 958 spectrum 1 weight 0.10000E+01 volume 0.17137E-01 ppm1 8.284 ppm2 7.926 CV 1
ASSI { 959}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HN ))
2.500 0.800 0.800 peak 959 spectrum 1 weight 0.92308E+00 volume 0.12264E-01 ppm1 8.284 ppm2 7.690 CV 1
ASSI { 978}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HN ))
2.700 0.900 0.900 peak 978 spectrum 1 weight 0.92308E+00 volume 0.70154E-02 ppm1 7.549 ppm2 8.565 CV 1
ASSI { 979}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HN ))
2.700 0.900 0.900 peak 979 spectrum 1 weight 0.10000E+01 volume 0.90071E-02 ppm1 7.548 ppm2 8.231 CV 1
ASSI { 988}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HG2 ))
6.000 5.900 0.000 peak 988 spectrum 1 weight 0.56904E+00 volume 0.79743E-04 ppm1 7.547 ppm2 2.534 CV 1
ASSI { 994}
(( segid " " and resid 147 and name HN ))
(( segid " " and resid 148 and name HN ))
2.800 0.900 0.900 peak 994 spectrum 1 weight 0.10000E+01 volume 0.69944E-02 ppm1 7.452 ppm2 7.705 CV 1
ASSI { 995}
(( segid " " and resid 147 and name HN ))
(( segid " " and resid 146 and name HA ))
3.700 1.700 1.700 peak 995 spectrum 1 weight 0.69850E+00 volume 0.25985E-02 ppm1 7.449 ppm2 3.678 CV 1
ASSI { 1000}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 10 and name HN ))
4.500 2.500 1.500 peak 1000 spectrum 1 weight 0.67881E+00 volume 0.60261E-03 ppm1 7.351 ppm2 8.912 CV 1
ASSI { 1014}
(( segid " " and resid 146 and name HN ))
(( segid " " and resid 145 and name HN ))
2.700 0.900 0.900 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.73516E-02 ppm1 8.023 ppm2 9.119 CV 1
ASSI { 1015}
(( segid " " and resid 146 and name HN ))
(( segid " " and resid 147 and name HN ))
2.700 0.900 0.900 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.76157E-02 ppm1 8.024 ppm2 7.458 CV 1
ASSI { 1023}
(( segid " " and resid 146 and name HN ))
( segid " " and resid 149 and name HD1%)
5.500 3.800 0.500 peak 1023 spectrum 1 weight 0.67056E+00 volume 0.53569E-03 ppm1 8.028 ppm2 0.227 CV 1
OR { 1023}
(( segid " " and resid 146 and name HN ))
( segid " " and resid 149 and name HD2%)
ASSI { 1031}
(( segid " " and resid 143 and name HN ))
(( segid " " and resid 145 and name HN ))
6.000 4.600 0.000 peak 1031 spectrum 1 weight 0.59135E+00 volume 0.15647E-03 ppm1 6.972 ppm2 9.122 CV 1
ASSI { 1033}
(( segid " " and resid 143 and name HN ))
(( segid " " and resid 142 and name HN ))
2.700 0.900 0.900 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.78624E-02 ppm1 6.967 ppm2 8.748 CV 1
ASSI { 1034}
(( segid " " and resid 143 and name HN ))
(( segid " " and resid 144 and name HN ))
2.800 1.000 1.000 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.74883E-02 ppm1 6.966 ppm2 7.887 CV 1
ASSI { 1036}
(( segid " " and resid 143 and name HN ))
(( segid " " and resid 140 and name HA ))
3.500 1.500 1.500 peak 1036 spectrum 1 weight 0.80073E+00 volume 0.29874E-02 ppm1 6.966 ppm2 4.155 CV 1
ASSI { 1045}
(( segid " " and resid 143 and name HN ))
( segid " " and resid 146 and name HD1%)
3.900 1.900 1.900 peak 1045 spectrum 1 weight 0.92308E+00 volume 0.80739E-02 ppm1 6.967 ppm2 0.700 CV 1
ASSI { 1051}
(( segid " " and resid 141 and name HN ))
(( segid " " and resid 140 and name HN ))
2.600 0.800 0.800 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.13339E-01 ppm1 8.676 ppm2 6.412 CV 1
ASSI { 1053}
(( segid " " and resid 141 and name HN ))
(( segid " " and resid 138 and name HA ))
3.300 1.300 1.300 peak 1053 spectrum 1 weight 0.91141E+00 volume 0.44624E-02 ppm1 8.676 ppm2 3.783 CV 1
ASSI { 1066}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 93 and name HA ))
2.900 1.000 1.000 peak 1066 spectrum 1 weight 0.86391E+00 volume 0.73349E-02 ppm1 8.270 ppm2 3.987 CV 1
ASSI { 1069}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 97 and name HN ))
2.500 0.800 0.800 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.10427E-01 ppm1 8.266 ppm2 7.252 CV 1
ASSI { 1078}
(( segid " " and resid 146 and name HN ))
(( segid " " and resid 143 and name HA ))
2.700 0.900 0.900 peak 1078 spectrum 1 weight 0.92308E+00 volume 0.13726E-01 ppm1 8.024 ppm2 3.855 CV 1
ASSI { 1086}
(( segid " " and resid 117 and name HN ))
(( segid " " and resid 116 and name HN ))
3.300 1.400 1.400 peak 1086 spectrum 1 weight 0.73254E+00 volume 0.18603E-02 ppm1 7.679 ppm2 8.211 CV 1
ASSI { 1106}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 20 and name HN ))
4.400 2.400 1.600 peak 1106 spectrum 1 weight 0.69451E+00 volume 0.10478E-02 ppm1 8.851 ppm2 7.572 CV 1
OR { 1106}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 24 and name HN ))
ASSI { 1109}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 21 and name HD1%)
4.200 2.200 1.800 peak 1109 spectrum 1 weight 0.80472E+00 volume 0.30464E-02 ppm1 8.851 ppm2 0.510 CV 1
ASSI { 1114}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 18 and name HA ))
3.800 1.800 1.800 peak 1114 spectrum 1 weight 0.74658E+00 volume 0.21159E-02 ppm1 8.848 ppm2 3.284 CV 1
ASSI { 1125}
(( segid " " and resid 141 and name HN ))
(( segid " " and resid 144 and name HB2 ))
5.700 4.000 0.300 peak 1125 spectrum 1 weight 0.67382E+00 volume 0.42338E-03 ppm1 8.676 ppm2 3.060 CV 1
ASSI { 1126}
(( segid " " and resid 141 and name HN ))
(( segid " " and resid 138 and name HN ))
6.000 5.000 0.000 peak 1126 spectrum 1 weight 0.56092E+00 volume 0.76127E-04 ppm1 8.672 ppm2 8.133 CV 1
ASSI { 1153}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 56 and name HN ))
2.600 0.800 0.800 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.10297E-01 ppm1 6.640 ppm2 7.793 CV 1
ASSI { 1162}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HN ))
3.000 1.200 1.200 peak 1162 spectrum 1 weight 0.94214E+00 volume 0.48285E-02 ppm1 6.640 ppm2 -0.731 CV 1
ASSI { 1163}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 57 and name HN ))
6.000 4.500 0.000 peak 1163 spectrum 1 weight 0.66826E+00 volume 0.15572E-03 ppm1 6.637 ppm2 8.578 CV 1
ASSI { 1170}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
2.900 1.100 1.100 peak 1170 spectrum 1 weight 0.54759E+00 volume 0.19604E-02 ppm1 9.083 ppm2 7.590 CV 1
ASSI { 1171}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HA ))
2.600 0.800 0.800 peak 1171 spectrum 1 weight 0.89468E+00 volume 0.92916E-02 ppm1 9.077 ppm2 4.721 CV 1
ASSI { 1172}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HG11))
6.000 5.000 0.000 peak 1172 spectrum 1 weight 0.60391E+00 volume 0.30409E-03 ppm1 9.077 ppm2 0.501 CV 1
ASSI { 1174}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
3.100 1.200 1.200 peak 1174 spectrum 1 weight 0.62601E+00 volume 0.12495E-02 ppm1 9.066 ppm2 7.586 CV 1
ASSI { 1176}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 19 and name HA ))
4.800 2.900 1.200 peak 1176 spectrum 1 weight 0.67537E+00 volume 0.48245E-03 ppm1 8.845 ppm2 3.459 CV 1
ASSI { 1177}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 78 and name HN ))
2.800 1.000 1.000 peak 1177 spectrum 1 weight 0.88865E+00 volume 0.50986E-02 ppm1 8.143 ppm2 7.419 CV 1
ASSI { 1180}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HN ))
2.600 0.800 0.800 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.88804E-02 ppm1 7.929 ppm2 8.278 CV 1
ASSI { 1185}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 62 and name HN ))
2.500 0.800 0.800 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.11590E-01 ppm1 7.928 ppm2 7.032 CV 1
ASSI { 1192}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 62 and name HD2%)
6.000 4.800 0.000 peak 1192 spectrum 1 weight 0.68965E+00 volume 0.92193E-03 ppm1 7.925 ppm2 0.520 CV 1
ASSI { 1193}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 59 and name HB2 ))
6.000 6.000 0.000 peak 1193 spectrum 1 weight 0.59128E+00 volume 0.15214E-03 ppm1 7.922 ppm2 1.111 CV 1
OR { 1193}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 59 and name HB1 ))
ASSI { 1195}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HD21))
5.100 3.200 0.900 peak 1195 spectrum 1 weight 0.66902E+00 volume 0.20183E-03 ppm1 6.929 ppm2 7.486 CV 1
ASSI { 1200}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HN ))
2.900 1.100 1.100 peak 1200 spectrum 1 weight 0.96422E+00 volume 0.50832E-02 ppm1 6.926 ppm2 8.564 CV 1
ASSI { 1201}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 59 and name HN ))
2.800 1.000 1.000 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.58028E-02 ppm1 6.926 ppm2 7.674 CV 1
ASSI { 1207}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 55 and name HA ))
4.100 2.100 1.900 peak 1207 spectrum 1 weight 0.68695E+00 volume 0.84819E-03 ppm1 6.926 ppm2 3.662 CV 1
ASSI { 1230}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 97 and name HN ))
5.200 3.400 0.800 peak 1230 spectrum 1 weight 0.67736E+00 volume 0.75363E-03 ppm1 8.003 ppm2 7.259 CV 1
ASSI { 1232}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HN ))
2.600 0.900 0.900 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.78097E-02 ppm1 7.997 ppm2 9.108 CV 1
ASSI { 1233}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 91 and name HN ))
4.000 2.000 2.000 peak 1233 spectrum 1 weight 0.76647E+00 volume 0.24540E-02 ppm1 7.996 ppm2 8.620 CV 1
OR { 1233}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 89 and name HN ))
ASSI { 1236}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 87 and name HB ))
3.600 1.600 1.600 peak 1236 spectrum 1 weight 0.70034E+00 volume 0.26278E-02 ppm1 7.996 ppm2 4.551 CV 1
ASSI { 1241}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 16 and name HD2 ))
5.300 3.500 0.700 peak 1241 spectrum 1 weight 0.61730E+00 volume 0.36331E-03 ppm1 7.723 ppm2 3.116 CV 1
OR { 1241}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 14 and name HD2 ))
OR { 1241}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 14 and name HD1 ))
ASSI { 1245}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HN ))
2.400 0.700 0.700 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.19168E-01 ppm1 7.463 ppm2 8.281 CV 1
ASSI { 1246}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HN ))
2.100 0.600 0.600 peak 1246 spectrum 1 weight 0.92308E+00 volume 0.27940E-01 ppm1 7.463 ppm2 8.094 CV 1
ASSI { 1251}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 26 and name HA ))
3.200 1.300 1.300 peak 1251 spectrum 1 weight 0.92308E+00 volume 0.56997E-02 ppm1 7.464 ppm2 3.473 CV 1
ASSI { 1253}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB1 ))
2.900 1.100 1.100 peak 1253 spectrum 1 weight 0.86391E+00 volume 0.22032E-01 ppm1 7.463 ppm2 1.841 CV 1
ASSI { 1254}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HD2 ))
2.300 0.700 0.700 peak 1254 spectrum 1 weight 0.81839E+00 volume 0.36867E-01 ppm1 7.461 ppm2 1.609 CV 1
ASSI { 1264}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 41 and name HA1 ))
6.000 4.800 0.000 peak 1264 spectrum 1 weight 0.63936E+00 volume 0.33364E-03 ppm1 9.012 ppm2 5.283 CV 1
OR { 1264}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 8 and name HA ))
ASSI { 1265}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA1 ))
3.400 1.500 1.500 peak 1265 spectrum 1 weight 0.67060E+00 volume 0.21326E-02 ppm1 9.011 ppm2 3.714 CV 1
ASSI { 1267}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 9 and name HN ))
6.000 4.600 0.000 peak 1267 spectrum 1 weight 0.59210E+00 volume 0.20188E-03 ppm1 9.009 ppm2 7.311 CV 1
ASSI { 1269}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 77 and name HN ))
6.000 6.000 0.000 peak 1269 spectrum 1 weight 0.48091E+00 volume 0.12792E-04 ppm1 8.514 ppm2 8.126 CV 1
ASSI { 1274}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 81 and name HN ))
2.600 0.800 0.800 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.10692E-01 ppm1 8.512 ppm2 7.761 CV 1
ASSI { 1275}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HN ))
2.500 0.800 0.800 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.11009E-01 ppm1 8.512 ppm2 7.506 CV 1
ASSI { 1283}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 81 and name HG1 ))
5.700 4.000 0.300 peak 1283 spectrum 1 weight 0.61111E+00 volume 0.87819E-03 ppm1 8.511 ppm2 2.283 CV 1
OR { 1283}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 81 and name HG2 ))
ASSI { 1286}
(( segid " " and resid 80 and name HN ))
( segid " " and resid 5 and name HD1%)
6.000 6.000 0.000 peak 1286 spectrum 1 weight 0.58978E+00 volume 0.13023E-04 ppm1 8.510 ppm2 0.570 CV 1
ASSI { 1289}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HN ))
2.800 1.000 1.000 peak 1289 spectrum 1 weight 0.94529E+00 volume 0.48652E-02 ppm1 8.200 ppm2 9.414 CV 1
ASSI { 1290}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 43 and name HN ))
5.200 3.400 0.800 peak 1290 spectrum 1 weight 0.67485E+00 volume 0.46298E-03 ppm1 8.200 ppm2 8.903 CV 1
ASSI { 1292}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HN ))
2.700 0.900 0.900 peak 1292 spectrum 1 weight 0.86391E+00 volume 0.68996E-02 ppm1 8.200 ppm2 8.068 CV 1
ASSI { 1294}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA1 ))
3.700 1.700 1.700 peak 1294 spectrum 1 weight 0.75022E+00 volume 0.21798E-02 ppm1 8.200 ppm2 4.283 CV 1
ASSI { 1304}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HN ))
2.600 0.800 0.800 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.70103E-02 ppm1 7.728 ppm2 8.143 CV 1
ASSI { 1306}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HN ))
2.500 0.800 0.800 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.10818E-01 ppm1 7.728 ppm2 6.546 CV 1
ASSI { 1318}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 20 and name HN ))
6.000 6.000 0.000 peak 1318 spectrum 1 weight 0.59059E+00 volume 0.10195E-03 ppm1 7.725 ppm2 7.526 CV 1
ASSI { 1322}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 21 and name HD1%)
4.800 2.900 1.200 peak 1322 spectrum 1 weight 0.71995E+00 volume 0.16150E-02 ppm1 7.726 ppm2 0.503 CV 1
ASSI { 1325}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HA ))
3.900 1.900 1.900 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.87837E-02 ppm1 7.463 ppm2 4.819 CV 1
OR { 1325}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 31 and name HA ))
ASSI { 1327}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 68 and name HN ))
5.400 3.700 0.600 peak 1327 spectrum 1 weight 0.66940E+00 volume 0.22315E-03 ppm1 7.422 ppm2 8.585 CV 1
ASSI { 1328}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HN ))
3.500 1.500 1.500 peak 1328 spectrum 1 weight 0.86391E+00 volume 0.68348E-02 ppm1 7.420 ppm2 8.144 CV 1
ASSI { 1332}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HA ))
3.200 1.300 1.300 peak 1332 spectrum 1 weight 0.91685E+00 volume 0.45283E-02 ppm1 7.419 ppm2 3.569 CV 1
ASSI { 1334}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HB2 ))
3.100 1.200 1.200 peak 1334 spectrum 1 weight 0.86391E+00 volume 0.68455E-02 ppm1 7.420 ppm2 2.002 CV 1
OR { 1334}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HB1 ))
ASSI { 1344}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HN ))
3.700 1.700 1.700 peak 1344 spectrum 1 weight 0.69938E+00 volume 0.11665E-02 ppm1 9.011 ppm2 7.576 CV 1
ASSI { 1350}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 23 and name HN ))
3.800 1.800 1.800 peak 1350 spectrum 1 weight 0.61894E+00 volume 0.32305E-02 ppm1 8.663 ppm2 8.544 CV 1
ASSI { 1354}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 43 and name HA ))
5.400 3.600 0.600 peak 1354 spectrum 1 weight 0.68348E+00 volume 0.74862E-03 ppm1 8.201 ppm2 4.515 CV 1
ASSI { 1357}
(( segid " " and resid 135 and name HN ))
(( segid " " and resid 136 and name HN ))
2.800 0.900 0.900 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.66029E-02 ppm1 7.774 ppm2 8.384 CV 1
ASSI { 1359}
(( segid " " and resid 135 and name HN ))
(( segid " " and resid 134 and name HN ))
2.800 1.000 1.000 peak 1359 spectrum 1 weight 0.10000E+01 volume 0.66098E-02 ppm1 7.774 ppm2 7.059 CV 1
ASSI { 1360}
(( segid " " and resid 135 and name HN ))
(( segid " " and resid 132 and name HA ))
3.500 1.600 1.600 peak 1360 spectrum 1 weight 0.74488E+00 volume 0.20858E-02 ppm1 7.775 ppm2 4.373 CV 1
ASSI { 1362}
(( segid " " and resid 135 and name HN ))
(( segid " " and resid 136 and name HA ))
5.500 3.800 0.500 peak 1362 spectrum 1 weight 0.67414E+00 volume 0.67880E-03 ppm1 7.771 ppm2 3.641 CV 1
ASSI { 1369}
(( segid " " and resid 135 and name HN ))
( segid " " and resid 134 and name HG2%)
3.400 1.400 1.400 peak 1369 spectrum 1 weight 0.93217E+00 volume 0.47112E-02 ppm1 7.774 ppm2 1.108 CV 1
OR { 1369}
(( segid " " and resid 135 and name HN ))
(( segid " " and resid 58 and name HG1 ))
ASSI { 1382}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 89 and name HA ))
2.400 0.700 0.700 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.94098E-02 ppm1 9.879 ppm2 5.117 CV 1
ASSI { 1387}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 121 and name HG1 ))
2.400 0.700 0.700 peak 1387 spectrum 1 weight 0.92308E+00 volume 0.12674E-01 ppm1 9.878 ppm2 2.189 CV 1
ASSI { 1388}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 121 and name HG2 ))
4.100 2.200 1.900 peak 1388 spectrum 1 weight 0.68474E+00 volume 0.23745E-02 ppm1 9.876 ppm2 2.015 CV 1
ASSI { 1389}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 121 and name HB1 ))
3.900 1.900 1.900 peak 1389 spectrum 1 weight 0.97057E+00 volume 0.51552E-02 ppm1 9.880 ppm2 1.823 CV 1
ASSI { 1393}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 23 and name HA ))
3.600 1.600 1.600 peak 1393 spectrum 1 weight 0.72843E+00 volume 0.30557E-02 ppm1 8.675 ppm2 3.715 CV 1
ASSI { 1395}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HN ))
2.600 0.800 0.800 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.92309E-02 ppm1 8.672 ppm2 8.231 CV 1
ASSI { 1396}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 27 and name HN ))
2.600 0.800 0.800 peak 1396 spectrum 1 weight 0.92308E+00 volume 0.12219E-01 ppm1 8.671 ppm2 8.029 CV 1
ASSI { 1397}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HN ))
4.600 2.600 1.400 peak 1397 spectrum 1 weight 0.68176E+00 volume 0.69651E-03 ppm1 8.671 ppm2 7.534 CV 1
ASSI { 1429}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HN ))
2.800 1.000 1.000 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.70036E-02 ppm1 8.232 ppm2 7.554 CV 1
ASSI { 1435}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 22 and name HA ))
3.300 1.300 1.300 peak 1435 spectrum 1 weight 0.73692E+00 volume 0.31791E-02 ppm1 8.232 ppm2 4.086 CV 1
ASSI { 1440}
(( segid " " and resid 144 and name HN ))
(( segid " " and resid 145 and name HN ))
2.700 0.900 0.900 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.90900E-02 ppm1 7.887 ppm2 9.119 CV 1
ASSI { 1445}
(( segid " " and resid 144 and name HN ))
(( segid " " and resid 143 and name HN ))
2.500 0.800 0.800 peak 1445 spectrum 1 weight 0.10000E+01 volume 0.13544E-01 ppm1 7.887 ppm2 6.972 CV 1
ASSI { 1447}
(( segid " " and resid 144 and name HN ))
(( segid " " and resid 141 and name HA ))
3.300 1.400 1.400 peak 1447 spectrum 1 weight 0.92745E+00 volume 0.46552E-02 ppm1 7.888 ppm2 4.144 CV 1
ASSI { 1540}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HN ))
2.700 0.900 0.900 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.77484E-02 ppm1 8.231 ppm2 8.669 CV 1
ASSI { 1569}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HG2 ))
5.300 3.600 0.700 peak 1569 spectrum 1 weight 0.69826E+00 volume 0.11398E-02 ppm1 7.034 ppm2 2.474 CV 1
ASSI { 1570}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 60 and name HN ))
5.200 3.300 0.800 peak 1570 spectrum 1 weight 0.67755E+00 volume 0.56010E-03 ppm1 7.030 ppm2 8.278 CV 1
ASSI { 1571}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 64 and name HN ))
6.000 4.900 0.000 peak 1571 spectrum 1 weight 0.62391E+00 volume 0.12009E-02 ppm1 7.030 ppm2 8.075 CV 1
ASSI { 1572}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HN ))
2.000 0.500 0.500 peak 1572 spectrum 1 weight 0.92308E+00 volume 0.19769E-01 ppm1 7.029 ppm2 7.917 CV 1
OR { 1572}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HN ))
ASSI { 1575}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HA ))
3.600 1.600 1.600 peak 1575 spectrum 1 weight 0.77992E+00 volume 0.26697E-02 ppm1 7.029 ppm2 3.896 CV 1
ASSI { 1613}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 108 and name HN ))
5.200 3.400 0.800 peak 1613 spectrum 1 weight 0.69343E+00 volume 0.10205E-02 ppm1 7.130 ppm2 9.129 CV 1
ASSI { 1617}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 59 and name HA ))
5.200 3.400 0.800 peak 1617 spectrum 1 weight 0.67512E+00 volume 0.47325E-03 ppm1 7.028 ppm2 3.742 CV 1
ASSI { 1621}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HN ))
2.900 1.100 1.100 peak 1621 spectrum 1 weight 0.83165E+00 volume 0.34307E-02 ppm1 8.556 ppm2 8.836 CV 1
ASSI { 1623}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HN ))
2.900 1.100 1.100 peak 1623 spectrum 1 weight 0.94390E+00 volume 0.48490E-02 ppm1 8.557 ppm2 7.558 CV 1
ASSI { 1638}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 41 and name HA2 ))
5.100 3.200 0.900 peak 1638 spectrum 1 weight 0.71492E+00 volume 0.15115E-02 ppm1 8.884 ppm2 3.577 CV 1
ASSI { 1639}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HN ))
2.600 0.900 0.900 peak 1639 spectrum 1 weight 0.82688E+00 volume 0.33643E-02 ppm1 8.881 ppm2 9.412 CV 1
ASSI { 1642}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 41 and name HA1 ))
4.200 2.200 1.800 peak 1642 spectrum 1 weight 0.71115E+00 volume 0.14319E-02 ppm1 8.881 ppm2 5.301 CV 1
ASSI { 1643}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 73 and name HA ))
3.800 1.800 1.800 peak 1643 spectrum 1 weight 0.92308E+00 volume 0.83403E-02 ppm1 8.882 ppm2 4.707 CV 1
ASSI { 1651}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 7 and name HG2%)
6.000 6.000 0.000 peak 1651 spectrum 1 weight 0.59069E+00 volume 0.11001E-03 ppm1 8.880 ppm2 0.763 CV 1
OR { 1651}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 74 and name HB2 ))
ASSI { 1654}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 6 and name HB2 ))
6.000 6.000 0.000 peak 1654 spectrum 1 weight 0.55755E+00 volume 0.25984E-04 ppm1 8.748 ppm2 2.597 CV 1
ASSI { 1656}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 8 and name HN ))
5.600 4.000 0.400 peak 1656 spectrum 1 weight 0.66923E+00 volume 0.21378E-03 ppm1 8.739 ppm2 7.891 CV 1
ASSI { 1658}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
2.300 0.700 0.700 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.14501E-01 ppm1 8.740 ppm2 5.711 CV 1
ASSI { 1659}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 7 and name HA ))
2.900 1.000 1.000 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.55501E-02 ppm1 8.739 ppm2 5.492 CV 1
ASSI { 1668}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 20 and name HA ))
3.800 1.800 1.800 peak 1668 spectrum 1 weight 0.75770E+00 volume 0.23079E-02 ppm1 8.558 ppm2 4.347 CV 1
ASSI { 1675}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 80 and name HN ))
2.600 0.800 0.800 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.89515E-02 ppm1 7.506 ppm2 8.511 CV 1
ASSI { 1690}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 75 and name HN ))
4.500 2.500 1.500 peak 1690 spectrum 1 weight 0.69149E+00 volume 0.97041E-03 ppm1 7.502 ppm2 6.313 CV 1
ASSI { 1692}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HN ))
3.000 1.100 1.100 peak 1692 spectrum 1 weight 0.77577E+00 volume 0.37165E-02 ppm1 7.409 ppm2 8.140 CV 1
ASSI { 1700}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 97 and name HA ))
5.200 3.400 0.800 peak 1700 spectrum 1 weight 0.67123E+00 volume 0.31372E-03 ppm1 7.343 ppm2 4.002 CV 1
ASSI { 1703}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 110 and name HN ))
4.000 2.000 2.000 peak 1703 spectrum 1 weight 0.87329E+00 volume 0.39861E-02 ppm1 9.140 ppm2 8.707 CV 1
OR { 1703}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 109 and name HN ))
ASSI { 1704}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HA ))
1.800 0.400 0.400 peak 1704 spectrum 1 weight 0.92308E+00 volume 0.38617E-01 ppm1 9.137 ppm2 5.324 CV 1
ASSI { 1709}
(( segid " " and resid 87 and name HN ))
( segid " " and resid 86 and name HD1%)
4.900 3.000 1.100 peak 1709 spectrum 1 weight 0.76972E+00 volume 0.27082E-02 ppm1 9.142 ppm2 0.430 CV 1
ASSI { 1710}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HB ))
3.800 1.800 1.800 peak 1710 spectrum 1 weight 0.84594E+00 volume 0.46005E-02 ppm1 9.136 ppm2 1.819 CV 1
ASSI { 1716}
(( segid " " and resid 149 and name HN ))
(( segid " " and resid 150 and name HN ))
2.800 1.000 1.000 peak 1716 spectrum 1 weight 0.92308E+00 volume 0.74974E-02 ppm1 8.650 ppm2 8.058 CV 1
ASSI { 1717}
(( segid " " and resid 149 and name HN ))
(( segid " " and resid 148 and name HN ))
2.900 1.000 1.000 peak 1717 spectrum 1 weight 0.10000E+01 volume 0.56843E-02 ppm1 8.650 ppm2 7.707 CV 1
ASSI { 1718}
(( segid " " and resid 149 and name HN ))
(( segid " " and resid 147 and name HN ))
4.700 2.800 1.300 peak 1718 spectrum 1 weight 0.68836E+00 volume 0.88708E-03 ppm1 8.650 ppm2 7.443 CV 1
OR { 1718}
(( segid " " and resid 149 and name HN ))
(( segid " " and resid 151 and name HN ))
ASSI { 1726}
(( segid " " and resid 149 and name HN ))
( segid " " and resid 145 and name HD1%)
5.000 3.200 1.000 peak 1726 spectrum 1 weight 0.67704E+00 volume 0.54238E-03 ppm1 8.652 ppm2 0.512 CV 1
ASSI { 1730}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 97 and name HN ))
4.200 2.200 1.800 peak 1730 spectrum 1 weight 0.70282E+00 volume 0.12470E-02 ppm1 8.204 ppm2 7.261 CV 1
ASSI { 1734}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 94 and name HN ))
2.200 0.600 0.600 peak 1734 spectrum 1 weight 0.86391E+00 volume 0.21124E-01 ppm1 8.203 ppm2 8.061 CV 1
ASSI { 1738}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 93 and name HB1 ))
5.700 4.100 0.300 peak 1738 spectrum 1 weight 0.54723E+00 volume 0.34065E-03 ppm1 8.202 ppm2 3.336 CV 1
ASSI { 1744}
(( segid " " and resid 130 and name HN ))
(( segid " " and resid 125 and name HA ))
3.700 1.700 1.700 peak 1744 spectrum 1 weight 0.73409E+00 volume 0.18892E-02 ppm1 7.725 ppm2 4.906 CV 1
ASSI { 1746}
(( segid " " and resid 130 and name HN ))
(( segid " " and resid 125 and name HB2 ))
6.000 6.000 0.000 peak 1746 spectrum 1 weight 0.48509E+00 volume 0.13059E-04 ppm1 7.726 ppm2 1.050 CV 1
ASSI { 1748}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 77 and name HN ))
5.800 4.300 0.200 peak 1748 spectrum 1 weight 0.59236E+00 volume 0.21649E-03 ppm1 7.508 ppm2 8.150 CV 1
ASSI { 1751}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 75 and name HN ))
3.900 1.900 1.900 peak 1751 spectrum 1 weight 0.72895E+00 volume 0.19498E-02 ppm1 7.412 ppm2 6.323 CV 1
ASSI { 1756}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 101 and name HN ))
5.800 4.100 0.200 peak 1756 spectrum 1 weight 0.68258E+00 volume 0.72144E-03 ppm1 7.342 ppm2 9.437 CV 1
ASSI { 1757}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 99 and name HN ))
2.400 0.700 0.700 peak 1757 spectrum 1 weight 0.10000E+01 volume 0.18363E-01 ppm1 7.343 ppm2 7.881 CV 1
ASSI { 1763}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 99 and name HA ))
3.400 1.400 1.400 peak 1763 spectrum 1 weight 0.10000E+01 volume 0.57379E-02 ppm1 7.343 ppm2 4.461 CV 1
ASSI { 1768}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 99 and name HB2 ))
3.700 1.700 1.700 peak 1768 spectrum 1 weight 0.85978E+00 volume 0.38103E-02 ppm1 7.342 ppm2 2.414 CV 1
ASSI { 1769}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 99 and name HB1 ))
4.000 2.000 2.000 peak 1769 spectrum 1 weight 0.81318E+00 volume 0.31696E-02 ppm1 7.343 ppm2 2.035 CV 1
ASSI { 1773}
(( segid " " and resid 100 and name HN ))
( segid " " and resid 96 and name HG2%)
4.900 3.000 1.100 peak 1773 spectrum 1 weight 0.62970E+00 volume 0.13331E-02 ppm1 7.342 ppm2 0.734 CV 1
ASSI { 1776}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 92 and name HA ))
3.800 1.800 1.800 peak 1776 spectrum 1 weight 0.81007E+00 volume 0.31246E-02 ppm1 8.205 ppm2 4.698 CV 1
ASSI { 1781}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 98 and name HN ))
6.000 6.000 0.000 peak 1781 spectrum 1 weight 0.57968E+00 volume 0.13197E-04 ppm1 8.199 ppm2 7.844 CV 1
OR { 1781}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 99 and name HN ))
ASSI { 1785}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 21 and name HN ))
5.400 3.600 0.600 peak 1785 spectrum 1 weight 0.67394E+00 volume 0.42824E-03 ppm1 8.145 ppm2 8.612 CV 1
ASSI { 1787}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HN ))
2.600 0.800 0.800 peak 1787 spectrum 1 weight 0.92308E+00 volume 0.73582E-02 ppm1 8.145 ppm2 7.729 CV 1
ASSI { 1788}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 20 and name HN ))
3.000 1.100 1.100 peak 1788 spectrum 1 weight 0.85267E+00 volume 0.46807E-02 ppm1 8.145 ppm2 7.567 CV 1
ASSI { 1789}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 17 and name HN ))
6.000 6.000 0.000 peak 1789 spectrum 1 weight 0.48509E+00 volume 0.12869E-04 ppm1 8.142 ppm2 6.547 CV 1
ASSI { 1792}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 17 and name HA ))
4.800 2.900 1.200 peak 1792 spectrum 1 weight 0.67646E+00 volume 0.52221E-03 ppm1 8.144 ppm2 3.644 CV 1
ASSI { 1794}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
4.200 2.200 1.800 peak 1794 spectrum 1 weight 0.70318E+00 volume 0.12552E-02 ppm1 8.144 ppm2 3.281 CV 1
OR { 1794}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 20 and name HB1 ))
ASSI { 1800}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 18 and name HB% )
2.800 1.000 1.000 peak 1800 spectrum 1 weight 0.10000E+01 volume 0.12340E-01 ppm1 8.145 ppm2 0.109 CV 1
ASSI { 1805}
(( segid " " and resid 130 and name HN ))
(( segid " " and resid 125 and name HB1 ))
6.000 6.000 0.000 peak 1805 spectrum 1 weight 0.59147E+00 volume 0.16406E-03 ppm1 7.727 ppm2 -0.025 CV 1
ASSI { 1806}
(( segid " " and resid 130 and name HN ))
(( segid " " and resid 129 and name HN ))
2.500 0.800 0.800 peak 1806 spectrum 1 weight 0.99734E+00 volume 0.54537E-02 ppm1 7.726 ppm2 8.334 CV 1
ASSI { 1807}
(( segid " " and resid 130 and name HN ))
(( segid " " and resid 128 and name HN ))
5.600 3.900 0.400 peak 1807 spectrum 1 weight 0.68512E+00 volume 0.79627E-03 ppm1 7.723 ppm2 7.983 CV 1
ASSI { 1820}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 27 and name HA ))
3.400 1.500 1.500 peak 1820 spectrum 1 weight 0.73095E+00 volume 0.18302E-02 ppm1 8.246 ppm2 4.189 CV 1
ASSI { 1821}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 32 and name HN ))
2.400 0.700 0.700 peak 1821 spectrum 1 weight 0.10000E+01 volume 0.10745E-01 ppm1 8.244 ppm2 9.219 CV 1
ASSI { 1823}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HN ))
2.000 0.500 0.500 peak 1823 spectrum 1 weight 0.86391E+00 volume 0.26354E-01 ppm1 8.243 ppm2 8.105 CV 1
ASSI { 1825}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 26 and name HA ))
4.600 2.700 1.400 peak 1825 spectrum 1 weight 0.72539E+00 volume 0.17230E-02 ppm1 8.243 ppm2 3.459 CV 1
ASSI { 1826}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB2 ))
3.500 1.500 1.500 peak 1826 spectrum 1 weight 0.75170E+00 volume 0.22054E-02 ppm1 8.242 ppm2 3.253 CV 1
ASSI { 1836}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 29 and name HN ))
5.600 3.900 0.400 peak 1836 spectrum 1 weight 0.68857E+00 volume 0.89275E-03 ppm1 8.242 ppm2 7.470 CV 1
ASSI { 1838}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 32 and name HG1 ))
6.000 4.500 0.000 peak 1838 spectrum 1 weight 0.68627E+00 volume 0.82916E-03 ppm1 8.241 ppm2 2.346 CV 1
ASSI { 1852}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 105 and name HN ))
2.700 0.900 0.900 peak 1852 spectrum 1 weight 0.92308E+00 volume 0.81982E-02 ppm1 7.822 ppm2 8.602 CV 1
ASSI { 1853}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 107 and name HN ))
2.000 0.500 0.500 peak 1853 spectrum 1 weight 0.86391E+00 volume 0.50569E-01 ppm1 7.822 ppm2 7.132 CV 1
ASSI { 1855}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 104 and name HA ))
3.800 1.800 1.800 peak 1855 spectrum 1 weight 0.63532E+00 volume 0.14552E-02 ppm1 7.824 ppm2 3.849 CV 1
ASSI { 1900}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 101 and name HN ))
6.000 6.000 0.000 peak 1900 spectrum 1 weight 0.59007E+00 volume 0.54389E-04 ppm1 9.134 ppm2 9.422 CV 1
ASSI { 1903}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 103 and name HN ))
2.800 1.000 1.000 peak 1903 spectrum 1 weight 0.10000E+01 volume 0.62422E-02 ppm1 9.135 ppm2 8.199 CV 1
ASSI { 1905}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 101 and name HA ))
2.300 0.600 0.600 peak 1905 spectrum 1 weight 0.86391E+00 volume 0.35911E-01 ppm1 9.135 ppm2 4.391 CV 1
ASSI { 1932}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 105 and name HA ))
3.400 1.400 1.400 peak 1932 spectrum 1 weight 0.92121E+00 volume 0.45807E-02 ppm1 7.820 ppm2 4.859 CV 1
ASSI { 2008}
(( segid " " and resid 119 and name HN ))
(( segid " " and resid 120 and name HN ))
6.000 6.000 0.000 peak 2008 spectrum 1 weight 0.59143E+00 volume 0.16136E-03 ppm1 7.775 ppm2 9.021 CV 1
ASSI { 2015}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 82 and name HN ))
2.400 0.700 0.700 peak 2015 spectrum 1 weight 0.92308E+00 volume 0.16696E-01 ppm1 7.766 ppm2 7.143 CV 1
ASSI { 2016}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 78 and name HA ))
3.100 1.200 1.200 peak 2016 spectrum 1 weight 0.86391E+00 volume 0.60923E-02 ppm1 7.767 ppm2 3.932 CV 1
ASSI { 2032}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 96 and name HN ))
2.500 0.800 0.800 peak 2032 spectrum 1 weight 0.10000E+01 volume 0.10145E-01 ppm1 7.251 ppm2 8.261 CV 1
ASSI { 2057}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 35 and name HA ))
6.000 6.000 0.000 peak 2057 spectrum 1 weight 0.59005E+00 volume 0.52389E-04 ppm1 7.813 ppm2 5.537 CV 1
ASSI { 2058}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 32 and name HA ))
3.000 1.100 1.100 peak 2058 spectrum 1 weight 0.86391E+00 volume 0.10162E-01 ppm1 7.812 ppm2 3.980 CV 1
ASSI { 2061}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 32 and name HN ))
6.000 4.600 0.000 peak 2061 spectrum 1 weight 0.66829E+00 volume 0.15740E-03 ppm1 7.810 ppm2 9.207 CV 1
ASSI { 2065}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HN ))
2.700 0.900 0.900 peak 2065 spectrum 1 weight 0.92308E+00 volume 0.84529E-02 ppm1 7.764 ppm2 8.508 CV 1
ASSI { 2085}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 36 and name HN ))
5.500 3.800 0.500 peak 2085 spectrum 1 weight 0.68659E+00 volume 0.83818E-03 ppm1 7.231 ppm2 8.844 CV 1
ASSI { 2086}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 33 and name HN ))
4.100 2.100 1.900 peak 2086 spectrum 1 weight 0.76029E+00 volume 0.23514E-02 ppm1 7.232 ppm2 8.468 CV 1
ASSI { 2088}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HN ))
2.300 0.700 0.700 peak 2088 spectrum 1 weight 0.10000E+01 volume 0.27060E-01 ppm1 7.234 ppm2 7.816 CV 1
ASSI { 2091}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HA ))
2.800 1.000 1.000 peak 2091 spectrum 1 weight 0.10000E+01 volume 0.86456E-02 ppm1 7.233 ppm2 4.293 CV 1
ASSI { 2102}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 102 and name HN ))
5.300 3.500 0.700 peak 2102 spectrum 1 weight 0.69055E+00 volume 0.94592E-03 ppm1 9.441 ppm2 9.149 CV 1
ASSI { 2111}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HN ))
4.500 2.500 1.500 peak 2111 spectrum 1 weight 0.72775E+00 volume 0.30457E-02 ppm1 9.438 ppm2 7.337 CV 1
ASSI { 2113}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HA ))
2.300 0.700 0.700 peak 2113 spectrum 1 weight 0.10000E+01 volume 0.23358E-01 ppm1 9.437 ppm2 4.869 CV 1
ASSI { 2116}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HB2 ))
2.400 0.700 0.700 peak 2116 spectrum 1 weight 0.10000E+01 volume 0.96380E-02 ppm1 9.437 ppm2 3.057 CV 1
ASSI { 2117}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HB1 ))
3.900 1.900 1.900 peak 2117 spectrum 1 weight 0.10000E+01 volume 0.60251E-02 ppm1 9.437 ppm2 2.840 CV 1
ASSI { 2119}
(( segid " " and resid 101 and name HN ))
( segid " " and resid 103 and name HG2%)
3.700 1.700 1.700 peak 2119 spectrum 1 weight 0.78709E+00 volume 0.27812E-02 ppm1 9.438 ppm2 0.922 CV 1
ASSI { 2130}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 61 and name HB2 ))
4.000 2.000 2.000 peak 2130 spectrum 1 weight 0.92308E+00 volume 0.58824E-02 ppm1 7.912 ppm2 2.071 CV 1
ASSI { 2134}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HN ))
2.000 0.500 0.500 peak 2134 spectrum 1 weight 0.10000E+01 volume 0.20444E-01 ppm1 7.907 ppm2 7.032 CV 1
ASSI { 2141}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 62 and name HD1%)
6.000 4.500 0.000 peak 2141 spectrum 1 weight 0.59122E+00 volume 0.14771E-03 ppm1 7.896 ppm2 0.303 CV 1
ASSI { 2143}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HN ))
2.200 0.600 0.600 peak 2143 spectrum 1 weight 0.92308E+00 volume 0.20695E-01 ppm1 7.810 ppm2 8.467 CV 1
ASSI { 2151}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 91 and name HA ))
3.200 1.300 1.300 peak 2151 spectrum 1 weight 0.85644E+00 volume 0.37663E-02 ppm1 8.045 ppm2 4.328 CV 1
ASSI { 2155}
(( segid " " and resid 113 and name HN ))
(( segid " " and resid 114 and name HN ))
2.500 0.800 0.800 peak 2155 spectrum 1 weight 0.92308E+00 volume 0.13852E-01 ppm1 7.925 ppm2 7.589 CV 1
ASSI { 2159}
(( segid " " and resid 113 and name HN ))
(( segid " " and resid 112 and name HB2 ))
4.000 2.000 2.000 peak 2159 spectrum 1 weight 0.66311E+00 volume 0.19987E-02 ppm1 7.923 ppm2 2.568 CV 1
ASSI { 2166}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HN ))
5.200 3.400 0.800 peak 2166 spectrum 1 weight 0.67128E+00 volume 0.31590E-03 ppm1 11.272 ppm2 8.050 CV 1
ASSI { 2171}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 95 and name HN ))
2.100 0.600 0.600 peak 2171 spectrum 1 weight 0.86391E+00 volume 0.27605E-01 ppm1 8.046 ppm2 8.190 CV 1
ASSI { 2177}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 93 and name HB1 ))
2.500 0.800 0.800 peak 2177 spectrum 1 weight 0.10000E+01 volume 0.15058E-01 ppm1 8.045 ppm2 3.298 CV 1
OR { 2177}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 93 and name HB2 ))
ASSI { 2182}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 60 and name HN ))
2.800 1.000 1.000 peak 2182 spectrum 1 weight 0.10000E+01 volume 0.63375E-02 ppm1 7.680 ppm2 8.283 CV 1
ASSI { 2184}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 58 and name HN ))
2.800 1.000 1.000 peak 2184 spectrum 1 weight 0.98554E+00 volume 0.53232E-02 ppm1 7.682 ppm2 6.926 CV 1
ASSI { 2187}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 56 and name HA ))
4.100 2.100 1.900 peak 2187 spectrum 1 weight 0.69754E+00 volume 0.11223E-02 ppm1 7.683 ppm2 3.256 CV 1
ASSI { 2195}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 55 and name HN ))
3.400 1.500 1.500 peak 2195 spectrum 1 weight 0.81469E+00 volume 0.31913E-02 ppm1 11.273 ppm2 6.646 CV 1
OR { 2195}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 53 and name HE% )
ASSI { 2203}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 58 and name HE1 ))
5.800 4.200 0.200 peak 2203 spectrum 1 weight 0.69060E+00 volume 0.94707E-03 ppm1 7.681 ppm2 2.350 CV 1
ASSI { 2209}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HN ))
3.800 1.800 1.800 peak 2209 spectrum 1 weight 0.68365E+00 volume 0.75366E-03 ppm1 7.530 ppm2 9.136 CV 1
ASSI { 2210}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 89 and name HN ))
3.200 1.300 1.300 peak 2210 spectrum 1 weight 0.77696E+00 volume 0.37323E-02 ppm1 7.526 ppm2 8.634 CV 1
ASSI { 2212}
(( segid " " and resid 88 and name HN ))
( segid " " and resid 119 and name HE% )
6.000 6.000 0.000 peak 2212 spectrum 1 weight 0.58155E+00 volume 0.40023E-04 ppm1 7.527 ppm2 6.670 CV 1
ASSI { 2213}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HA ))
2.700 0.900 0.900 peak 2213 spectrum 1 weight 0.92308E+00 volume 0.13887E-01 ppm1 7.528 ppm2 5.154 CV 1
ASSI { 2214}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HB ))
3.000 1.100 1.100 peak 2214 spectrum 1 weight 0.89560E+00 volume 0.42680E-02 ppm1 7.527 ppm2 4.546 CV 1
ASSI { 2217}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 92 and name HB1 ))
5.200 3.400 0.800 peak 2217 spectrum 1 weight 0.71847E+00 volume 0.15848E-02 ppm1 7.526 ppm2 2.587 CV 1
ASSI { 2237}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 35 and name HN ))
4.800 2.900 1.200 peak 2237 spectrum 1 weight 0.69305E+00 volume 0.10108E-02 ppm1 8.469 ppm2 7.235 CV 1
ASSI { 2238}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HG2 ))
4.000 2.000 2.000 peak 2238 spectrum 1 weight 0.82334E+00 volume 0.43259E-02 ppm1 8.467 ppm2 2.293 CV 1
ASSI { 2239}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 95 and name HA ))
3.300 1.300 1.300 peak 2239 spectrum 1 weight 0.80400E+00 volume 0.40837E-02 ppm1 7.860 ppm2 4.344 CV 1
ASSI { 2242}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 97 and name HN ))
2.500 0.800 0.800 peak 2242 spectrum 1 weight 0.10000E+01 volume 0.14445E-01 ppm1 7.858 ppm2 7.254 CV 1
ASSI { 2253}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 57 and name HD21))
5.200 3.300 0.800 peak 2253 spectrum 1 weight 0.52477E+00 volume 0.85623E-03 ppm1 7.680 ppm2 7.553 CV 1
ASSI { 2258}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HN ))
3.800 1.800 1.800 peak 2258 spectrum 1 weight 0.86391E+00 volume 0.57011E-02 ppm1 8.686 ppm2 8.567 CV 1
ASSI { 2260}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HN ))
2.800 1.000 1.000 peak 2260 spectrum 1 weight 0.99855E+00 volume 0.54669E-02 ppm1 8.465 ppm2 9.213 CV 1
ASSI { 2262}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 34 and name HN ))
2.500 0.800 0.800 peak 2262 spectrum 1 weight 0.10000E+01 volume 0.10875E-01 ppm1 8.467 ppm2 7.812 CV 1
ASSI { 2263}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HA ))
3.800 1.800 1.800 peak 2263 spectrum 1 weight 0.67550E+00 volume 0.22179E-02 ppm1 8.466 ppm2 4.875 CV 1
ASSI { 2267}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HB2 ))
2.800 1.000 1.000 peak 2267 spectrum 1 weight 0.92308E+00 volume 0.99764E-02 ppm1 8.467 ppm2 2.094 CV 1
OR { 2267}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HB1 ))
ASSI { 2290}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HN ))
2.500 0.800 0.800 peak 2290 spectrum 1 weight 0.10000E+01 volume 0.12006E-01 ppm1 8.565 ppm2 7.793 CV 1
ASSI { 2291}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 58 and name HN ))
2.700 0.900 0.900 peak 2291 spectrum 1 weight 0.10000E+01 volume 0.82069E-02 ppm1 8.565 ppm2 6.927 CV 1
ASSI { 2306}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 21 and name HN ))
2.700 0.900 0.900 peak 2306 spectrum 1 weight 0.10000E+01 volume 0.73209E-02 ppm1 7.576 ppm2 8.602 CV 1
ASSI { 2307}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HN ))
3.100 1.200 1.200 peak 2307 spectrum 1 weight 0.86328E+00 volume 0.38562E-02 ppm1 7.577 ppm2 8.145 CV 1
ASSI { 2311}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 17 and name HA ))
3.200 1.300 1.300 peak 2311 spectrum 1 weight 0.75003E+00 volume 0.33653E-02 ppm1 7.573 ppm2 3.619 CV 1
ASSI { 2321}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 21 and name HD1%)
4.700 2.700 1.300 peak 2321 spectrum 1 weight 0.76119E+00 volume 0.24969E-02 ppm1 7.578 ppm2 0.489 CV 1
ASSI { 2334}
(( segid " " and resid 139 and name HN ))
(( segid " " and resid 138 and name HN ))
2.700 0.900 0.900 peak 2334 spectrum 1 weight 0.10000E+01 volume 0.91535E-02 ppm1 8.724 ppm2 8.151 CV 1
ASSI { 2335}
(( segid " " and resid 139 and name HN ))
(( segid " " and resid 140 and name HN ))
2.600 0.800 0.800 peak 2335 spectrum 1 weight 0.92308E+00 volume 0.11498E-01 ppm1 8.724 ppm2 6.413 CV 1
ASSI { 2349}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 65 and name HG1 ))
6.000 6.000 0.000 peak 2349 spectrum 1 weight 0.58200E+00 volume 0.53292E-04 ppm1 8.564 ppm2 2.270 CV 1
OR { 2349}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 65 and name HG2 ))
ASSI { 2353}
(( segid " " and resid 138 and name HN ))
(( segid " " and resid 137 and name HG11))
5.100 3.300 0.900 peak 2353 spectrum 1 weight 0.68264E+00 volume 0.72350E-03 ppm1 8.152 ppm2 0.255 CV 1
ASSI { 2354}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 32 and name HN ))
3.800 1.800 1.800 peak 2354 spectrum 1 weight 0.71299E+00 volume 0.14709E-02 ppm1 8.095 ppm2 9.219 CV 1
ASSI { 2355}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HN ))
1.800 0.400 0.400 peak 2355 spectrum 1 weight 0.86391E+00 volume 0.52462E-01 ppm1 8.095 ppm2 8.235 CV 1
ASSI { 2357}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 27 and name HN ))
3.800 1.800 1.800 peak 2357 spectrum 1 weight 0.70870E+00 volume 0.36106E-02 ppm1 8.095 ppm2 7.978 CV 1
ASSI { 2358}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HN ))
2.300 0.700 0.700 peak 2358 spectrum 1 weight 0.10000E+01 volume 0.17296E-01 ppm1 8.094 ppm2 7.465 CV 1
ASSI { 2360}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
2.900 1.100 1.100 peak 2360 spectrum 1 weight 0.10000E+01 volume 0.74702E-02 ppm1 8.095 ppm2 4.397 CV 1
ASSI { 2361}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 27 and name HA ))
3.500 1.500 1.500 peak 2361 spectrum 1 weight 0.96414E+00 volume 0.50823E-02 ppm1 8.094 ppm2 4.193 CV 1
ASSI { 2362}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 28 and name HA ))
4.000 2.000 2.000 peak 2362 spectrum 1 weight 0.79000E+00 volume 0.28259E-02 ppm1 8.096 ppm2 3.998 CV 1
ASSI { 2367}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 29 and name HB% )
3.300 1.400 1.400 peak 2367 spectrum 1 weight 0.86391E+00 volume 0.11783E-01 ppm1 8.095 ppm2 1.423 CV 1
ASSI { 2368}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HB2 ))
4.700 2.800 1.300 peak 2368 spectrum 1 weight 0.74888E+00 volume 0.21564E-02 ppm1 8.091 ppm2 2.099 CV 1
OR { 2368}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 32 and name HB2 ))
OR { 2368}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 32 and name HB1 ))
ASSI { 2370}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 22 and name HN ))
6.000 6.000 0.000 peak 2370 spectrum 1 weight 0.52776E+00 volume 0.53256E-04 ppm1 7.582 ppm2 8.808 CV 1
ASSI { 2373}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 83 and name HN ))
5.200 3.400 0.800 peak 2373 spectrum 1 weight 0.67603E+00 volume 0.77651E-03 ppm1 7.141 ppm2 8.975 CV 1
ASSI { 2374}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 80 and name HN ))
5.400 3.600 0.600 peak 2374 spectrum 1 weight 0.68222E+00 volume 0.71058E-03 ppm1 7.141 ppm2 8.504 CV 1
ASSI { 2375}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HN ))
2.500 0.800 0.800 peak 2375 spectrum 1 weight 0.10000E+01 volume 0.13999E-01 ppm1 7.140 ppm2 7.764 CV 1
ASSI { 2376}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 84 and name HN ))
5.200 3.300 0.800 peak 2376 spectrum 1 weight 0.69932E+00 volume 0.11651E-02 ppm1 7.144 ppm2 7.423 CV 1
ASSI { 2382}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 5 and name HA ))
4.900 3.000 1.100 peak 2382 spectrum 1 weight 0.70033E+00 volume 0.19039E-02 ppm1 7.139 ppm2 4.740 CV 1
ASSI { 2386}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 79 and name HA ))
3.100 1.200 1.200 peak 2386 spectrum 1 weight 0.85766E+00 volume 0.47397E-02 ppm1 7.140 ppm2 3.762 CV 1
ASSI { 2389}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HG1 ))
4.600 2.600 1.400 peak 2389 spectrum 1 weight 0.87940E+00 volume 0.40643E-02 ppm1 7.139 ppm2 2.266 CV 1
OR { 2389}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HG2 ))
ASSI { 2394}
(( segid " " and resid 82 and name HN ))
( segid " " and resid 5 and name HD1%)
3.500 1.500 1.500 peak 2394 spectrum 1 weight 0.75960E+00 volume 0.23399E-02 ppm1 7.142 ppm2 0.539 CV 1
ASSI { 2398}
(( segid " " and resid 139 and name HN ))
(( segid " " and resid 137 and name HN ))
4.800 2.900 1.200 peak 2398 spectrum 1 weight 0.67575E+00 volume 0.49667E-03 ppm1 8.726 ppm2 7.356 CV 1
ASSI { 2401}
(( segid " " and resid 138 and name HN ))
(( segid " " and resid 139 and name HN ))
3.000 1.200 1.200 peak 2401 spectrum 1 weight 0.87826E+00 volume 0.40498E-02 ppm1 8.150 ppm2 8.721 CV 1
ASSI { 2403}
(( segid " " and resid 138 and name HN ))
(( segid " " and resid 137 and name HN ))
2.600 0.900 0.900 peak 2403 spectrum 1 weight 0.10000E+01 volume 0.69486E-02 ppm1 8.148 ppm2 7.350 CV 1
ASSI { 2414}
(( segid " " and resid 138 and name HN ))
(( segid " " and resid 136 and name HN ))
6.000 6.000 0.000 peak 2414 spectrum 1 weight 0.59004E+00 volume 0.51076E-04 ppm1 8.143 ppm2 8.381 CV 1
ASSI { 2417}
(( segid " " and resid 137 and name HN ))
(( segid " " and resid 136 and name HN ))
2.900 1.100 1.100 peak 2417 spectrum 1 weight 0.88991E+00 volume 0.41970E-02 ppm1 7.351 ppm2 8.379 CV 1
ASSI { 2418}
(( segid " " and resid 137 and name HN ))
(( segid " " and resid 138 and name HN ))
2.700 0.900 0.900 peak 2418 spectrum 1 weight 0.10000E+01 volume 0.55524E-02 ppm1 7.350 ppm2 8.154 CV 1
ASSI { 2436}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 38 and name HD21))
5.400 3.600 0.600 peak 2436 spectrum 1 weight 0.61815E+00 volume 0.37737E-03 ppm1 7.141 ppm2 7.576 CV 1
ASSI { 2441}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HN ))
2.700 0.900 0.900 peak 2441 spectrum 1 weight 0.10000E+01 volume 0.67536E-02 ppm1 6.544 ppm2 7.726 CV 1
ASSI { 2450}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HD2 ))
3.400 1.400 1.400 peak 2450 spectrum 1 weight 0.71223E+00 volume 0.14548E-02 ppm1 6.540 ppm2 3.130 CV 1
ASSI { 2456}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HA ))
6.000 6.000 0.000 peak 2456 spectrum 1 weight 0.57195E+00 volume 0.15512E-03 ppm1 6.550 ppm2 3.310 CV 1
OR { 2456}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 20 and name HB1 ))
ASSI { 2457}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 59 and name HD2%)
6.000 5.600 0.000 peak 2457 spectrum 1 weight 0.55989E+00 volume 0.31958E-03 ppm1 6.541 ppm2 0.483 CV 1
ASSI { 2467}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HA ))
2.200 0.600 0.600 peak 2467 spectrum 1 weight 0.92308E+00 volume 0.31405E-01 ppm1 8.577 ppm2 3.918 CV 1
ASSI { 2480}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 106 and name HN ))
2.600 0.900 0.900 peak 2480 spectrum 1 weight 0.10000E+01 volume 0.99473E-02 ppm1 8.591 ppm2 7.820 CV 1
ASSI { 2482}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 107 and name HN ))
4.800 2.900 1.200 peak 2482 spectrum 1 weight 0.74374E+00 volume 0.20656E-02 ppm1 8.588 ppm2 7.143 CV 1
ASSI { 2485}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 104 and name HB2 ))
3.400 1.400 1.400 peak 2485 spectrum 1 weight 0.92308E+00 volume 0.84284E-02 ppm1 8.588 ppm2 2.040 CV 1
ASSI { 2494}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HB1 ))
5.600 4.000 0.400 peak 2494 spectrum 1 weight 0.68243E+00 volume 0.71696E-03 ppm1 8.054 ppm2 2.494 CV 1
OR { 2494}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HB2 ))
ASSI { 2501}
(( segid " " and resid 128 and name HN ))
(( segid " " and resid 125 and name HB2 ))
5.500 3.800 0.500 peak 2501 spectrum 1 weight 0.53810E+00 volume 0.12603E-02 ppm1 8.006 ppm2 1.001 CV 1
ASSI { 2502}
(( segid " " and resid 128 and name HN ))
(( segid " " and resid 125 and name HA ))
3.500 1.500 1.500 peak 2502 spectrum 1 weight 0.10000E+01 volume 0.59935E-02 ppm1 7.987 ppm2 4.912 CV 1
ASSI { 2503}
(( segid " " and resid 128 and name HN ))
(( segid " " and resid 125 and name HB2 ))
6.000 5.000 0.000 peak 2503 spectrum 1 weight 0.60845E+00 volume 0.80375E-03 ppm1 7.987 ppm2 1.029 CV 1
ASSI { 2504}
(( segid " " and resid 128 and name HN ))
(( segid " " and resid 129 and name HN ))
2.600 0.900 0.900 peak 2504 spectrum 1 weight 0.95891E+00 volume 0.50225E-02 ppm1 7.984 ppm2 8.326 CV 1
ASSI { 2508}
(( segid " " and resid 128 and name HN ))
(( segid " " and resid 127 and name HB2 ))
3.900 1.900 1.900 peak 2508 spectrum 1 weight 0.82101E+00 volume 0.32816E-02 ppm1 7.984 ppm2 3.197 CV 1
ASSI { 2509}
(( segid " " and resid 128 and name HN ))
(( segid " " and resid 127 and name HB1 ))
2.600 0.900 0.900 peak 2509 spectrum 1 weight 0.10000E+01 volume 0.58656E-02 ppm1 7.984 ppm2 2.892 CV 1
ASSI { 2515}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
2.000 0.500 0.500 peak 2515 spectrum 1 weight 0.10000E+01 volume 0.80566E-02 ppm1 8.049 ppm2 6.920 CV 1
ASSI { 2519}
(( segid " " and resid 128 and name HN ))
(( segid " " and resid 127 and name HN ))
2.500 0.800 0.800 peak 2519 spectrum 1 weight 0.10000E+01 volume 0.10886E-01 ppm1 7.983 ppm2 7.082 CV 1
ASSI { 2528}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
2.600 0.800 0.800 peak 2528 spectrum 1 weight 0.84104E+00 volume 0.35597E-02 ppm1 9.418 ppm2 8.889 CV 1
ASSI { 2529}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 45 and name HN ))
2.800 1.000 1.000 peak 2529 spectrum 1 weight 0.98916E+00 volume 0.53634E-02 ppm1 9.419 ppm2 8.201 CV 1
ASSI { 2530}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 73 and name HA ))
2.400 0.700 0.700 peak 2530 spectrum 1 weight 0.92308E+00 volume 0.22017E-01 ppm1 9.419 ppm2 4.697 CV 1
ASSI { 2531}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HA ))
3.200 1.300 1.300 peak 2531 spectrum 1 weight 0.10000E+01 volume 0.71355E-02 ppm1 9.419 ppm2 4.504 CV 1
ASSI { 2535}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 73 and name HG2 ))
5.300 3.400 0.700 peak 2535 spectrum 1 weight 0.67931E+00 volume 0.61901E-03 ppm1 9.417 ppm2 1.163 CV 1
ASSI { 2565}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 100 and name HN ))
2.400 0.700 0.700 peak 2565 spectrum 1 weight 0.92308E+00 volume 0.19520E-01 ppm1 7.887 ppm2 7.327 CV 1
ASSI { 2568}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 98 and name HN ))
2.700 0.900 0.900 peak 2568 spectrum 1 weight 0.92308E+00 volume 0.56574E-02 ppm1 7.887 ppm2 4.224 CV 1
ASSI { 2569}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 96 and name HA ))
4.100 2.100 1.900 peak 2569 spectrum 1 weight 0.69063E+00 volume 0.94801E-03 ppm1 7.887 ppm2 3.786 CV 1
ASSI { 2572}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 98 and name HB1 ))
3.100 1.200 1.200 peak 2572 spectrum 1 weight 0.92308E+00 volume 0.94082E-02 ppm1 7.887 ppm2 1.838 CV 1
ASSI { 2585}
(( segid " " and resid 116 and name HN ))
(( segid " " and resid 117 and name HN ))
3.200 1.300 1.300 peak 2585 spectrum 1 weight 0.76661E+00 volume 0.24561E-02 ppm1 8.230 ppm2 7.679 CV 1
ASSI { 2599}
(( segid " " and resid 134 and name HN ))
(( segid " " and resid 132 and name HN ))
6.000 4.900 0.000 peak 2599 spectrum 1 weight 0.59108E+00 volume 0.13825E-03 ppm1 7.058 ppm2 8.283 CV 1
ASSI { 2600}
(( segid " " and resid 134 and name HN ))
(( segid " " and resid 135 and name HN ))
2.800 1.000 1.000 peak 2600 spectrum 1 weight 0.92308E+00 volume 0.64385E-02 ppm1 7.057 ppm2 7.764 CV 1
ASSI { 2601}
(( segid " " and resid 134 and name HN ))
(( segid " " and resid 133 and name HN ))
2.700 0.900 0.900 peak 2601 spectrum 1 weight 0.92308E+00 volume 0.70530E-02 ppm1 7.056 ppm2 7.671 CV 1
ASSI { 2627}
(( segid " " and resid 116 and name HN ))
(( segid " " and resid 117 and name HA ))
4.300 2.300 1.700 peak 2627 spectrum 1 weight 0.66277E+00 volume 0.19926E-02 ppm1 8.227 ppm2 4.563 CV 1
ASSI { 2632}
(( segid " " and resid 150 and name HN ))
(( segid " " and resid 149 and name HN ))
2.600 0.800 0.800 peak 2632 spectrum 1 weight 0.10000E+01 volume 0.12026E-01 ppm1 8.059 ppm2 8.651 CV 1
ASSI { 2636}
(( segid " " and resid 150 and name HN ))
(( segid " " and resid 148 and name HN ))
6.000 6.000 0.000 peak 2636 spectrum 1 weight 0.53061E+00 volume 0.13156E-04 ppm1 8.059 ppm2 7.648 CV 1
ASSI { 2637}
(( segid " " and resid 150 and name HN ))
(( segid " " and resid 151 and name HN ))
2.700 0.900 0.900 peak 2637 spectrum 1 weight 0.10000E+01 volume 0.13144E-01 ppm1 8.060 ppm2 7.455 CV 1
ASSI { 2643}
(( segid " " and resid 150 and name HN ))
(( segid " " and resid 147 and name HA ))
3.100 1.200 1.200 peak 2643 spectrum 1 weight 0.92308E+00 volume 0.61495E-02 ppm1 8.060 ppm2 3.523 CV 1
ASSI { 2666}
(( segid " " and resid 134 and name HN ))
(( segid " " and resid 136 and name HN ))
6.000 4.500 0.000 peak 2666 spectrum 1 weight 0.46263E+00 volume 0.21208E-03 ppm1 7.063 ppm2 8.423 CV 1
ASSI { 2838}
(( segid " " and resid 121 and name HN ))
(( segid " " and resid 120 and name HN ))
3.000 1.100 1.100 peak 2838 spectrum 1 weight 0.10000E+01 volume 0.10638E-01 ppm1 7.661 ppm2 9.031 CV 1
ASSI { 2839}
(( segid " " and resid 121 and name HN ))
(( segid " " and resid 122 and name HN ))
4.100 2.100 1.900 peak 2839 spectrum 1 weight 0.74106E+00 volume 0.20173E-02 ppm1 7.659 ppm2 8.009 CV 1
ASSI { 2842}
(( segid " " and resid 121 and name HN ))
(( segid " " and resid 120 and name HA ))
2.300 0.700 0.700 peak 2842 spectrum 1 weight 0.86391E+00 volume 0.35510E-01 ppm1 7.661 ppm2 4.643 CV 1
ASSI { 2849}
(( segid " " and resid 114 and name HN ))
(( segid " " and resid 113 and name HN ))
2.500 0.800 0.800 peak 2849 spectrum 1 weight 0.10000E+01 volume 0.14682E-01 ppm1 7.587 ppm2 7.922 CV 1
ASSI { 2850}
(( segid " " and resid 114 and name HN ))
(( segid " " and resid 112 and name HN ))
3.900 1.900 1.900 peak 2850 spectrum 1 weight 0.92308E+00 volume 0.62763E-02 ppm1 7.591 ppm2 7.726 CV 1
ASSI { 2852}
(( segid " " and resid 114 and name HN ))
(( segid " " and resid 113 and name HA ))
2.700 0.900 0.900 peak 2852 spectrum 1 weight 0.86391E+00 volume 0.20409E-01 ppm1 7.588 ppm2 4.315 CV 1
OR { 2852}
(( segid " " and resid 114 and name HN ))
(( segid " " and resid 112 and name HA ))
ASSI { 2854}
(( segid " " and resid 114 and name HN ))
(( segid " " and resid 113 and name HB1 ))
4.100 2.200 1.900 peak 2854 spectrum 1 weight 0.73611E+00 volume 0.31675E-02 ppm1 7.589 ppm2 3.598 CV 1
ASSI { 2857}
(( segid " " and resid 114 and name HN ))
(( segid " " and resid 113 and name HB2 ))
3.600 1.600 1.600 peak 2857 spectrum 1 weight 0.79635E+00 volume 0.39858E-02 ppm1 7.587 ppm2 3.048 CV 1
ASSI { 2875}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 74 and name HD1%)
5.300 3.600 0.700 peak 2875 spectrum 1 weight 0.69847E+00 volume 0.11448E-02 ppm1 6.311 ppm2 0.309 CV 1
ASSI { 2876}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 78 and name HN ))
4.900 3.000 1.100 peak 2876 spectrum 1 weight 0.67651E+00 volume 0.52389E-03 ppm1 6.307 ppm2 7.411 CV 1
ASSI { 2878}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 145 and name HN ))
5.200 3.400 0.800 peak 2878 spectrum 1 weight 0.67438E+00 volume 0.44515E-03 ppm1 8.753 ppm2 9.104 CV 1
ASSI { 2884}
(( segid " " and resid 121 and name HN ))
( segid " " and resid 127 and name HE% )
5.100 3.200 0.900 peak 2884 spectrum 1 weight 0.69793E+00 volume 0.11915E-02 ppm1 7.662 ppm2 7.029 CV 1
OR { 2884}
(( segid " " and resid 121 and name HN ))
(( segid " " and resid 127 and name HN ))
ASSI { 2898}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 78 and name HD1%)
3.200 1.200 1.200 peak 2898 spectrum 1 weight 0.92308E+00 volume 0.15005E-01 ppm1 6.310 ppm2 0.857 CV 1
OR { 2898}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 78 and name HG ))
ASSI { 2900}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HA ))
2.200 0.600 0.600 peak 2900 spectrum 1 weight 0.10000E+01 volume 0.13920E-01 ppm1 6.309 ppm2 3.677 CV 1
ASSI { 2906}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 144 and name HN ))
5.400 3.600 0.600 peak 2906 spectrum 1 weight 0.67599E+00 volume 0.50517E-03 ppm1 8.750 ppm2 7.913 CV 1
ASSI { 2907}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 143 and name HN ))
2.500 0.800 0.800 peak 2907 spectrum 1 weight 0.10000E+01 volume 0.13272E-01 ppm1 8.750 ppm2 6.969 CV 1
ASSI { 2910}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 139 and name HA ))
3.800 1.800 1.800 peak 2910 spectrum 1 weight 0.75066E+00 volume 0.21873E-02 ppm1 8.749 ppm2 3.579 CV 1
ASSI { 2912}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 22 and name HG2 ))
6.000 5.100 0.000 peak 2912 spectrum 1 weight 0.67100E+00 volume 0.30324E-03 ppm1 8.747 ppm2 2.505 CV 1
OR { 2912}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 22 and name HG1 ))
ASSI { 2920}
(( segid " " and resid 142 and name HN ))
( segid " " and resid 21 and name HD1%)
5.400 3.600 0.600 peak 2920 spectrum 1 weight 0.61069E+00 volume 0.86659E-03 ppm1 8.748 ppm2 0.517 CV 1
OR { 2920}
(( segid " " and resid 142 and name HN ))
( segid " " and resid 145 and name HD1%)
ASSI { 2988}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HA1 ))
2.700 0.900 0.900 peak 2988 spectrum 1 weight 0.10000E+01 volume 0.10059E-01 ppm1 8.942 ppm2 5.300 CV 1
ASSI { 2989}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 9 and name HA ))
2.600 0.900 0.900 peak 2989 spectrum 1 weight 0.92308E+00 volume 0.99789E-02 ppm1 8.943 ppm2 4.806 CV 1
ASSI { 2996}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HN ))
4.800 2.900 1.200 peak 2996 spectrum 1 weight 0.66436E+00 volume 0.20214E-02 ppm1 8.939 ppm2 8.739 CV 1
ASSI { 2997}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 2997 spectrum 1 weight 0.67110E+00 volume 0.30785E-03 ppm1 8.937 ppm2 7.911 CV 1
ASSI { 2998}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HA ))
4.800 2.900 1.200 peak 2998 spectrum 1 weight 0.67095E+00 volume 0.21387E-02 ppm1 8.940 ppm2 4.500 CV 1
ASSI { 3008}
(( segid " " and resid 118 and name HD21))
(( segid " " and resid 90 and name HD22))
4.400 2.400 1.600 peak 3008 spectrum 1 weight 0.68456E+00 volume 0.78025E-03 ppm1 7.332 ppm2 7.463 CV 1
ASSI { 3070}
(( segid " " and resid 130 and name HD21))
(( segid " " and resid 124 and name HA ))
6.000 6.000 0.000 peak 3070 spectrum 1 weight 0.57348E+00 volume 0.73254E-04 ppm1 7.703 ppm2 4.696 CV 1
ASSI { 3071}
(( segid " " and resid 130 and name HD21))
(( segid " " and resid 57 and name HD21))
6.000 5.600 0.000 peak 3071 spectrum 1 weight 0.52875E+00 volume 0.30941E-03 ppm1 7.691 ppm2 7.563 CV 1
ASSI { 3081}
(( segid " " and resid 38 and name HD22))
(( segid " " and resid 84 and name HN ))
6.000 6.000 0.000 peak 3081 spectrum 1 weight 0.40949E+00 volume 0.57903E-04 ppm1 6.946 ppm2 7.434 CV 1
OR { 3081}
(( segid " " and resid 38 and name HD22))
(( segid " " and resid 78 and name HN ))
ASSI { 3093}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 49 and name HB1 ))
6.000 6.000 0.000 peak 3093 spectrum 1 weight 0.44612E+00 volume 0.25733E-04 ppm1 8.515 ppm2 2.298 CV 1
ASSI { 3095}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 49 and name HN ))
2.400 0.700 0.700 peak 3095 spectrum 1 weight 0.10000E+01 volume 0.66657E-02 ppm1 8.507 ppm2 8.223 CV 1
ASSI { 3098}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HA ))
1.900 0.400 0.400 peak 3098 spectrum 1 weight 0.92308E+00 volume 0.25899E-01 ppm1 8.507 ppm2 3.922 CV 1
ASSI { 3107}
(( segid " " and resid 144 and name HD22))
(( segid " " and resid 114 and name HA ))
4.400 2.400 1.600 peak 3107 spectrum 1 weight 0.67103E+00 volume 0.30446E-03 ppm1 8.017 ppm2 4.955 CV 1
ASSI { 3113}
(( segid " " and resid 38 and name HD21))
( segid " " and resid 5 and name HD2%)
4.900 3.000 1.100 peak 3113 spectrum 1 weight 0.77043E+00 volume 0.27313E-02 ppm1 7.609 ppm2 0.563 CV 1
OR { 3113}
(( segid " " and resid 38 and name HD21))
( segid " " and resid 5 and name HD1%)
ASSI { 3117}
(( segid " " and resid 38 and name HD21))
( segid " " and resid 78 and name HD2%)
4.200 2.300 1.800 peak 3117 spectrum 1 weight 0.76765E+00 volume 0.24732E-02 ppm1 7.607 ppm2 0.783 CV 1
OR { 3117}
(( segid " " and resid 38 and name HD21))
(( segid " " and resid 74 and name HB2 ))
ASSI { 3118}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HN ))
2.200 0.600 0.600 peak 3118 spectrum 1 weight 0.10000E+01 volume 0.13268E-01 ppm1 7.407 ppm2 8.971 CV 1
ASSI { 3120}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 5 and name HN ))
3.900 1.900 1.900 peak 3120 spectrum 1 weight 0.70972E+00 volume 0.14009E-02 ppm1 7.408 ppm2 8.373 CV 1
ASSI { 3137}
(( segid " " and resid 84 and name HN ))
( segid " " and resid 4 and name HG2%)
4.700 2.800 1.300 peak 3137 spectrum 1 weight 0.71123E+00 volume 0.14335E-02 ppm1 7.408 ppm2 0.216 CV 1
ASSI { 3138}
(( segid " " and resid 61 and name HE21))
(( segid " " and resid 63 and name HD22))
5.000 3.200 1.000 peak 3138 spectrum 1 weight 0.68260E+00 volume 0.72222E-03 ppm1 7.274 ppm2 7.412 CV 1
ASSI { 3139}
(( segid " " and resid 61 and name HE21))
(( segid " " and resid 57 and name HD21))
5.700 4.000 0.300 peak 3139 spectrum 1 weight 0.67247E+00 volume 0.36835E-03 ppm1 7.268 ppm2 7.570 CV 1
ASSI { 3141}
(( segid " " and resid 127 and name HN ))
(( segid " " and resid 129 and name HN ))
6.000 5.200 0.000 peak 3141 spectrum 1 weight 0.59066E+00 volume 0.10798E-03 ppm1 7.083 ppm2 8.326 CV 1
ASSI { 3142}
(( segid " " and resid 127 and name HN ))
(( segid " " and resid 128 and name HN ))
2.400 0.700 0.700 peak 3142 spectrum 1 weight 0.10000E+01 volume 0.11772E-01 ppm1 7.082 ppm2 8.004 CV 1
OR { 3142}
(( segid " " and resid 127 and name HN ))
(( segid " " and resid 126 and name HN ))
ASSI { 3148}
(( segid " " and resid 127 and name HN ))
(( segid " " and resid 124 and name HA ))
5.300 3.500 0.700 peak 3148 spectrum 1 weight 0.67158E+00 volume 0.32967E-03 ppm1 7.080 ppm2 4.696 CV 1
ASSI { 3149}
(( segid " " and resid 127 and name HN ))
(( segid " " and resid 126 and name HA ))
6.000 6.000 0.000 peak 3149 spectrum 1 weight 0.59004E+00 volume 0.51148E-04 ppm1 7.078 ppm2 3.644 CV 1
ASSI { 3156}
(( segid " " and resid 38 and name HD22))
( segid " " and resid 5 and name HD2%)
4.000 2.000 2.000 peak 3156 spectrum 1 weight 0.73295E+00 volume 0.20315E-02 ppm1 6.951 ppm2 0.573 CV 1
OR { 3156}
(( segid " " and resid 38 and name HD22))
( segid " " and resid 5 and name HD1%)
ASSI { 3174}
(( segid " " and resid 127 and name HN ))
(( segid " " and resid 124 and name HB2 ))
4.800 2.900 1.200 peak 3174 spectrum 1 weight 0.68730E+00 volume 0.85785E-03 ppm1 7.076 ppm2 3.365 CV 1
ASSI { 3183}
(( segid " " and resid 38 and name HD22))
(( segid " " and resid 84 and name HN ))
6.000 6.000 0.000 peak 3183 spectrum 1 weight 0.49362E+00 volume 0.21783E-03 ppm1 6.948 ppm2 7.440 CV 1
OR { 3183}
(( segid " " and resid 38 and name HD22))
(( segid " " and resid 78 and name HN ))
ASSI { 3188}
(( segid " " and resid 129 and name HN ))
(( segid " " and resid 125 and name HB2 ))
5.700 4.100 0.300 peak 3188 spectrum 1 weight 0.68418E+00 volume 0.76909E-03 ppm1 8.338 ppm2 1.051 CV 1
ASSI { 3191}
(( segid " " and resid 129 and name HN ))
(( segid " " and resid 128 and name HN ))
2.500 0.800 0.800 peak 3191 spectrum 1 weight 0.10000E+01 volume 0.66002E-02 ppm1 8.336 ppm2 7.992 CV 1
ASSI { 3192}
(( segid " " and resid 129 and name HN ))
(( segid " " and resid 130 and name HN ))
2.500 0.800 0.800 peak 3192 spectrum 1 weight 0.10000E+01 volume 0.56272E-02 ppm1 8.335 ppm2 7.730 CV 1
ASSI { 3193}
(( segid " " and resid 129 and name HN ))
(( segid " " and resid 127 and name HN ))
4.100 2.100 1.900 peak 3193 spectrum 1 weight 0.71193E+00 volume 0.14485E-02 ppm1 8.335 ppm2 7.084 CV 1
ASSI { 3194}
(( segid " " and resid 129 and name HN ))
(( segid " " and resid 125 and name HA ))
2.300 0.700 0.700 peak 3194 spectrum 1 weight 0.91914E+00 volume 0.45558E-02 ppm1 8.335 ppm2 4.916 CV 1
ASSI { 3200}
(( segid " " and resid 129 and name HN ))
(( segid " " and resid 124 and name HA ))
4.000 2.000 2.000 peak 3200 spectrum 1 weight 0.67090E+00 volume 0.18043E-02 ppm1 8.340 ppm2 4.690 CV 1
ASSI { 3298}
(( segid " " and resid 111 and name HN ))
(( segid " " and resid 110 and name HN ))
2.700 0.900 0.900 peak 3298 spectrum 1 weight 0.94866E+00 volume 0.49043E-02 ppm1 7.674 ppm2 8.706 CV 1
ASSI { 3302}
(( segid " " and resid 111 and name HN ))
(( segid " " and resid 109 and name HA ))
5.100 3.200 0.900 peak 3302 spectrum 1 weight 0.68094E+00 volume 0.67099E-03 ppm1 7.675 ppm2 4.553 CV 1
ASSI { 3342}
(( segid " " and resid 92 and name HD22))
(( segid " " and resid 9 and name HB2 ))
6.000 5.800 0.000 peak 3342 spectrum 1 weight 0.53088E+00 volume 0.52343E-04 ppm1 8.461 ppm2 1.688 CV 1
ASSI { 3376}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 3 and name HA ))
2.900 1.100 1.100 peak 3376 spectrum 1 weight 0.75909E+00 volume 0.48116E-02 ppm1 8.852 ppm2 5.427 CV 1
ASSI { 3377}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 84 and name HN ))
5.400 3.600 0.600 peak 3377 spectrum 1 weight 0.59239E+00 volume 0.21837E-03 ppm1 8.377 ppm2 7.414 CV 1
ASSI { 3378}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 85 and name HA ))
4.400 2.400 1.600 peak 3378 spectrum 1 weight 0.59602E+00 volume 0.38791E-03 ppm1 8.376 ppm2 5.029 CV 1
ASSI { 3379}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 86 and name HN ))
6.000 5.200 0.000 peak 3379 spectrum 1 weight 0.53179E+00 volume 0.13026E-03 ppm1 8.377 ppm2 9.069 CV 1
ASSI { 3389}
(( segid " " and resid 5 and name HN ))
( segid " " and resid 4 and name HG2%)
3.800 1.800 1.800 peak 3389 spectrum 1 weight 0.66738E+00 volume 0.30281E-02 ppm1 8.376 ppm2 0.223 CV 1
ASSI { 3393}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
5.100 3.300 0.900 peak 3393 spectrum 1 weight 0.53404E+00 volume 0.26141E-03 ppm1 8.900 ppm2 7.350 CV 1
ASSI { 3397}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HB1 ))
4.100 2.100 1.900 peak 3397 spectrum 1 weight 0.57195E+00 volume 0.13645E-02 ppm1 8.904 ppm2 2.132 CV 1
ASSI { 3398}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HB2 ))
5.600 3.900 0.400 peak 3398 spectrum 1 weight 0.59573E+00 volume 0.37604E-03 ppm1 8.903 ppm2 1.683 CV 1
ASSI { 3400}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 13 and name HN ))
3.900 1.900 1.900 peak 3400 spectrum 1 weight 0.53665E+00 volume 0.37990E-03 ppm1 7.582 ppm2 9.045 CV 1
OR { 3400}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HN ))
ASSI { 3405}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 74 and name HN ))
3.500 1.600 1.600 peak 3405 spectrum 1 weight 0.63006E+00 volume 0.13409E-02 ppm1 8.725 ppm2 9.286 CV 1
ASSI { 3406}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HN ))
6.000 6.000 0.000 peak 3406 spectrum 1 weight 0.59116E+00 volume 0.14383E-03 ppm1 8.721 ppm2 8.943 CV 1
OR { 3406}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 11 and name HN ))
ASSI { 3409}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 73 and name HA ))
2.900 1.000 1.000 peak 3409 spectrum 1 weight 0.82634E+00 volume 0.50628E-02 ppm1 8.726 ppm2 4.703 CV 1
ASSI { 3419}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HA ))
2.800 1.000 1.000 peak 3419 spectrum 1 weight 0.86391E+00 volume 0.84024E-02 ppm1 8.244 ppm2 4.413 CV 1
ASSI { 3421}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HB2 ))
3.300 1.400 1.400 peak 3421 spectrum 1 weight 0.81839E+00 volume 0.66780E-02 ppm1 8.244 ppm2 2.500 CV 1
ASSI { 3422}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HB1 ))
3.100 1.200 1.200 peak 3422 spectrum 1 weight 0.81839E+00 volume 0.81530E-02 ppm1 8.245 ppm2 2.331 CV 1
ASSI { 3425}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HA ))
2.300 0.700 0.700 peak 3425 spectrum 1 weight 0.92308E+00 volume 0.14207E-01 ppm1 8.842 ppm2 4.041 CV 1
ASSI { 3431}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 102 and name HN ))
3.000 1.100 1.100 peak 3431 spectrum 1 weight 0.83223E+00 volume 0.44349E-02 ppm1 8.202 ppm2 9.134 CV 1
ASSI { 3432}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 104 and name HN ))
2.400 0.700 0.700 peak 3432 spectrum 1 weight 0.92308E+00 volume 0.11375E-01 ppm1 8.201 ppm2 8.666 CV 1
ASSI { 3434}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 106 and name HN ))
4.900 3.000 1.100 peak 3434 spectrum 1 weight 0.60581E+00 volume 0.72602E-03 ppm1 8.201 ppm2 7.790 CV 1
ASSI { 3440}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 102 and name HB1 ))
4.600 2.600 1.400 peak 3440 spectrum 1 weight 0.61856E+00 volume 0.10720E-02 ppm1 8.199 ppm2 3.058 CV 1
OR { 3440}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 100 and name HB2 ))
ASSI { 3455}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 84 and name HN ))
5.900 4.400 0.100 peak 3455 spectrum 1 weight 0.53640E+00 volume 0.36928E-03 ppm1 10.080 ppm2 7.418 CV 1
ASSI { 3457}
(( segid " " and resid 5 and name HN ))
( segid " " and resid 86 and name HD1%)
4.400 2.400 1.600 peak 3457 spectrum 1 weight 0.52763E+00 volume 0.10915E-02 ppm1 8.377 ppm2 0.444 CV 1
ASSI { 3461}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HN ))
6.000 6.000 0.000 peak 3461 spectrum 1 weight 0.59054E+00 volume 0.97577E-04 ppm1 8.645 ppm2 8.377 CV 1
ASSI { 3464}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 9 and name HN ))
6.000 6.000 0.000 peak 3464 spectrum 1 weight 0.59068E+00 volume 0.10934E-03 ppm1 7.899 ppm2 7.364 CV 1
ASSI { 3465}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 92 and name HD22))
5.500 3.700 0.500 peak 3465 spectrum 1 weight 0.59126E+00 volume 0.15077E-03 ppm1 7.344 ppm2 8.426 CV 1
ASSI { 3466}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 92 and name HD21))
6.000 4.700 0.000 peak 3466 spectrum 1 weight 0.59072E+00 volume 0.11236E-03 ppm1 7.350 ppm2 5.872 CV 1
ASSI { 3468}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HG11))
6.000 4.800 0.000 peak 3468 spectrum 1 weight 0.59108E+00 volume 0.13808E-03 ppm1 9.008 ppm2 0.513 CV 1
ASSI { 3469}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HN ))
4.300 2.300 1.700 peak 3469 spectrum 1 weight 0.50890E+00 volume 0.10522E-02 ppm1 9.005 ppm2 8.858 CV 1
ASSI { 3473}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 18 and name HB% )
6.000 6.000 0.000 peak 3473 spectrum 1 weight 0.59063E+00 volume 0.10514E-03 ppm1 6.545 ppm2 0.118 CV 1
ASSI { 3478}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 18 and name HB% )
6.000 6.000 0.000 peak 3478 spectrum 1 weight 0.59089E+00 volume 0.12516E-03 ppm1 7.574 ppm2 0.115 CV 1
ASSI { 3479}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 22 and name HG1 ))
5.100 3.200 0.900 peak 3479 spectrum 1 weight 0.57488E+00 volume 0.22875E-02 ppm1 7.726 ppm2 2.496 CV 1
OR { 3479}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 22 and name HG2 ))
OR { 3479}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 22 and name HB2 ))
ASSI { 3481}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 20 and name HB2 ))
6.000 4.700 0.000 peak 3481 spectrum 1 weight 0.60324E+00 volume 0.64641E-03 ppm1 8.145 ppm2 2.554 CV 1
ASSI { 3483}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 18 and name HB% )
6.000 6.000 0.000 peak 3483 spectrum 1 weight 0.55550E+00 volume 0.50322E-04 ppm1 8.602 ppm2 0.129 CV 1
ASSI { 3493}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HN ))
5.500 3.800 0.500 peak 3493 spectrum 1 weight 0.59177E+00 volume 0.18235E-03 ppm1 7.546 ppm2 8.855 CV 1
ASSI { 3499}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB1 ))
3.100 1.200 1.200 peak 3499 spectrum 1 weight 0.64918E+00 volume 0.34188E-02 ppm1 8.242 ppm2 2.885 CV 1
ASSI { 3519}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 74 and name HG ))
6.000 6.000 0.000 peak 3519 spectrum 1 weight 0.58781E+00 volume 0.30402E-03 ppm1 8.731 ppm2 0.592 CV 1
OR { 3519}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 5 and name HD2%)
ASSI { 3527}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 7 and name HA ))
6.000 6.000 0.000 peak 3527 spectrum 1 weight 0.52398E+00 volume 0.16939E-03 ppm1 8.938 ppm2 5.478 CV 1
ASSI { 3528}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 47 and name HN ))
6.000 5.400 0.000 peak 3528 spectrum 1 weight 0.59178E+00 volume 0.18321E-03 ppm1 8.202 ppm2 6.931 CV 1
ASSI { 3535}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HN ))
6.000 5.600 0.000 peak 3535 spectrum 1 weight 0.59070E+00 volume 0.11072E-03 ppm1 8.503 ppm2 6.938 CV 1
ASSI { 3536}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 69 and name HA ))
4.900 3.000 1.100 peak 3536 spectrum 1 weight 0.53067E+00 volume 0.13751E-02 ppm1 8.508 ppm2 4.799 CV 1
OR { 3536}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 72 and name HA ))
ASSI { 3541}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HG1 ))
4.800 2.900 1.200 peak 3541 spectrum 1 weight 0.54517E+00 volume 0.17502E-02 ppm1 8.245 ppm2 2.210 CV 1
ASSI { 3548}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HN ))
6.000 6.000 0.000 peak 3548 spectrum 1 weight 0.59046E+00 volume 0.91022E-04 ppm1 8.052 ppm2 8.639 CV 1
ASSI { 3549}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 54 and name HN ))
5.600 3.900 0.400 peak 3549 spectrum 1 weight 0.59199E+00 volume 0.19546E-03 ppm1 7.796 ppm2 -0.730 CV 1
ASSI { 3552}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 60 and name HN ))
6.000 5.000 0.000 peak 3552 spectrum 1 weight 0.59096E+00 volume 0.13008E-03 ppm1 6.931 ppm2 8.306 CV 1
ASSI { 3557}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 57 and name HD21))
6.000 6.000 0.000 peak 3557 spectrum 1 weight 0.59008E+00 volume 0.54877E-04 ppm1 7.926 ppm2 7.527 CV 1
ASSI { 3559}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HN ))
6.000 4.900 0.000 peak 3559 spectrum 1 weight 0.59203E+00 volume 0.19810E-03 ppm1 8.847 ppm2 8.048 CV 1
ASSI { 3560}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HN ))
5.800 4.200 0.200 peak 3560 spectrum 1 weight 0.59131E+00 volume 0.15405E-03 ppm1 8.158 ppm2 8.834 CV 1
ASSI { 3569}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 72 and name HN ))
6.000 6.000 0.000 peak 3569 spectrum 1 weight 0.52295E+00 volume 0.13045E-03 ppm1 8.909 ppm2 9.714 CV 1
ASSI { 3571}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 75 and name HN ))
6.000 6.000 0.000 peak 3571 spectrum 1 weight 0.59157E+00 volume 0.17011E-03 ppm1 9.284 ppm2 6.319 CV 1
ASSI { 3573}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HN ))
6.000 6.000 0.000 peak 3573 spectrum 1 weight 0.59081E+00 volume 0.11908E-03 ppm1 6.317 ppm2 9.309 CV 1
ASSI { 3575}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 100 and name HE% )
4.300 2.300 1.700 peak 3575 spectrum 1 weight 0.55033E+00 volume 0.83349E-03 ppm1 9.466 ppm2 7.020 CV 1
ASSI { 3581}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 74 and name HD1%)
6.000 6.000 0.000 peak 3581 spectrum 1 weight 0.59143E+00 volume 0.16151E-03 ppm1 7.510 ppm2 0.314 CV 1
ASSI { 3582}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 76 and name HN ))
5.000 3.100 1.000 peak 3582 spectrum 1 weight 0.58426E+00 volume 0.98603E-04 ppm1 8.517 ppm2 9.431 CV 1
OR { 3582}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 4 and name HN ))
ASSI { 3588}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 5 and name HN ))
6.000 6.000 0.000 peak 3588 spectrum 1 weight 0.59011E+00 volume 0.58929E-04 ppm1 7.141 ppm2 8.327 CV 1
ASSI { 3590}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 3 and name HA ))
6.000 4.500 0.000 peak 3590 spectrum 1 weight 0.59253E+00 volume 0.22586E-03 ppm1 8.967 ppm2 5.425 CV 1
ASSI { 3591}
(( segid " " and resid 84 and name HN ))
( segid " " and resid 108 and name HD1%)
6.000 6.000 0.000 peak 3591 spectrum 1 weight 0.53186E+00 volume 0.13500E-03 ppm1 7.409 ppm2 1.022 CV 1
OR { 3591}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 86 and name HG11))
ASSI { 3593}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 3 and name HN ))
6.000 5.100 0.000 peak 3593 spectrum 1 weight 0.59232E+00 volume 0.21439E-03 ppm1 7.409 ppm2 10.080 CV 1
ASSI { 3599}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 90 and name HA ))
6.000 5.300 0.000 peak 3599 spectrum 1 weight 0.53345E+00 volume 0.23059E-03 ppm1 7.526 ppm2 4.702 CV 1
OR { 3599}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 92 and name HA ))
ASSI { 3601}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 86 and name HA ))
5.600 4.000 0.400 peak 3601 spectrum 1 weight 0.50496E+00 volume 0.83771E-03 ppm1 7.528 ppm2 5.300 CV 1
ASSI { 3603}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 8 and name HA ))
4.300 2.300 1.700 peak 3603 spectrum 1 weight 0.52920E+00 volume 0.14763E-02 ppm1 8.634 ppm2 5.278 CV 1
OR { 3603}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 86 and name HA ))
ASSI { 3604}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 89 and name HA ))
5.400 3.700 0.600 peak 3604 spectrum 1 weight 0.61104E+00 volume 0.87613E-03 ppm1 8.618 ppm2 5.114 CV 1
ASSI { 3607}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HD22))
6.000 6.000 0.000 peak 3607 spectrum 1 weight 0.59095E+00 volume 0.12915E-03 ppm1 8.623 ppm2 7.435 CV 1
ASSI { 3608}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 93 and name HB2 ))
5.200 3.400 0.800 peak 3608 spectrum 1 weight 0.46250E+00 volume 0.13045E-02 ppm1 9.107 ppm2 3.327 CV 1
OR { 3608}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 93 and name HB1 ))
ASSI { 3613}
(( segid " " and resid 94 and name HN ))
( segid " " and resid 87 and name HG2%)
6.000 6.000 0.000 peak 3613 spectrum 1 weight 0.59145E+00 volume 0.16275E-03 ppm1 8.042 ppm2 1.025 CV 1
ASSI { 3617}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 99 and name HA ))
6.000 6.000 0.000 peak 3617 spectrum 1 weight 0.53238E+00 volume 0.16933E-03 ppm1 7.858 ppm2 4.481 CV 1
ASSI { 3619}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 97 and name HA ))
6.000 5.700 0.000 peak 3619 spectrum 1 weight 0.53149E+00 volume 0.10806E-03 ppm1 7.890 ppm2 4.029 CV 1
ASSI { 3622}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 98 and name HB1 ))
4.100 2.100 1.900 peak 3622 spectrum 1 weight 0.53273E+00 volume 0.19044E-03 ppm1 7.341 ppm2 1.831 CV 1
ASSI { 3633}
(( segid " " and resid 108 and name HN ))
(( segid " " and resid 86 and name HA ))
2.700 0.900 0.900 peak 3633 spectrum 1 weight 0.71233E+00 volume 0.42475E-02 ppm1 9.130 ppm2 5.337 CV 1
ASSI { 3638}
(( segid " " and resid 111 and name HN ))
(( segid " " and resid 88 and name HA ))
6.000 6.000 0.000 peak 3638 spectrum 1 weight 0.58631E+00 volume 0.94571E-04 ppm1 7.672 ppm2 5.033 CV 1
ASSI { 3648}
(( segid " " and resid 121 and name HN ))
(( segid " " and resid 120 and name HB2 ))
3.800 1.800 1.800 peak 3648 spectrum 1 weight 0.65311E+00 volume 0.34732E-02 ppm1 7.660 ppm2 2.572 CV 1
ASSI { 3650}
(( segid " " and resid 122 and name HN ))
(( segid " " and resid 90 and name HN ))
4.400 2.400 1.600 peak 3650 spectrum 1 weight 0.59091E+00 volume 0.12615E-03 ppm1 8.023 ppm2 9.888 CV 1
ASSI { 3653}
(( segid " " and resid 126 and name HN ))
(( segid " " and resid 125 and name HB2 ))
6.000 6.000 0.000 peak 3653 spectrum 1 weight 0.59076E+00 volume 0.11528E-03 ppm1 8.034 ppm2 1.067 CV 1
ASSI { 3654}
(( segid " " and resid 126 and name HN ))
(( segid " " and resid 125 and name HG1 ))
6.000 5.300 0.000 peak 3654 spectrum 1 weight 0.53396E+00 volume 0.25733E-03 ppm1 8.036 ppm2 1.534 CV 1
ASSI { 3655}
(( segid " " and resid 126 and name HN ))
(( segid " " and resid 124 and name HB2 ))
6.000 4.700 0.000 peak 3655 spectrum 1 weight 0.59058E+00 volume 0.10151E-03 ppm1 8.034 ppm2 3.371 CV 1
ASSI { 3656}
(( segid " " and resid 126 and name HN ))
(( segid " " and resid 125 and name HA ))
6.000 4.700 0.000 peak 3656 spectrum 1 weight 0.59022E+00 volume 0.69182E-04 ppm1 8.036 ppm2 4.922 CV 1
ASSI { 3658}
(( segid " " and resid 127 and name HN ))
(( segid " " and resid 125 and name HB1 ))
6.000 6.000 0.000 peak 3658 spectrum 1 weight 0.53115E+00 volume 0.79517E-04 ppm1 7.081 ppm2 -0.011 CV 1
ASSI { 3659}
(( segid " " and resid 127 and name HN ))
(( segid " " and resid 125 and name HA ))
6.000 5.400 0.000 peak 3659 spectrum 1 weight 0.59034E+00 volume 0.80989E-04 ppm1 7.083 ppm2 4.910 CV 1
ASSI { 3660}
(( segid " " and resid 127 and name HN ))
( segid " " and resid 53 and name HD% )
4.800 2.800 1.200 peak 3660 spectrum 1 weight 0.41218E+00 volume 0.78353E-04 ppm1 7.074 ppm2 6.767 CV 1
ASSI { 3661}
(( segid " " and resid 129 and name HN ))
(( segid " " and resid 125 and name HB1 ))
6.000 6.000 0.000 peak 3661 spectrum 1 weight 0.59169E+00 volume 0.17793E-03 ppm1 8.334 ppm2 -0.034 CV 1
ASSI { 3664}
(( segid " " and resid 130 and name HN ))
(( segid " " and resid 131 and name HN ))
6.000 6.000 0.000 peak 3664 spectrum 1 weight 0.59055E+00 volume 0.99203E-04 ppm1 7.728 ppm2 8.765 CV 1
ASSI { 3668}
(( segid " " and resid 130 and name HN ))
(( segid " " and resid 133 and name HA ))
6.000 5.300 0.000 peak 3668 spectrum 1 weight 0.53738E+00 volume 0.40948E-03 ppm1 7.725 ppm2 3.904 CV 1
ASSI { 3672}
(( segid " " and resid 133 and name HN ))
(( segid " " and resid 131 and name HN ))
6.000 6.000 0.000 peak 3672 spectrum 1 weight 0.58999E+00 volume 0.44377E-04 ppm1 7.654 ppm2 8.767 CV 1
ASSI { 3675}
(( segid " " and resid 134 and name HN ))
( segid " " and resid 137 and name HD1%)
6.000 6.000 0.000 peak 3675 spectrum 1 weight 0.59085E+00 volume 0.12201E-03 ppm1 7.056 ppm2 -0.107 CV 1
ASSI { 3677}
(( segid " " and resid 134 and name HN ))
(( segid " " and resid 55 and name HA ))
5.400 3.700 0.600 peak 3677 spectrum 1 weight 0.51670E+00 volume 0.11411E-02 ppm1 7.056 ppm2 3.688 CV 1
ASSI { 3678}
(( segid " " and resid 134 and name HN ))
(( segid " " and resid 139 and name HN ))
6.000 4.600 0.000 peak 3678 spectrum 1 weight 0.59025E+00 volume 0.72803E-04 ppm1 7.055 ppm2 8.749 CV 1
OR { 3678}
(( segid " " and resid 134 and name HN ))
(( segid " " and resid 131 and name HN ))
ASSI { 3679}
(( segid " " and resid 135 and name HN ))
(( segid " " and resid 138 and name HN ))
6.000 5.100 0.000 peak 3679 spectrum 1 weight 0.50586E+00 volume 0.11074E-03 ppm1 7.774 ppm2 8.177 CV 1
ASSI { 3681}
(( segid " " and resid 136 and name HN ))
(( segid " " and resid 137 and name HG11))
6.000 6.000 0.000 peak 3681 spectrum 1 weight 0.59085E+00 volume 0.12181E-03 ppm1 8.384 ppm2 0.272 CV 1
ASSI { 3683}
(( segid " " and resid 136 and name HN ))
(( segid " " and resid 123 and name HB1 ))
5.900 4.400 0.100 peak 3683 spectrum 1 weight 0.59102E+00 volume 0.13427E-03 ppm1 8.384 ppm2 2.354 CV 1
ASSI { 3693}
(( segid " " and resid 139 and name HN ))
(( segid " " and resid 135 and name HN ))
4.600 2.700 1.400 peak 3693 spectrum 1 weight 0.59047E+00 volume 0.91991E-04 ppm1 8.727 ppm2 7.808 CV 1
ASSI { 3695}
(( segid " " and resid 140 and name HN ))
(( segid " " and resid 139 and name HB1 ))
5.600 4.000 0.400 peak 3695 spectrum 1 weight 0.53246E+00 volume 0.17433E-03 ppm1 6.410 ppm2 3.391 CV 1
ASSI { 3697}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 140 and name HN ))
5.400 3.700 0.600 peak 3697 spectrum 1 weight 0.53151E+00 volume 0.29051E-03 ppm1 8.753 ppm2 6.436 CV 1
ASSI { 3702}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 115 and name HD2 ))
5.200 3.300 0.800 peak 3702 spectrum 1 weight 0.53168E+00 volume 0.12196E-03 ppm1 8.748 ppm2 3.426 CV 1
OR { 3702}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 139 and name HB1 ))
OR { 3702}
(( segid " " and resid 142 and name HN ))
(( segid " " and resid 148 and name HB1 ))
ASSI { 3707}
(( segid " " and resid 143 and name HN ))
( segid " " and resid 146 and name HD2%)
6.000 6.000 0.000 peak 3707 spectrum 1 weight 0.59004E+00 volume 0.50271E-04 ppm1 6.968 ppm2 0.505 CV 1
OR { 3707}
(( segid " " and resid 143 and name HN ))
( segid " " and resid 145 and name HD1%)
ASSI { 3723}
(( segid " " and resid 147 and name HN ))
(( segid " " and resid 152 and name HB2 ))
6.000 6.000 0.000 peak 3723 spectrum 1 weight 0.53107E+00 volume 0.71469E-04 ppm1 7.450 ppm2 3.049 CV 1
OR { 3723}
(( segid " " and resid 147 and name HN ))
(( segid " " and resid 152 and name HB1 ))
ASSI { 3724}
(( segid " " and resid 147 and name HN ))
(( segid " " and resid 145 and name HN ))
6.000 6.000 0.000 peak 3724 spectrum 1 weight 0.59015E+00 volume 0.62576E-04 ppm1 7.448 ppm2 9.132 CV 1
ASSI { 3728}
(( segid " " and resid 148 and name HN ))
(( segid " " and resid 145 and name HN ))
6.000 6.000 0.000 peak 3728 spectrum 1 weight 0.58998E+00 volume 0.44008E-04 ppm1 7.704 ppm2 9.131 CV 1
ASSI { 3731}
(( segid " " and resid 149 and name HN ))
(( segid " " and resid 152 and name HN ))
6.000 6.000 0.000 peak 3731 spectrum 1 weight 0.59002E+00 volume 0.48886E-04 ppm1 8.649 ppm2 7.882 CV 1
ASSI { 3738}
(( segid " " and resid 153 and name HN ))
(( segid " " and resid 152 and name HB1 ))
5.300 3.600 0.700 peak 3738 spectrum 1 weight 0.54130E+00 volume 0.55482E-03 ppm1 8.110 ppm2 3.066 CV 1
OR { 3738}
(( segid " " and resid 153 and name HN ))
(( segid " " and resid 152 and name HB2 ))
ASSI { 3746}
(( segid " " and resid 129 and name HN ))
(( segid " " and resid 125 and name HG1 ))
6.000 6.000 0.000 peak 3746 spectrum 1 weight 0.53175E+00 volume 0.12750E-03 ppm1 8.339 ppm2 1.523 CV 1
ASSI { 3750}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 13 and name HA ))
5.200 3.400 0.800 peak 3750 spectrum 1 weight 0.60002E+00 volume 0.53902E-03 ppm1 6.643 ppm2 5.237 CV 1
ASSI { 3754}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 93 and name HA ))
6.000 6.000 0.000 peak 3754 spectrum 1 weight 0.59111E+00 volume 0.14076E-03 ppm1 9.144 ppm2 3.974 CV 1
ASSI { 3755}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 92 and name HB2 ))
6.000 5.000 0.000 peak 3755 spectrum 1 weight 0.59599E+00 volume 0.38695E-03 ppm1 9.140 ppm2 3.257 CV 1
OR { 3755}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 93 and name HB2 ))
OR { 3755}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 93 and name HB1 ))
Contact the webmaster for help, if required. Thursday, May 2, 2024 3:17:46 PM GMT (wattos1)