NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
14650 |
1x3q   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 1}
(( segid " " and resid 29 and name HE1 ))
(( segid " " and resid 29 and name HZ2 ))
3.200 1.300 1.300 peak 1 spectrum 1 weight 0.10000E+01 volume 0.15846E-02 ppm1 10.125 ppm2 6.970 CV 1
ASSI { 3}
(( segid " " and resid 29 and name HE1 ))
(( segid " " and resid 29 and name HD1 ))
2.600 0.800 0.800 peak 3 spectrum 1 weight 0.10000E+01 volume 0.41077E-02 ppm1 10.125 ppm2 7.063 CV 1
ASSI { 4}
(( segid " " and resid 29 and name HE1 ))
(( segid " " and resid 36 and name HB2 ))
3.700 1.700 1.700 peak 4 spectrum 1 weight 0.10000E+01 volume 0.10776E-02 ppm1 10.124 ppm2 2.013 CV 1
ASSI { 6}
(( segid " " and resid 37 and name HE1 ))
(( segid " " and resid 37 and name HZ2 ))
3.000 1.100 1.100 peak 6 spectrum 1 weight 0.10000E+01 volume 0.25025E-02 ppm1 10.069 ppm2 7.287 CV 1
ASSI { 9}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 25 and name HN ))
3.700 1.700 1.700 peak 9 spectrum 1 weight 0.10000E+01 volume 0.82691E-03 ppm1 9.795 ppm2 9.193 CV 1
ASSI { 11}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.700 1.700 1.700 peak 11 spectrum 1 weight 0.10000E+01 volume 0.66745E-03 ppm1 9.798 ppm2 2.816 CV 1
ASSI { 27}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HG2 ))
4.900 3.000 1.100 peak 27 spectrum 1 weight 0.10000E+01 volume 0.49915E-03 ppm1 9.194 ppm2 2.200 CV 1
ASSI { 29}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 36 and name HB2 ))
4.200 2.200 1.800 peak 29 spectrum 1 weight 0.10000E+01 volume 0.55696E-03 ppm1 9.193 ppm2 1.987 CV 1
ASSI { 37}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 29 and name HZ3 ))
4.200 2.200 1.800 peak 37 spectrum 1 weight 0.10000E+01 volume 0.63492E-03 ppm1 9.053 ppm2 7.505 CV 1
ASSI { 38}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HN ))
2.200 0.600 0.600 peak 38 spectrum 1 weight 0.10000E+01 volume 0.17573E-02 ppm1 9.053 ppm2 7.226 CV 1
ASSI { 47}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 28 and name HG1 ))
4.800 2.900 1.200 peak 47 spectrum 1 weight 0.10000E+01 volume 0.40824E-03 ppm1 9.054 ppm2 1.337 CV 1
OR { 47}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 49}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.700 3.700 2.300 peak 49 spectrum 1 weight 0.10000E+01 volume 0.11070E-02 ppm1 9.053 ppm2 0.498 CV 1
ASSI { 51}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HN ))
3.400 1.400 1.400 peak 51 spectrum 1 weight 0.10000E+01 volume 0.56991E-03 ppm1 8.970 ppm2 6.896 CV 1
ASSI { 58}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HN ))
2.700 0.900 0.900 peak 58 spectrum 1 weight 0.10000E+01 volume 0.19244E-02 ppm1 8.913 ppm2 7.223 CV 1
ASSI { 60}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
3.300 1.300 1.300 peak 60 spectrum 1 weight 0.10000E+01 volume 0.79941E-03 ppm1 8.913 ppm2 3.879 CV 1
ASSI { 71}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 9 and name HB2 ))
3.400 3.400 2.600 peak 71 spectrum 1 weight 0.10000E+01 volume 0.21186E-02 ppm1 8.685 ppm2 2.247 CV 1
ASSI { 78}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HB ))
2.700 0.900 0.900 peak 78 spectrum 1 weight 0.10000E+01 volume 0.15812E-02 ppm1 8.491 ppm2 1.837 CV 1
ASSI { 80}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 11 and name HB2 ))
4.000 2.000 2.000 peak 80 spectrum 1 weight 0.10000E+01 volume 0.12885E-02 ppm1 8.568 ppm2 2.134 CV 1
ASSI { 81}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.100 1.200 1.200 peak 81 spectrum 1 weight 0.10000E+01 volume 0.83068E-03 ppm1 8.743 ppm2 2.023 CV 1
ASSI { 83}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 27 and name HB ))
3.700 1.700 1.700 peak 83 spectrum 1 weight 0.10000E+01 volume 0.66146E-03 ppm1 8.727 ppm2 1.224 CV 1
ASSI { 86}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 54 and name HN ))
3.000 1.100 1.100 peak 86 spectrum 1 weight 0.10000E+01 volume 0.93643E-03 ppm1 8.698 ppm2 7.646 CV 1
ASSI { 92}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB2 ))
2.500 0.800 0.800 peak 92 spectrum 1 weight 0.10000E+01 volume 0.45812E-02 ppm1 8.711 ppm2 2.600 CV 1
ASSI { 95}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HA2 ))
2.800 1.000 1.000 peak 95 spectrum 1 weight 0.10000E+01 volume 0.21037E-02 ppm1 8.676 ppm2 3.825 CV 1
ASSI { 97}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HA1 ))
2.300 0.700 0.700 peak 97 spectrum 1 weight 0.10000E+01 volume 0.23200E-02 ppm1 8.677 ppm2 3.705 CV 1
ASSI { 102}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.300 1.400 1.400 peak 102 spectrum 1 weight 0.10000E+01 volume 0.15130E-02 ppm1 8.691 ppm2 2.816 CV 1
ASSI { 103}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB2 ))
3.100 1.200 1.200 peak 103 spectrum 1 weight 0.10000E+01 volume 0.39087E-02 ppm1 8.480 ppm2 2.910 CV 1
ASSI { 105}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB1 ))
2.700 0.900 0.900 peak 105 spectrum 1 weight 0.10000E+01 volume 0.29145E-02 ppm1 8.680 ppm2 1.596 CV 1
OR { 105}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB2 ))
ASSI { 106}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HG2 ))
2.600 0.900 0.900 peak 106 spectrum 1 weight 0.10000E+01 volume 0.25460E-02 ppm1 8.676 ppm2 1.333 CV 1
OR { 106}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 108}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
2.400 0.700 0.700 peak 108 spectrum 1 weight 0.10000E+01 volume 0.17387E-02 ppm1 8.595 ppm2 8.126 CV 1
ASSI { 109}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
3.500 1.600 1.600 peak 109 spectrum 1 weight 0.10000E+01 volume 0.48905E-03 ppm1 8.600 ppm2 7.792 CV 1
ASSI { 115}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HN ))
4.300 2.300 1.700 peak 115 spectrum 1 weight 0.10000E+01 volume 0.72081E-03 ppm1 8.501 ppm2 7.688 CV 1
ASSI { 117}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HN ))
2.700 0.900 0.900 peak 117 spectrum 1 weight 0.10000E+01 volume 0.12468E-02 ppm1 8.479 ppm2 7.470 CV 1
ASSI { 119}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 51 and name HD% )
3.700 1.700 1.700 peak 119 spectrum 1 weight 0.10000E+01 volume 0.16891E-02 ppm1 8.483 ppm2 6.964 CV 1
ASSI { 124}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 53 and name HB2 ))
5.200 3.300 0.800 peak 124 spectrum 1 weight 0.10000E+01 volume 0.45560E-03 ppm1 8.493 ppm2 2.592 CV 1
ASSI { 125}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HG2 ))
3.900 1.900 1.900 peak 125 spectrum 1 weight 0.10000E+01 volume 0.10915E-02 ppm1 8.479 ppm2 2.423 CV 1
ASSI { 126}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HB ))
2.600 0.800 0.800 peak 126 spectrum 1 weight 0.10000E+01 volume 0.22142E-02 ppm1 8.495 ppm2 1.143 CV 1
ASSI { 129}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 25 and name HD% )
3.000 1.100 1.100 peak 129 spectrum 1 weight 0.10000E+01 volume 0.11360E-02 ppm1 8.319 ppm2 6.802 CV 1
ASSI { 135}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HG2 ))
4.300 2.300 1.700 peak 135 spectrum 1 weight 0.10000E+01 volume 0.10198E-02 ppm1 8.135 ppm2 1.333 CV 1
OR { 135}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 139}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HB ))
4.300 2.300 1.700 peak 139 spectrum 1 weight 0.10000E+01 volume 0.46412E-03 ppm1 8.133 ppm2 1.204 CV 1
ASSI { 147}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HB2 ))
3.000 1.100 1.100 peak 147 spectrum 1 weight 0.10000E+01 volume 0.89791E-03 ppm1 8.302 ppm2 2.770 CV 1
ASSI { 154}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 53 and name HB2 ))
4.200 2.200 1.800 peak 154 spectrum 1 weight 0.10000E+01 volume 0.12099E-02 ppm1 8.303 ppm2 2.598 CV 1
ASSI { 157}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HB ))
2.800 1.000 1.000 peak 157 spectrum 1 weight 0.10000E+01 volume 0.19136E-02 ppm1 8.294 ppm2 1.207 CV 1
ASSI { 161}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HN ))
2.700 0.900 0.900 peak 161 spectrum 1 weight 0.10000E+01 volume 0.13033E-02 ppm1 8.271 ppm2 7.893 CV 1
ASSI { 162}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HN ))
2.400 0.700 0.700 peak 162 spectrum 1 weight 0.10000E+01 volume 0.13387E-02 ppm1 8.269 ppm2 7.777 CV 1
ASSI { 166}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HD2 ))
3.800 1.800 1.800 peak 166 spectrum 1 weight 0.10000E+01 volume 0.59200E-03 ppm1 8.074 ppm2 6.986 CV 1
ASSI { 170}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HN ))
3.100 1.200 1.200 peak 170 spectrum 1 weight 0.10000E+01 volume 0.81395E-03 ppm1 8.073 ppm2 7.520 CV 1
ASSI { 186}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 4 and name HA ))
4.200 2.200 1.800 peak 186 spectrum 1 weight 0.10000E+01 volume 0.28656E-03 ppm1 8.022 ppm2 4.063 CV 1
ASSI { 190}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 57 and name HN ))
3.400 1.500 1.500 peak 190 spectrum 1 weight 0.10000E+01 volume 0.70820E-03 ppm1 7.999 ppm2 7.602 CV 1
ASSI { 193}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HB2 ))
3.400 1.400 1.400 peak 193 spectrum 1 weight 0.10000E+01 volume 0.59959E-03 ppm1 7.999 ppm2 1.647 CV 1
ASSI { 196}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 7 and name HD% )
4.200 2.200 1.800 peak 196 spectrum 1 weight 0.10000E+01 volume 0.83256E-03 ppm1 7.956 ppm2 7.177 CV 1
ASSI { 201}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA2 ))
3.800 1.800 1.800 peak 201 spectrum 1 weight 0.10000E+01 volume 0.61506E-03 ppm1 7.930 ppm2 3.896 CV 1
OR { 201}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA1 ))
ASSI { 204}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HB2 ))
2.200 0.600 0.600 peak 204 spectrum 1 weight 0.10000E+01 volume 0.33088E-02 ppm1 7.914 ppm2 2.631 CV 1
ASSI { 206}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HN ))
2.600 0.900 0.900 peak 206 spectrum 1 weight 0.10000E+01 volume 0.89888E-03 ppm1 7.894 ppm2 7.469 CV 1
ASSI { 210}
(( segid " " and resid 42 and name HE1 ))
(( segid " " and resid 42 and name HD2 ))
4.900 3.000 1.100 peak 210 spectrum 1 weight 0.10000E+01 volume 0.62134E-03 ppm1 7.872 ppm2 6.986 CV 1
ASSI { 211}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HN ))
2.700 0.900 0.900 peak 211 spectrum 1 weight 0.10000E+01 volume 0.15452E-02 ppm1 7.793 ppm2 8.068 CV 1
ASSI { 213}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
3.700 1.700 1.700 peak 213 spectrum 1 weight 0.10000E+01 volume 0.43823E-03 ppm1 7.799 ppm2 4.262 CV 1
ASSI { 216}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HA ))
3.700 1.700 1.700 peak 216 spectrum 1 weight 0.10000E+01 volume 0.50959E-03 ppm1 7.775 ppm2 3.569 CV 1
ASSI { 218}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB ))
2.400 0.700 0.700 peak 218 spectrum 1 weight 0.10000E+01 volume 0.25186E-02 ppm1 7.792 ppm2 2.051 CV 1
ASSI { 221}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HN ))
2.800 1.000 1.000 peak 221 spectrum 1 weight 0.10000E+01 volume 0.13362E-02 ppm1 7.782 ppm2 7.173 CV 1
ASSI { 223}
(( segid " " and resid 57 and name HN ))
( segid " " and resid 57 and name HD% )
3.700 1.700 1.700 peak 223 spectrum 1 weight 0.10000E+01 volume 0.60998E-03 ppm1 7.597 ppm2 7.070 CV 1
ASSI { 240}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 25 and name HD% )
2.800 2.800 3.200 peak 240 spectrum 1 weight 0.10000E+01 volume 0.75300E-02 ppm1 7.448 ppm2 6.803 CV 1
ASSI { 242}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB ))
2.900 1.100 1.100 peak 242 spectrum 1 weight 0.10000E+01 volume 0.16891E-02 ppm1 7.524 ppm2 2.076 CV 1
ASSI { 243}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 47 and name HB ))
3.500 1.500 1.500 peak 243 spectrum 1 weight 0.10000E+01 volume 0.11616E-02 ppm1 7.520 ppm2 1.948 CV 1
ASSI { 248}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 51 and name HE% )
4.100 2.100 1.900 peak 248 spectrum 1 weight 0.10000E+01 volume 0.31510E-02 ppm1 7.506 ppm2 6.596 CV 1
ASSI { 252}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 28 and name HD2 ))
4.000 2.000 2.000 peak 252 spectrum 1 weight 0.10000E+01 volume 0.19358E-02 ppm1 7.504 ppm2 3.087 CV 1
ASSI { 253}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 9 and name HB2 ))
3.200 1.200 1.200 peak 253 spectrum 1 weight 0.10000E+01 volume 0.11701E-02 ppm1 7.505 ppm2 2.229 CV 1
ASSI { 255}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 28 and name HG2 ))
3.400 1.500 1.500 peak 255 spectrum 1 weight 0.10000E+01 volume 0.70694E-03 ppm1 7.493 ppm2 1.330 CV 1
OR { 255}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 261}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HB2 ))
2.200 0.600 0.600 peak 261 spectrum 1 weight 0.10000E+01 volume 0.33878E-02 ppm1 7.472 ppm2 2.924 CV 1
ASSI { 262}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 31 and name HB2 ))
4.400 2.400 1.600 peak 262 spectrum 1 weight 0.10000E+01 volume 0.77606E-03 ppm1 7.475 ppm2 2.744 CV 1
ASSI { 264}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HN ))
2.900 1.100 1.100 peak 264 spectrum 1 weight 0.10000E+01 volume 0.85659E-03 ppm1 7.319 ppm2 7.649 CV 1
ASSI { 266}
(( segid " " and resid 37 and name HZ2 ))
(( segid " " and resid 37 and name HZ3 ))
5.000 3.200 1.000 peak 266 spectrum 1 weight 0.10000E+01 volume 0.65102E-03 ppm1 7.280 ppm2 6.674 CV 1
ASSI { 267}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 56 and name HN ))
3.400 1.400 1.400 peak 267 spectrum 1 weight 0.10000E+01 volume 0.67567E-03 ppm1 7.314 ppm2 7.993 CV 1
ASSI { 269}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HA2 ))
4.500 2.500 1.500 peak 269 spectrum 1 weight 0.10000E+01 volume 0.44391E-03 ppm1 7.307 ppm2 3.991 CV 1
ASSI { 271}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA ))
2.900 1.100 1.100 peak 271 spectrum 1 weight 0.10000E+01 volume 0.17915E-02 ppm1 7.179 ppm2 4.600 CV 1
ASSI { 274}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HB2 ))
2.900 1.100 1.100 peak 274 spectrum 1 weight 0.10000E+01 volume 0.18581E-02 ppm1 7.313 ppm2 1.647 CV 1
ASSI { 284}
( segid " " and resid 7 and name HD% )
(( segid " " and resid 9 and name HB2 ))
3.800 1.800 1.800 peak 284 spectrum 1 weight 0.10000E+01 volume 0.14324E-02 ppm1 7.180 ppm2 2.230 CV 1
ASSI { 285}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB ))
2.200 0.600 0.600 peak 285 spectrum 1 weight 0.10000E+01 volume 0.34257E-02 ppm1 7.175 ppm2 1.932 CV 1
ASSI { 286}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HG2 ))
2.300 0.700 0.700 peak 286 spectrum 1 weight 0.10000E+01 volume 0.26095E-02 ppm1 7.226 ppm2 2.387 CV 1
ASSI { 287}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HB2 ))
2.200 0.600 0.600 peak 287 spectrum 1 weight 0.10000E+01 volume 0.13794E-02 ppm1 7.219 ppm2 2.147 CV 1
ASSI { 288}
( segid " " and resid 7 and name HD% )
(( segid " " and resid 9 and name HG2 ))
3.600 1.600 1.600 peak 288 spectrum 1 weight 0.10000E+01 volume 0.10924E-02 ppm1 7.179 ppm2 2.332 CV 1
ASSI { 297}
(( segid " " and resid 37 and name HD1 ))
(( segid " " and resid 37 and name HE1 ))
2.500 0.800 0.800 peak 297 spectrum 1 weight 0.10000E+01 volume 0.57494E-02 ppm1 7.165 ppm2 10.066 CV 1
ASSI { 298}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HN ))
2.500 0.800 0.800 peak 298 spectrum 1 weight 0.10000E+01 volume 0.21252E-02 ppm1 7.165 ppm2 8.723 CV 1
ASSI { 302}
( segid " " and resid 7 and name HD% )
( segid " " and resid 7 and name HE% )
2.000 0.500 0.500 peak 302 spectrum 1 weight 0.10000E+01 volume 0.14173E-01 ppm1 7.175 ppm2 6.726 CV 1
ASSI { 303}
(( segid " " and resid 37 and name HD1 ))
(( segid " " and resid 42 and name HB2 ))
3.300 3.300 2.700 peak 303 spectrum 1 weight 0.10000E+01 volume 0.16598E-02 ppm1 7.184 ppm2 3.438 CV 1
ASSI { 304}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
2.800 1.000 1.000 peak 304 spectrum 1 weight 0.10000E+01 volume 0.12377E-02 ppm1 7.174 ppm2 3.569 CV 1
ASSI { 309}
( segid " " and resid 7 and name HD% )
(( segid " " and resid 7 and name HB2 ))
2.200 0.600 0.600 peak 309 spectrum 1 weight 0.10000E+01 volume 0.67944E-02 ppm1 7.178 ppm2 2.867 CV 1
ASSI { 315}
( segid " " and resid 51 and name HD% )
( segid " " and resid 51 and name HE% )
1.900 0.500 0.500 peak 315 spectrum 1 weight 0.10000E+01 volume 0.10646E-01 ppm1 6.965 ppm2 6.596 CV 1
ASSI { 317}
(( segid " " and resid 29 and name HD1 ))
(( segid " " and resid 38 and name HA ))
4.100 2.100 1.900 peak 317 spectrum 1 weight 0.10000E+01 volume 0.80699E-03 ppm1 7.066 ppm2 4.685 CV 1
ASSI { 318}
(( segid " " and resid 29 and name HD1 ))
(( segid " " and resid 29 and name HB2 ))
3.800 1.800 1.800 peak 318 spectrum 1 weight 0.10000E+01 volume 0.11111E-02 ppm1 7.064 ppm2 3.491 CV 1
ASSI { 320}
(( segid " " and resid 29 and name HD1 ))
(( segid " " and resid 35 and name HB2 ))
3.600 1.600 1.600 peak 320 spectrum 1 weight 0.10000E+01 volume 0.50988E-03 ppm1 7.064 ppm2 2.765 CV 1
ASSI { 323}
(( segid " " and resid 42 and name HD2 ))
(( segid " " and resid 39 and name HN ))
3.700 1.700 1.700 peak 323 spectrum 1 weight 0.10000E+01 volume 0.52409E-03 ppm1 6.982 ppm2 8.980 CV 1
ASSI { 327}
(( segid " " and resid 42 and name HD2 ))
(( segid " " and resid 42 and name HB2 ))
3.400 1.400 1.400 peak 327 spectrum 1 weight 0.10000E+01 volume 0.55696E-03 ppm1 6.986 ppm2 3.440 CV 1
ASSI { 330}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 52 and name HB2 ))
3.400 1.500 1.500 peak 330 spectrum 1 weight 0.10000E+01 volume 0.13955E-02 ppm1 6.978 ppm2 1.943 CV 1
ASSI { 331}
(( segid " " and resid 42 and name HD2 ))
(( segid " " and resid 39 and name HB2 ))
3.500 1.500 1.500 peak 331 spectrum 1 weight 0.10000E+01 volume 0.58127E-03 ppm1 6.977 ppm2 2.100 CV 1
ASSI { 332}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HB ))
2.500 0.800 0.800 peak 332 spectrum 1 weight 0.10000E+01 volume 0.38140E-02 ppm1 6.897 ppm2 1.716 CV 1
ASSI { 340}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 51 and name HN ))
4.400 2.400 1.600 peak 340 spectrum 1 weight 0.10000E+01 volume 0.97215E-03 ppm1 6.962 ppm2 7.470 CV 1
ASSI { 341}
( segid " " and resid 51 and name HD% )
( segid " " and resid 25 and name HE% )
2.700 0.900 0.900 peak 341 spectrum 1 weight 0.10000E+01 volume 0.24536E-02 ppm1 6.955 ppm2 6.688 CV 1
ASSI { 343}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 52 and name HA ))
3.800 1.800 1.800 peak 343 spectrum 1 weight 0.10000E+01 volume 0.81743E-03 ppm1 6.964 ppm2 3.866 CV 1
ASSI { 352}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.600 1.700 1.700 peak 352 spectrum 1 weight 0.10000E+01 volume 0.13697E-02 ppm1 6.929 ppm2 2.816 CV 1
ASSI { 354}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HN ))
3.100 1.200 1.200 peak 354 spectrum 1 weight 0.10000E+01 volume 0.23411E-02 ppm1 6.893 ppm2 7.927 CV 1
ASSI { 366}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 40 and name HA1 ))
3.200 1.200 1.200 peak 366 spectrum 1 weight 0.10000E+01 volume 0.15916E-02 ppm1 6.801 ppm2 3.710 CV 1
ASSI { 367}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 51 and name HB2 ))
3.900 1.900 1.900 peak 367 spectrum 1 weight 0.10000E+01 volume 0.31794E-03 ppm1 6.799 ppm2 2.936 CV 1
ASSI { 368}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 46 and name HB2 ))
2.700 2.700 3.300 peak 368 spectrum 1 weight 0.10000E+01 volume 0.30550E-02 ppm1 6.802 ppm2 2.702 CV 1
ASSI { 369}
( segid " " and resid 25 and name HE% )
(( segid " " and resid 15 and name HG2 ))
3.500 1.600 1.600 peak 369 spectrum 1 weight 0.10000E+01 volume 0.17223E-02 ppm1 6.721 ppm2 2.398 CV 1
ASSI { 370}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 25 and name HB2 ))
2.500 0.800 0.800 peak 370 spectrum 1 weight 0.10000E+01 volume 0.29767E-02 ppm1 6.801 ppm2 2.293 CV 1
ASSI { 371}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 43 and name HB ))
3.200 1.200 1.200 peak 371 spectrum 1 weight 0.10000E+01 volume 0.11038E-02 ppm1 6.800 ppm2 2.055 CV 1
ASSI { 372}
( segid " " and resid 25 and name HE% )
(( segid " " and resid 43 and name HB ))
3.900 1.900 1.900 peak 372 spectrum 1 weight 0.10000E+01 volume 0.10435E-02 ppm1 6.685 ppm2 2.054 CV 1
ASSI { 374}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 49 and name HB2 ))
3.300 3.300 2.700 peak 374 spectrum 1 weight 0.10000E+01 volume 0.22389E-02 ppm1 6.800 ppm2 1.838 CV 1
ASSI { 377}
( segid " " and resid 7 and name HE% )
(( segid " " and resid 56 and name HB2 ))
3.400 3.400 2.600 peak 377 spectrum 1 weight 0.10000E+01 volume 0.11752E-02 ppm1 6.723 ppm2 1.976 CV 1
ASSI { 379}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 27 and name HB ))
4.000 2.000 2.000 peak 379 spectrum 1 weight 0.10000E+01 volume 0.81144E-03 ppm1 6.802 ppm2 1.217 CV 1
ASSI { 390}
(( segid " " and resid 37 and name HH2 ))
(( segid " " and resid 37 and name HZ2 ))
2.700 0.900 0.900 peak 390 spectrum 1 weight 0.10000E+01 volume 0.52221E-02 ppm1 6.725 ppm2 7.283 CV 1
OR { 390}
(( segid " " and resid 37 and name HZ3 ))
(( segid " " and resid 37 and name HZ2 ))
ASSI { 394}
( segid " " and resid 25 and name HE% )
(( segid " " and resid 26 and name HN ))
4.000 2.000 2.000 peak 394 spectrum 1 weight 0.10000E+01 volume 0.10365E-02 ppm1 6.684 ppm2 8.320 CV 1
ASSI { 415}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 25 and name HD% )
2.900 1.000 1.000 peak 415 spectrum 1 weight 0.10000E+01 volume 0.88119E-03 ppm1 5.642 ppm2 6.803 CV 1
ASSI { 416}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HN ))
2.500 0.800 0.800 peak 416 spectrum 1 weight 0.10000E+01 volume 0.26190E-02 ppm1 5.644 ppm2 9.190 CV 1
ASSI { 417}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HN ))
2.900 1.000 1.000 peak 417 spectrum 1 weight 0.10000E+01 volume 0.67316E-03 ppm1 5.646 ppm2 8.732 CV 1
ASSI { 418}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 26 and name HN ))
3.200 1.300 1.300 peak 418 spectrum 1 weight 0.10000E+01 volume 0.96423E-03 ppm1 5.647 ppm2 8.319 CV 1
ASSI { 420}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 25 and name HE% )
3.000 1.100 1.100 peak 420 spectrum 1 weight 0.10000E+01 volume 0.22098E-02 ppm1 5.644 ppm2 6.674 CV 1
ASSI { 427}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
3.300 1.400 1.400 peak 427 spectrum 1 weight 0.10000E+01 volume 0.78964E-03 ppm1 5.536 ppm2 8.491 CV 1
ASSI { 432}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HN ))
3.400 1.400 1.400 peak 432 spectrum 1 weight 0.10000E+01 volume 0.10473E-02 ppm1 5.305 ppm2 8.382 CV 1
ASSI { 433}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 25 and name HD% )
2.700 0.900 0.900 peak 433 spectrum 1 weight 0.10000E+01 volume 0.24302E-02 ppm1 5.299 ppm2 6.801 CV 1
ASSI { 434}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HN ))
2.800 1.000 1.000 peak 434 spectrum 1 weight 0.10000E+01 volume 0.11524E-02 ppm1 5.301 ppm2 9.194 CV 1
ASSI { 436}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 25 and name HE% )
3.900 1.900 1.900 peak 436 spectrum 1 weight 0.10000E+01 volume 0.15430E-02 ppm1 5.300 ppm2 6.680 CV 1
ASSI { 437}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 16 and name HA ))
4.000 2.000 2.000 peak 437 spectrum 1 weight 0.10000E+01 volume 0.12405E-02 ppm1 5.299 ppm2 5.642 CV 1
ASSI { 439}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
3.100 1.200 1.200 peak 439 spectrum 1 weight 0.10000E+01 volume 0.10201E-02 ppm1 5.300 ppm2 2.295 CV 1
ASSI { 441}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HN ))
2.800 1.000 1.000 peak 441 spectrum 1 weight 0.10000E+01 volume 0.32583E-02 ppm1 4.984 ppm2 9.794 CV 1
ASSI { 442}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 25 and name HN ))
4.700 2.700 1.300 peak 442 spectrum 1 weight 0.10000E+01 volume 0.51056E-03 ppm1 4.980 ppm2 9.203 CV 1
ASSI { 445}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HN ))
2.300 0.700 0.700 peak 445 spectrum 1 weight 0.10000E+01 volume 0.31147E-02 ppm1 4.353 ppm2 8.672 CV 1
ASSI { 447}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 18 and name HN ))
2.500 2.500 3.500 peak 447 spectrum 1 weight 0.10000E+01 volume 0.78867E-02 ppm1 4.778 ppm2 8.299 CV 1
ASSI { 452}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 20 and name HN ))
2.200 2.200 3.800 peak 452 spectrum 1 weight 0.10000E+01 volume 0.29154E-02 ppm1 4.771 ppm2 8.788 CV 1
ASSI { 455}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HN ))
2.500 0.800 0.800 peak 455 spectrum 1 weight 0.10000E+01 volume 0.44802E-02 ppm1 4.713 ppm2 8.493 CV 1
ASSI { 459}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HN ))
3.200 1.300 1.300 peak 459 spectrum 1 weight 0.10000E+01 volume 0.84078E-03 ppm1 4.990 ppm2 8.695 CV 1
ASSI { 460}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 36 and name HN ))
4.000 2.000 2.000 peak 460 spectrum 1 weight 0.10000E+01 volume 0.12348E-02 ppm1 4.987 ppm2 8.290 CV 1
ASSI { 464}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB2 ))
3.000 1.100 1.100 peak 464 spectrum 1 weight 0.10000E+01 volume 0.17450E-02 ppm1 4.985 ppm2 2.816 CV 1
ASSI { 466}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HG2 ))
3.300 1.400 1.400 peak 466 spectrum 1 weight 0.10000E+01 volume 0.14034E-02 ppm1 4.849 ppm2 2.198 CV 1
ASSI { 470}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HN ))
3.100 1.200 1.200 peak 470 spectrum 1 weight 0.10000E+01 volume 0.13750E-02 ppm1 4.900 ppm2 8.071 CV 1
ASSI { 471}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HN ))
3.300 1.400 1.400 peak 471 spectrum 1 weight 0.10000E+01 volume 0.14864E-02 ppm1 4.897 ppm2 7.790 CV 1
ASSI { 477}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB2 ))
3.100 1.200 1.200 peak 477 spectrum 1 weight 0.10000E+01 volume 0.28479E-02 ppm1 4.906 ppm2 3.476 CV 1
ASSI { 478}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB2 ))
3.800 1.800 1.800 peak 478 spectrum 1 weight 0.10000E+01 volume 0.87205E-03 ppm1 4.885 ppm2 3.431 CV 1
ASSI { 480}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 28 and name HD2 ))
3.400 1.400 1.400 peak 480 spectrum 1 weight 0.10000E+01 volume 0.14682E-02 ppm1 4.913 ppm2 3.072 CV 1
ASSI { 488}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 36 and name HB2 ))
3.200 3.200 2.800 peak 488 spectrum 1 weight 0.10000E+01 volume 0.23528E-02 ppm1 4.852 ppm2 2.002 CV 1
ASSI { 492}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 28 and name HG2 ))
4.700 2.800 1.300 peak 492 spectrum 1 weight 0.10000E+01 volume 0.55947E-03 ppm1 4.912 ppm2 1.336 CV 1
OR { 492}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 498}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HN ))
2.600 0.900 0.900 peak 498 spectrum 1 weight 0.10000E+01 volume 0.30585E-02 ppm1 4.689 ppm2 8.980 CV 1
ASSI { 499}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HN ))
3.000 1.100 1.100 peak 499 spectrum 1 weight 0.10000E+01 volume 0.13589E-02 ppm1 4.631 ppm2 9.051 CV 1
ASSI { 500}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 24 and name HN ))
4.000 2.000 2.000 peak 500 spectrum 1 weight 0.10000E+01 volume 0.13961E-02 ppm1 4.779 ppm2 8.970 CV 1
ASSI { 503}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HN ))
2.600 0.900 0.900 peak 503 spectrum 1 weight 0.10000E+01 volume 0.22227E-02 ppm1 4.801 ppm2 6.891 CV 1
ASSI { 505}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 39 and name HA ))
5.100 3.200 0.900 peak 505 spectrum 1 weight 0.10000E+01 volume 0.34825E-03 ppm1 4.850 ppm2 4.352 CV 1
ASSI { 507}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 20 and name HA2 ))
2.300 2.300 3.700 peak 507 spectrum 1 weight 0.10000E+01 volume 0.24608E-02 ppm1 4.769 ppm2 3.895 CV 1
OR { 507}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 20 and name HA1 ))
ASSI { 514}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB2 ))
2.900 1.000 1.000 peak 514 spectrum 1 weight 0.10000E+01 volume 0.30872E-02 ppm1 4.709 ppm2 2.766 CV 1
ASSI { 516}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
2.600 0.800 0.800 peak 516 spectrum 1 weight 0.10000E+01 volume 0.53328E-02 ppm1 4.807 ppm2 2.908 CV 1
ASSI { 518}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 19 and name HN ))
3.000 1.200 1.200 peak 518 spectrum 1 weight 0.10000E+01 volume 0.26888E-02 ppm1 4.774 ppm2 7.799 CV 1
ASSI { 523}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HN ))
2.500 0.800 0.800 peak 523 spectrum 1 weight 0.10000E+01 volume 0.41298E-02 ppm1 4.780 ppm2 7.929 CV 1
ASSI { 525}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 37 and name HZ2 ))
3.600 1.600 1.600 peak 525 spectrum 1 weight 0.10000E+01 volume 0.10962E-02 ppm1 4.779 ppm2 7.293 CV 1
ASSI { 528}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 37 and name HH2 ))
3.700 1.700 1.700 peak 528 spectrum 1 weight 0.10000E+01 volume 0.11931E-02 ppm1 4.777 ppm2 6.726 CV 1
ASSI { 540}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HN ))
3.000 1.100 1.100 peak 540 spectrum 1 weight 0.10000E+01 volume 0.89922E-03 ppm1 4.689 ppm2 9.795 CV 1
ASSI { 543}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 24 and name HA ))
2.800 2.800 3.200 peak 543 spectrum 1 weight 0.10000E+01 volume 0.55788E-02 ppm1 3.813 ppm2 4.863 CV 1
ASSI { 545}
(( segid " " and resid 18 and name HA1 ))
(( segid " " and resid 17 and name HA ))
3.700 1.700 1.700 peak 545 spectrum 1 weight 0.10000E+01 volume 0.21188E-02 ppm1 4.215 ppm2 4.863 CV 1
ASSI { 547}
(( segid " " and resid 18 and name HA1 ))
(( segid " " and resid 37 and name HA ))
3.200 3.200 2.800 peak 547 spectrum 1 weight 0.10000E+01 volume 0.30562E-02 ppm1 4.212 ppm2 4.996 CV 1
ASSI { 551}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.900 1.100 1.100 peak 551 spectrum 1 weight 0.10000E+01 volume 0.31384E-02 ppm1 4.630 ppm2 2.149 CV 1
ASSI { 552}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB ))
2.800 1.000 1.000 peak 552 spectrum 1 weight 0.10000E+01 volume 0.24112E-02 ppm1 4.692 ppm2 2.100 CV 1
ASSI { 553}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HB2 ))
2.700 0.900 0.900 peak 553 spectrum 1 weight 0.10000E+01 volume 0.25729E-02 ppm1 4.535 ppm2 1.730 CV 1
ASSI { 555}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB2 ))
3.200 1.300 1.300 peak 555 spectrum 1 weight 0.10000E+01 volume 0.19326E-02 ppm1 4.467 ppm2 2.006 CV 1
ASSI { 556}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB2 ))
2.800 1.000 1.000 peak 556 spectrum 1 weight 0.10000E+01 volume 0.30651E-02 ppm1 4.580 ppm2 1.907 CV 1
ASSI { 558}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 52 and name HB2 ))
2.600 2.600 3.400 peak 558 spectrum 1 weight 0.10000E+01 volume 0.12995E-02 ppm1 4.464 ppm2 1.938 CV 1
ASSI { 560}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 35 and name HN ))
3.500 3.500 2.500 peak 560 spectrum 1 weight 0.10000E+01 volume 0.17510E-02 ppm1 4.676 ppm2 8.369 CV 1
ASSI { 562}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB2 ))
2.400 0.700 0.700 peak 562 spectrum 1 weight 0.10000E+01 volume 0.35646E-02 ppm1 4.539 ppm2 1.615 CV 1
OR { 562}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB1 ))
ASSI { 566}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 7 and name HD% )
2.800 1.000 1.000 peak 566 spectrum 1 weight 0.10000E+01 volume 0.37919E-02 ppm1 4.531 ppm2 7.175 CV 1
ASSI { 569}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB2 ))
2.900 1.100 1.100 peak 569 spectrum 1 weight 0.10000E+01 volume 0.28820E-02 ppm1 4.574 ppm2 2.737 CV 1
ASSI { 571}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB2 ))
2.800 1.000 1.000 peak 571 spectrum 1 weight 0.10000E+01 volume 0.36972E-02 ppm1 4.526 ppm2 2.230 CV 1
ASSI { 572}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HG2 ))
3.400 1.400 1.400 peak 572 spectrum 1 weight 0.10000E+01 volume 0.33752E-02 ppm1 4.528 ppm2 2.332 CV 1
ASSI { 573}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HG2 ))
3.300 1.400 1.400 peak 573 spectrum 1 weight 0.10000E+01 volume 0.31456E-02 ppm1 4.610 ppm2 2.396 CV 1
ASSI { 574}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HG2 ))
4.100 2.100 1.900 peak 574 spectrum 1 weight 0.10000E+01 volume 0.67567E-03 ppm1 4.467 ppm2 2.282 CV 1
ASSI { 576}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HN ))
3.100 1.200 1.200 peak 576 spectrum 1 weight 0.10000E+01 volume 0.93962E-03 ppm1 4.461 ppm2 8.306 CV 1
ASSI { 577}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HN ))
3.100 1.200 1.200 peak 577 spectrum 1 weight 0.10000E+01 volume 0.18761E-02 ppm1 4.581 ppm2 8.083 CV 1
ASSI { 578}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 4 and name HN ))
3.300 3.300 2.700 peak 578 spectrum 1 weight 0.10000E+01 volume 0.27159E-03 ppm1 4.560 ppm2 8.018 CV 1
ASSI { 586}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 28 and name HG2 ))
2.100 2.100 3.900 peak 586 spectrum 1 weight 0.10000E+01 volume 0.51906E-02 ppm1 4.586 ppm2 1.334 CV 1
OR { 586}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 587}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 5 and name HA ))
3.800 3.800 2.200 peak 587 spectrum 1 weight 0.10000E+01 volume 0.10432E-02 ppm1 4.568 ppm2 5.536 CV 1
ASSI { 588}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HN ))
3.700 1.700 1.700 peak 588 spectrum 1 weight 0.10000E+01 volume 0.39719E-03 ppm1 4.528 ppm2 8.796 CV 1
ASSI { 589}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HN ))
3.100 1.200 1.200 peak 589 spectrum 1 weight 0.10000E+01 volume 0.12244E-02 ppm1 4.536 ppm2 7.812 CV 1
ASSI { 590}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 29 and name HZ3 ))
4.100 2.100 1.900 peak 590 spectrum 1 weight 0.10000E+01 volume 0.61346E-03 ppm1 4.539 ppm2 7.505 CV 1
ASSI { 591}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 7 and name HE% )
5.100 3.300 0.900 peak 591 spectrum 1 weight 0.10000E+01 volume 0.53767E-03 ppm1 4.532 ppm2 6.725 CV 1
ASSI { 595}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 35 and name HN ))
5.600 3.900 0.400 peak 595 spectrum 1 weight 0.10000E+01 volume 0.22736E-03 ppm1 4.478 ppm2 8.385 CV 1
ASSI { 598}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HA1 ))
4.100 2.100 1.900 peak 598 spectrum 1 weight 0.10000E+01 volume 0.18097E-02 ppm1 4.436 ppm2 3.791 CV 1
ASSI { 599}
(( segid " " and resid 32 and name HA1 ))
(( segid " " and resid 32 and name HA2 ))
1.900 0.400 0.400 peak 599 spectrum 1 weight 0.10000E+01 volume 0.68263E-02 ppm1 4.289 ppm2 3.763 CV 1
ASSI { 600}
(( segid " " and resid 18 and name HA1 ))
(( segid " " and resid 18 and name HA2 ))
1.900 0.500 0.500 peak 600 spectrum 1 weight 0.10000E+01 volume 0.51181E-02 ppm1 4.216 ppm2 3.627 CV 1
ASSI { 601}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HA2 ))
5.000 3.200 1.000 peak 601 spectrum 1 weight 0.10000E+01 volume 0.41582E-03 ppm1 4.356 ppm2 3.818 CV 1
ASSI { 603}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HB2 ))
2.500 0.800 0.800 peak 603 spectrum 1 weight 0.10000E+01 volume 0.49031E-02 ppm1 4.330 ppm2 2.713 CV 1
ASSI { 606}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 10 and name HN ))
2.700 2.700 3.300 peak 606 spectrum 1 weight 0.10000E+01 volume 0.79626E-03 ppm1 4.391 ppm2 8.576 CV 1
ASSI { 607}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 11 and name HB2 ))
3.200 1.300 1.300 peak 607 spectrum 1 weight 0.10000E+01 volume 0.30578E-02 ppm1 4.393 ppm2 2.133 CV 1
ASSI { 609}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HB ))
3.200 1.300 1.300 peak 609 spectrum 1 weight 0.10000E+01 volume 0.13371E-02 ppm1 4.277 ppm2 2.048 CV 1
ASSI { 611}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 49 and name HB2 ))
1.900 0.500 0.500 peak 611 spectrum 1 weight 0.10000E+01 volume 0.39971E-02 ppm1 4.332 ppm2 1.817 CV 1
ASSI { 612}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB2 ))
2.600 0.900 0.900 peak 612 spectrum 1 weight 0.10000E+01 volume 0.31368E-02 ppm1 4.360 ppm2 1.771 CV 1
ASSI { 625}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG2 ))
5.400 3.600 0.600 peak 625 spectrum 1 weight 0.10000E+01 volume 0.32394E-03 ppm1 4.254 ppm2 1.345 CV 1
OR { 625}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 626}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 25 and name HN ))
4.100 2.100 1.900 peak 626 spectrum 1 weight 0.10000E+01 volume 0.70312E-03 ppm1 4.356 ppm2 9.191 CV 1
ASSI { 627}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HN ))
3.000 1.100 1.100 peak 627 spectrum 1 weight 0.10000E+01 volume 0.11767E-02 ppm1 4.354 ppm2 8.977 CV 1
ASSI { 628}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 43 and name HN ))
3.600 1.600 1.600 peak 628 spectrum 1 weight 0.10000E+01 volume 0.83667E-03 ppm1 4.126 ppm2 7.802 CV 1
ASSI { 630}
(( segid " " and resid 18 and name HA1 ))
(( segid " " and resid 19 and name HN ))
2.600 0.900 0.900 peak 630 spectrum 1 weight 0.10000E+01 volume 0.30231E-02 ppm1 4.221 ppm2 7.812 CV 1
ASSI { 632}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HN ))
2.800 1.000 1.000 peak 632 spectrum 1 weight 0.10000E+01 volume 0.12686E-02 ppm1 4.357 ppm2 7.228 CV 1
ASSI { 634}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HB ))
4.300 2.300 1.700 peak 634 spectrum 1 weight 0.10000E+01 volume 0.73377E-03 ppm1 4.357 ppm2 1.139 CV 1
ASSI { 636}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 26 and name HB2 ))
3.400 1.400 1.400 peak 636 spectrum 1 weight 0.10000E+01 volume 0.76973E-03 ppm1 4.359 ppm2 0.498 CV 1
ASSI { 639}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 49 and name HN ))
3.500 1.600 1.600 peak 639 spectrum 1 weight 0.10000E+01 volume 0.93552E-03 ppm1 4.326 ppm2 8.265 CV 1
ASSI { 640}
(( segid " " and resid 32 and name HA1 ))
(( segid " " and resid 32 and name HN ))
3.300 1.400 1.400 peak 640 spectrum 1 weight 0.10000E+01 volume 0.12117E-02 ppm1 4.292 ppm2 8.079 CV 1
ASSI { 642}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 4 and name HN ))
3.500 1.500 1.500 peak 642 spectrum 1 weight 0.10000E+01 volume 0.42244E-02 ppm1 4.231 ppm2 8.017 CV 1
ASSI { 643}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HN ))
2.900 1.000 1.000 peak 643 spectrum 1 weight 0.10000E+01 volume 0.37256E-02 ppm1 4.181 ppm2 7.992 CV 1
ASSI { 644}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HN ))
3.300 1.400 1.400 peak 644 spectrum 1 weight 0.10000E+01 volume 0.85973E-03 ppm1 4.220 ppm2 7.954 CV 1
ASSI { 646}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HD% )
2.300 0.700 0.700 peak 646 spectrum 1 weight 0.10000E+01 volume 0.36214E-02 ppm1 4.217 ppm2 6.963 CV 1
ASSI { 649}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB2 ))
3.800 1.800 1.800 peak 649 spectrum 1 weight 0.10000E+01 volume 0.63052E-03 ppm1 4.346 ppm2 2.839 CV 1
ASSI { 650}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HE% )
4.400 2.500 1.600 peak 650 spectrum 1 weight 0.10000E+01 volume 0.10103E-02 ppm1 4.216 ppm2 6.594 CV 1
ASSI { 651}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HN ))
2.600 0.800 0.800 peak 651 spectrum 1 weight 0.10000E+01 volume 0.39087E-02 ppm1 4.276 ppm2 8.597 CV 1
ASSI { 652}
(( segid " " and resid 32 and name HA1 ))
(( segid " " and resid 33 and name HN ))
4.100 2.100 1.900 peak 652 spectrum 1 weight 0.10000E+01 volume 0.78142E-03 ppm1 4.290 ppm2 7.687 CV 1
ASSI { 653}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB2 ))
2.300 0.600 0.600 peak 653 spectrum 1 weight 0.10000E+01 volume 0.51935E-02 ppm1 4.217 ppm2 2.924 CV 1
ASSI { 659}
(( segid " " and resid 18 and name HA1 ))
(( segid " " and resid 24 and name HN ))
4.400 2.400 1.600 peak 659 spectrum 1 weight 0.10000E+01 volume 0.40603E-03 ppm1 4.233 ppm2 8.972 CV 1
ASSI { 664}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 42 and name HN ))
3.300 1.400 1.400 peak 664 spectrum 1 weight 0.10000E+01 volume 0.12172E-02 ppm1 4.126 ppm2 8.066 CV 1
ASSI { 666}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 57 and name HN ))
2.500 0.800 0.800 peak 666 spectrum 1 weight 0.10000E+01 volume 0.37288E-02 ppm1 4.220 ppm2 7.603 CV 1
ASSI { 667}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HN ))
2.900 1.000 1.000 peak 667 spectrum 1 weight 0.10000E+01 volume 0.14337E-02 ppm1 4.216 ppm2 7.469 CV 1
ASSI { 668}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HG2 ))
3.700 1.700 1.700 peak 668 spectrum 1 weight 0.10000E+01 volume 0.91497E-03 ppm1 4.224 ppm2 2.200 CV 1
ASSI { 669}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB2 ))
2.700 0.900 0.900 peak 669 spectrum 1 weight 0.10000E+01 volume 0.18325E-02 ppm1 4.219 ppm2 1.958 CV 1
ASSI { 671}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 4 and name HB ))
1.900 0.400 0.400 peak 671 spectrum 1 weight 0.10000E+01 volume 0.79153E-02 ppm1 4.192 ppm2 1.832 CV 1
ASSI { 672}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HN ))
2.700 0.900 0.900 peak 672 spectrum 1 weight 0.10000E+01 volume 0.22575E-02 ppm1 4.125 ppm2 7.521 CV 1
ASSI { 673}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HN ))
3.000 1.100 1.100 peak 673 spectrum 1 weight 0.10000E+01 volume 0.15360E-02 ppm1 4.176 ppm2 7.310 CV 1
ASSI { 674}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB ))
2.800 1.000 1.000 peak 674 spectrum 1 weight 0.10000E+01 volume 0.34130E-02 ppm1 4.128 ppm2 1.716 CV 1
ASSI { 675}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB2 ))
2.700 0.900 0.900 peak 675 spectrum 1 weight 0.10000E+01 volume 0.28302E-02 ppm1 4.180 ppm2 1.648 CV 1
ASSI { 677}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
2.500 0.800 0.800 peak 677 spectrum 1 weight 0.10000E+01 volume 0.59577E-02 ppm1 4.128 ppm2 8.964 CV 1
ASSI { 679}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 18 and name HN ))
4.500 2.600 1.500 peak 679 spectrum 1 weight 0.10000E+01 volume 0.61786E-03 ppm1 4.116 ppm2 8.290 CV 1
ASSI { 682}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 15 and name HN ))
3.600 1.600 1.600 peak 682 spectrum 1 weight 0.10000E+01 volume 0.12105E-02 ppm1 3.965 ppm2 7.227 CV 1
ASSI { 683}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HN ))
2.900 1.000 1.000 peak 683 spectrum 1 weight 0.10000E+01 volume 0.20747E-02 ppm1 4.130 ppm2 6.890 CV 1
ASSI { 684}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HA ))
3.200 1.300 1.300 peak 684 spectrum 1 weight 0.10000E+01 volume 0.97844E-03 ppm1 4.118 ppm2 4.001 CV 1
ASSI { 685}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB ))
2.500 0.800 0.800 peak 685 spectrum 1 weight 0.10000E+01 volume 0.55348E-02 ppm1 4.124 ppm2 2.076 CV 1
ASSI { 691}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 5 and name HN ))
3.200 1.200 1.200 peak 691 spectrum 1 weight 0.10000E+01 volume 0.23190E-02 ppm1 4.069 ppm2 8.479 CV 1
ASSI { 694}
(( segid " " and resid 33 and name HA2 ))
(( segid " " and resid 33 and name HN ))
2.900 1.100 1.100 peak 694 spectrum 1 weight 0.10000E+01 volume 0.40792E-02 ppm1 3.994 ppm2 7.685 CV 1
ASSI { 696}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HN ))
2.900 1.000 1.000 peak 696 spectrum 1 weight 0.10000E+01 volume 0.12607E-02 ppm1 3.989 ppm2 8.596 CV 1
ASSI { 698}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HN ))
2.800 1.000 1.000 peak 698 spectrum 1 weight 0.10000E+01 volume 0.28173E-02 ppm1 3.961 ppm2 8.715 CV 1
ASSI { 700}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 28 and name HN ))
3.800 1.800 1.800 peak 700 spectrum 1 weight 0.10000E+01 volume 0.74227E-03 ppm1 3.958 ppm2 8.129 CV 1
ASSI { 703}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name HN ))
3.500 1.500 1.500 peak 703 spectrum 1 weight 0.10000E+01 volume 0.13902E-02 ppm1 3.969 ppm2 7.890 CV 1
ASSI { 705}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 28 and name HD2 ))
3.600 1.600 1.600 peak 705 spectrum 1 weight 0.10000E+01 volume 0.84774E-03 ppm1 3.983 ppm2 3.097 CV 1
ASSI { 706}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HB2 ))
2.600 0.900 0.900 peak 706 spectrum 1 weight 0.10000E+01 volume 0.59485E-02 ppm1 3.954 ppm2 2.020 CV 1
ASSI { 708}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB2 ))
2.500 0.800 0.800 peak 708 spectrum 1 weight 0.10000E+01 volume 0.64000E-02 ppm1 3.969 ppm2 1.811 CV 1
ASSI { 709}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 14 and name HN ))
2.500 0.800 0.800 peak 709 spectrum 1 weight 0.10000E+01 volume 0.35393E-02 ppm1 3.960 ppm2 8.912 CV 1
ASSI { 711}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 15 and name HG2 ))
3.400 3.400 2.600 peak 711 spectrum 1 weight 0.10000E+01 volume 0.29350E-02 ppm1 3.963 ppm2 2.377 CV 1
ASSI { 713}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 11 and name HB2 ))
3.000 3.000 3.000 peak 713 spectrum 1 weight 0.10000E+01 volume 0.35046E-02 ppm1 3.966 ppm2 2.145 CV 1
ASSI { 714}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB ))
3.000 1.200 1.200 peak 714 spectrum 1 weight 0.10000E+01 volume 0.18072E-02 ppm1 3.877 ppm2 1.633 CV 1
ASSI { 715}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 28 and name HB2 ))
2.800 2.800 3.200 peak 715 spectrum 1 weight 0.10000E+01 volume 0.38898E-02 ppm1 3.966 ppm2 1.604 CV 1
OR { 715}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 28 and name HB1 ))
ASSI { 717}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB ))
3.300 1.400 1.400 peak 717 spectrum 1 weight 0.10000E+01 volume 0.66209E-03 ppm1 3.961 ppm2 1.144 CV 1
ASSI { 722}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HN ))
3.200 1.300 1.300 peak 722 spectrum 1 weight 0.10000E+01 volume 0.10757E-02 ppm1 3.864 ppm2 8.474 CV 1
ASSI { 723}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 55 and name HN ))
3.400 1.400 1.400 peak 723 spectrum 1 weight 0.10000E+01 volume 0.13520E-02 ppm1 3.802 ppm2 7.310 CV 1
ASSI { 726}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG2 ))
3.800 1.800 1.800 peak 726 spectrum 1 weight 0.10000E+01 volume 0.10517E-02 ppm1 3.864 ppm2 2.419 CV 1
ASSI { 728}
(( segid " " and resid 33 and name HA1 ))
(( segid " " and resid 38 and name HB ))
4.400 2.400 1.600 peak 728 spectrum 1 weight 0.10000E+01 volume 0.71008E-03 ppm1 3.765 ppm2 2.091 CV 1
ASSI { 729}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 43 and name HB ))
3.200 1.200 1.200 peak 729 spectrum 1 weight 0.10000E+01 volume 0.50171E-03 ppm1 3.816 ppm2 2.053 CV 1
ASSI { 734}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HN ))
2.600 0.800 0.800 peak 734 spectrum 1 weight 0.10000E+01 volume 0.29237E-02 ppm1 3.841 ppm2 9.052 CV 1
ASSI { 735}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HN ))
2.900 1.000 1.000 peak 735 spectrum 1 weight 0.10000E+01 volume 0.77640E-03 ppm1 3.839 ppm2 8.588 CV 1
ASSI { 736}
(( segid " " and resid 32 and name HA2 ))
(( segid " " and resid 32 and name HN ))
3.300 1.300 1.300 peak 736 spectrum 1 weight 0.10000E+01 volume 0.13213E-02 ppm1 3.765 ppm2 8.083 CV 1
ASSI { 759}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 50 and name HB2 ))
4.100 2.100 1.900 peak 759 spectrum 1 weight 0.10000E+01 volume 0.81333E-03 ppm1 3.579 ppm2 2.616 CV 1
ASSI { 760}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB ))
2.600 0.900 0.900 peak 760 spectrum 1 weight 0.10000E+01 volume 0.13017E-02 ppm1 3.574 ppm2 1.941 CV 1
ASSI { 762}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 31 and name HN ))
4.300 2.300 1.700 peak 762 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 3.501 ppm2 8.712 CV 1
ASSI { 763}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HZ3 ))
4.300 2.300 1.700 peak 763 spectrum 1 weight 0.10000E+01 volume 0.16396E-02 ppm1 3.498 ppm2 7.504 CV 1
ASSI { 767}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HN ))
2.900 1.100 1.100 peak 767 spectrum 1 weight 0.10000E+01 volume 0.98380E-03 ppm1 3.440 ppm2 8.068 CV 1
ASSI { 775}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 12 and name HG2 ))
3.900 1.900 1.900 peak 775 spectrum 1 weight 0.10000E+01 volume 0.84175E-03 ppm1 3.112 ppm2 1.913 CV 1
ASSI { 776}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 28 and name HG2 ))
2.400 0.700 0.700 peak 776 spectrum 1 weight 0.10000E+01 volume 0.36119E-02 ppm1 3.108 ppm2 1.333 CV 1
OR { 776}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 781}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 25 and name HE% )
2.900 1.000 1.000 peak 781 spectrum 1 weight 0.10000E+01 volume 0.14606E-02 ppm1 2.931 ppm2 6.685 CV 1
ASSI { 782}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 51 and name HE% )
3.700 1.700 1.700 peak 782 spectrum 1 weight 0.10000E+01 volume 0.29565E-02 ppm1 2.926 ppm2 6.596 CV 1
ASSI { 783}
(( segid " " and resid 7 and name HB2 ))
( segid " " and resid 7 and name HE% )
4.600 2.700 1.400 peak 783 spectrum 1 weight 0.10000E+01 volume 0.90458E-03 ppm1 2.865 ppm2 6.724 CV 1
ASSI { 794}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 31 and name HN ))
3.900 1.900 1.900 peak 794 spectrum 1 weight 0.10000E+01 volume 0.10005E-02 ppm1 3.088 ppm2 8.714 CV 1
ASSI { 805}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 51 and name HD% )
2.200 0.600 0.600 peak 805 spectrum 1 weight 0.10000E+01 volume 0.97621E-02 ppm1 2.925 ppm2 6.963 CV 1
ASSI { 808}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 49 and name HB2 ))
2.000 2.000 4.000 peak 808 spectrum 1 weight 0.10000E+01 volume 0.56421E-02 ppm1 2.934 ppm2 1.817 CV 1
ASSI { 819}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HN ))
3.400 1.400 1.400 peak 819 spectrum 1 weight 0.10000E+01 volume 0.25322E-02 ppm1 2.908 ppm2 7.926 CV 1
ASSI { 820}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 8 and name HN ))
3.600 1.600 1.600 peak 820 spectrum 1 weight 0.10000E+01 volume 0.43097E-03 ppm1 2.853 ppm2 7.962 CV 1
ASSI { 823}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 50 and name HB2 ))
2.600 2.600 3.400 peak 823 spectrum 1 weight 0.10000E+01 volume 0.12882E-01 ppm1 2.907 ppm2 2.639 CV 1
ASSI { 831}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HN ))
3.200 1.200 1.200 peak 831 spectrum 1 weight 0.10000E+01 volume 0.18704E-02 ppm1 2.851 ppm2 7.603 CV 1
ASSI { 833}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 57 and name HD% )
3.600 1.600 1.600 peak 833 spectrum 1 weight 0.10000E+01 volume 0.90806E-03 ppm1 2.852 ppm2 7.065 CV 1
ASSI { 843}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 28 and name HB2 ))
2.500 0.800 0.800 peak 843 spectrum 1 weight 0.10000E+01 volume 0.30566E-02 ppm1 2.152 ppm2 1.613 CV 1
OR { 843}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 28 and name HB1 ))
ASSI { 847}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 24 and name HB2 ))
2.700 0.900 0.900 peak 847 spectrum 1 weight 0.10000E+01 volume 0.38930E-02 ppm1 2.199 ppm2 1.726 CV 1
ASSI { 849}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 52 and name HB2 ))
2.800 1.000 1.000 peak 849 spectrum 1 weight 0.10000E+01 volume 0.55822E-02 ppm1 2.413 ppm2 1.940 CV 1
ASSI { 850}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 49 and name HB2 ))
3.200 3.200 2.800 peak 850 spectrum 1 weight 0.10000E+01 volume 0.67219E-02 ppm1 1.957 ppm2 1.802 CV 1
ASSI { 852}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 12 and name HB2 ))
2.600 0.900 0.900 peak 852 spectrum 1 weight 0.10000E+01 volume 0.41329E-02 ppm1 1.932 ppm2 1.776 CV 1
ASSI { 853}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 47 and name HA ))
3.700 1.700 1.700 peak 853 spectrum 1 weight 0.10000E+01 volume 0.86606E-03 ppm1 2.748 ppm2 3.573 CV 1
ASSI { 854}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HN ))
3.000 1.100 1.100 peak 854 spectrum 1 weight 0.10000E+01 volume 0.42308E-02 ppm1 2.768 ppm2 8.494 CV 1
ASSI { 861}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 50 and name HN ))
3.800 1.800 1.800 peak 861 spectrum 1 weight 0.10000E+01 volume 0.21826E-02 ppm1 2.747 ppm2 7.891 CV 1
ASSI { 862}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 51 and name HN ))
4.600 2.700 1.400 peak 862 spectrum 1 weight 0.10000E+01 volume 0.75586E-03 ppm1 2.742 ppm2 7.474 CV 1
ASSI { 869}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 25 and name HE% )
3.200 1.300 1.300 peak 869 spectrum 1 weight 0.10000E+01 volume 0.89951E-03 ppm1 2.702 ppm2 6.685 CV 1
ASSI { 872}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 49 and name HB2 ))
4.400 2.500 1.600 peak 872 spectrum 1 weight 0.10000E+01 volume 0.98066E-03 ppm1 2.711 ppm2 1.822 CV 1
ASSI { 891}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HN ))
2.600 0.800 0.800 peak 891 spectrum 1 weight 0.10000E+01 volume 0.37288E-02 ppm1 2.648 ppm2 8.500 CV 1
ASSI { 899}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 51 and name HN ))
3.300 1.400 1.400 peak 899 spectrum 1 weight 0.10000E+01 volume 0.85470E-03 ppm1 2.621 ppm2 7.471 CV 1
ASSI { 900}
(( segid " " and resid 5 and name HB2 ))
( segid " " and resid 7 and name HE% )
4.100 2.100 1.900 peak 900 spectrum 1 weight 0.10000E+01 volume 0.69302E-03 ppm1 2.612 ppm2 6.730 CV 1
ASSI { 902}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 46 and name HA ))
3.800 1.800 1.800 peak 902 spectrum 1 weight 0.10000E+01 volume 0.84774E-03 ppm1 2.613 ppm2 4.332 CV 1
ASSI { 903}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 46 and name HB2 ))
2.300 2.300 3.700 peak 903 spectrum 1 weight 0.10000E+01 volume 0.38992E-01 ppm1 2.607 ppm2 2.730 CV 1
ASSI { 915}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HN ))
2.600 0.800 0.800 peak 915 spectrum 1 weight 0.10000E+01 volume 0.21640E-02 ppm1 2.343 ppm2 8.131 CV 1
ASSI { 916}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HN ))
3.100 1.200 1.200 peak 916 spectrum 1 weight 0.10000E+01 volume 0.23058E-02 ppm1 2.233 ppm2 8.129 CV 1
ASSI { 917}
(( segid " " and resid 15 and name HG2 ))
( segid " " and resid 51 and name HD% )
3.700 1.700 1.700 peak 917 spectrum 1 weight 0.10000E+01 volume 0.48750E-03 ppm1 2.420 ppm2 6.963 CV 1
ASSI { 920}
(( segid " " and resid 38 and name HB ))
(( segid " " and resid 34 and name HN ))
3.400 1.400 1.400 peak 920 spectrum 1 weight 0.10000E+01 volume 0.20242E-02 ppm1 2.111 ppm2 8.476 CV 1
ASSI { 921}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HN ))
2.500 0.800 0.800 peak 921 spectrum 1 weight 0.10000E+01 volume 0.43255E-02 ppm1 2.022 ppm2 8.658 CV 1
ASSI { 923}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 10 and name HN ))
2.900 1.100 1.100 peak 923 spectrum 1 weight 0.10000E+01 volume 0.16949E-02 ppm1 2.227 ppm2 8.585 CV 1
ASSI { 924}
(( segid " " and resid 15 and name HG2 ))
(( segid " " and resid 16 and name HN ))
2.800 1.000 1.000 peak 924 spectrum 1 weight 0.10000E+01 volume 0.22051E-02 ppm1 2.401 ppm2 8.730 CV 1
ASSI { 925}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 10 and name HN ))
3.300 1.300 1.300 peak 925 spectrum 1 weight 0.10000E+01 volume 0.74136E-03 ppm1 2.345 ppm2 8.582 CV 1
ASSI { 927}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 53 and name HN ))
3.700 3.700 2.300 peak 927 spectrum 1 weight 0.10000E+01 volume 0.22449E-02 ppm1 1.788 ppm2 8.686 CV 1
ASSI { 929}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 53 and name HN ))
3.200 1.300 1.300 peak 929 spectrum 1 weight 0.10000E+01 volume 0.41961E-02 ppm1 1.937 ppm2 8.700 CV 1
ASSI { 948}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 57 and name HN ))
4.300 2.300 1.700 peak 948 spectrum 1 weight 0.10000E+01 volume 0.70472E-03 ppm1 1.957 ppm2 7.605 CV 1
ASSI { 950}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 29 and name HZ3 ))
4.000 2.000 2.000 peak 950 spectrum 1 weight 0.10000E+01 volume 0.88530E-03 ppm1 2.349 ppm2 7.513 CV 1
ASSI { 955}
(( segid " " and resid 36 and name HG2 ))
(( segid " " and resid 29 and name HE1 ))
3.800 1.800 1.800 peak 955 spectrum 1 weight 0.10000E+01 volume 0.10612E-02 ppm1 2.254 ppm2 10.122 CV 1
ASSI { 960}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HN ))
2.700 0.900 0.900 peak 960 spectrum 1 weight 0.10000E+01 volume 0.18622E-02 ppm1 2.154 ppm2 9.052 CV 1
ASSI { 963}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HN ))
3.400 1.500 1.500 peak 963 spectrum 1 weight 0.10000E+01 volume 0.10653E-02 ppm1 1.958 ppm2 7.993 CV 1
ASSI { 987}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HN ))
2.900 1.000 1.000 peak 987 spectrum 1 weight 0.10000E+01 volume 0.22066E-02 ppm1 2.011 ppm2 8.308 CV 1
ASSI { 989}
(( segid " " and resid 38 and name HB ))
(( segid " " and resid 38 and name HN ))
3.300 1.400 1.400 peak 989 spectrum 1 weight 0.10000E+01 volume 0.15512E-02 ppm1 2.100 ppm2 9.793 CV 1
ASSI { 996}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 25 and name HE% )
3.200 3.200 2.800 peak 996 spectrum 1 weight 0.10000E+01 volume 0.46002E-02 ppm1 1.826 ppm2 6.686 CV 1
ASSI { 1005}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 37 and name HB2 ))
4.000 2.000 2.000 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.11777E-02 ppm1 2.041 ppm2 2.815 CV 1
ASSI { 1014}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HG2 ))
2.700 0.900 0.900 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.78867E-02 ppm1 1.989 ppm2 2.202 CV 1
ASSI { 1015}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HG2 ))
2.600 0.900 0.900 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.37919E-02 ppm1 2.024 ppm2 2.266 CV 1
ASSI { 1021}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 37 and name HZ2 ))
3.700 3.700 2.300 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.11713E-02 ppm1 1.977 ppm2 7.280 CV 1
ASSI { 1026}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HA ))
2.700 0.900 0.900 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.25931E-02 ppm1 1.932 ppm2 3.861 CV 1
ASSI { 1029}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 11 and name HB2 ))
2.800 1.000 1.000 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.46823E-02 ppm1 1.875 ppm2 2.144 CV 1
ASSI { 1033}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 50 and name HN ))
1.900 0.400 0.400 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.29549E-02 ppm1 1.820 ppm2 7.893 CV 1
ASSI { 1034}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HN ))
3.400 1.500 1.500 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.10195E-02 ppm1 1.732 ppm2 7.813 CV 1
ASSI { 1036}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 4 and name HN ))
2.700 0.900 0.900 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.27374E-02 ppm1 1.847 ppm2 8.018 CV 1
ASSI { 1037}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 56 and name HN ))
3.800 1.800 1.800 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.12759E-02 ppm1 1.813 ppm2 7.994 CV 1
ASSI { 1038}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 4 and name HA ))
3.100 1.200 1.200 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.98762E-03 ppm1 1.854 ppm2 4.072 CV 1
ASSI { 1039}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HN ))
1.900 0.400 0.400 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.62168E-02 ppm1 1.821 ppm2 8.266 CV 1
ASSI { 1040}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 55 and name HA ))
3.300 3.300 2.700 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.27156E-02 ppm1 1.833 ppm2 4.183 CV 1
ASSI { 1045}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 56 and name HB2 ))
2.300 2.300 3.700 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.80511E-02 ppm1 1.795 ppm2 1.958 CV 1
ASSI { 1046}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 14 and name HN ))
3.200 1.300 1.300 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.19534E-02 ppm1 1.627 ppm2 8.907 CV 1
ASSI { 1050}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 37 and name HB2 ))
4.400 2.400 1.600 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.52506E-03 ppm1 1.735 ppm2 2.814 CV 1
ASSI { 1055}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 28 and name HB2 ))
2.700 0.900 0.900 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.75996E-02 ppm1 1.788 ppm2 1.598 CV 1
OR { 1055}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 28 and name HB1 ))
ASSI { 1061}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HN ))
2.700 0.900 0.900 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.21324E-02 ppm1 1.600 ppm2 8.128 CV 1
OR { 1061}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HN ))
ASSI { 1062}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 19 and name HN ))
3.700 3.700 2.300 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.19089E-02 ppm1 1.617 ppm2 7.813 CV 1
ASSI { 1092}
(( segid " " and resid 28 and name HG1 ))
(( segid " " and resid 12 and name HB2 ))
3.900 1.900 1.900 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.98569E-03 ppm1 1.341 ppm2 1.788 CV 1
ASSI { 1105}
(( segid " " and resid 28 and name HG1 ))
(( segid " " and resid 12 and name HN ))
3.200 1.300 1.300 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.16658E-02 ppm1 1.329 ppm2 7.222 CV 1
OR { 1105}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 12 and name HN ))
ASSI { 1124}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 16 and name HA ))
3.000 3.000 3.000 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.49190E-03 ppm1 1.212 ppm2 5.645 CV 1
ASSI { 1132}
(( segid " " and resid 13 and name HB ))
( segid " " and resid 51 and name HD% )
3.100 1.200 1.200 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.33088E-02 ppm1 1.133 ppm2 6.969 CV 1
ASSI { 1144}
(( segid " " and resid 13 and name HB ))
( segid " " and resid 7 and name HD% )
3.200 1.300 1.300 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.25700E-02 ppm1 1.123 ppm2 7.187 CV 1
ASSI { 1237}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HB ))
3.600 1.700 1.700 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.21331E-02 ppm1 0.500 ppm2 1.213 CV 1
ASSI { 1239}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 13 and name HN ))
3.500 1.500 1.500 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.39845E-03 ppm1 0.496 ppm2 8.493 CV 1
ASSI { 1241}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 28 and name HN ))
3.700 1.700 1.700 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.84614E-03 ppm1 0.497 ppm2 8.132 CV 1
ASSI { 1242}
(( segid " " and resid 26 and name HB2 ))
( segid " " and resid 7 and name HE% )
3.300 3.300 2.700 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.17706E-02 ppm1 0.500 ppm2 6.737 CV 1
ASSI { 1245}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 15 and name HG2 ))
3.800 1.800 1.800 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.36246E-03 ppm1 0.494 ppm2 2.392 CV 1
ASSI { 1325}
(( segid " " and resid 54 and name HA2 ))
(( segid " " and resid 54 and name HA1 ))
1.900 0.400 0.400 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.68954E-02 ppm1 3.983 ppm2 3.789 CV 1
ASSI { 1326}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 41 and name HN ))
3.000 1.100 1.100 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.23174E-02 ppm1 3.839 ppm2 7.506 CV 1
ASSI { 1327}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 54 and name HN ))
2.600 0.900 0.900 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.25669E-02 ppm1 3.799 ppm2 7.643 CV 1
ASSI { 1332}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HN ))
2.700 0.900 0.900 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.10722E-02 ppm1 8.694 ppm2 8.477 CV 1
ASSI { 1333}
(( segid " " and resid 40 and name HA2 ))
( segid " " and resid 25 and name HD% )
2.800 1.000 1.000 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.25735E-02 ppm1 3.817 ppm2 6.802 CV 1
ASSI { 1334}
(( segid " " and resid 40 and name HA2 ))
( segid " " and resid 25 and name HE% )
3.400 1.400 1.400 peak 1334 spectrum 1 weight 0.10000E+01 volume 0.26844E-02 ppm1 3.818 ppm2 6.688 CV 1
ASSI { 1341}
(( segid " " and resid 18 and name HA2 ))
(( segid " " and resid 19 and name HN ))
2.900 1.000 1.000 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.51462E-02 ppm1 3.642 ppm2 7.811 CV 1
ASSI { 1345}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 28 and name HG1 ))
2.500 0.800 0.800 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.28775E-02 ppm1 2.153 ppm2 1.336 CV 1
OR { 1345}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 1349}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 28 and name HG1 ))
3.600 1.700 1.700 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.36593E-02 ppm1 1.789 ppm2 1.335 CV 1
OR { 1349}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 1352}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HG1 ))
1.700 0.400 0.500 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.21394E-01 ppm1 1.634 ppm2 1.331 CV 1
OR { 1352}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HG2 ))
OR { 1352}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HG1 ))
OR { 1352}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 1}
(( segid " " and resid 29 and name HE1 ))
(( segid " " and resid 29 and name HZ2 ))
3.100 1.200 1.200 peak 1 spectrum 1 weight 0.10000E+01 volume 0.17450E-02 ppm1 10.125 ppm2 6.970 CV 1
ASSI { 3}
(( segid " " and resid 29 and name HE1 ))
(( segid " " and resid 29 and name HD1 ))
2.600 0.800 0.800 peak 3 spectrum 1 weight 0.10000E+01 volume 0.45233E-02 ppm1 10.125 ppm2 7.063 CV 1
ASSI { 4}
(( segid " " and resid 29 and name HE1 ))
(( segid " " and resid 36 and name HB2 ))
3.800 1.800 1.800 peak 4 spectrum 1 weight 0.10000E+01 volume 0.11866E-02 ppm1 10.124 ppm2 2.013 CV 1
ASSI { 6}
(( segid " " and resid 37 and name HE1 ))
(( segid " " and resid 37 and name HZ2 ))
2.400 0.700 0.700 peak 6 spectrum 1 weight 0.10000E+01 volume 0.27557E-02 ppm1 10.069 ppm2 7.287 CV 1
ASSI { 9}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 25 and name HN ))
4.700 2.700 1.300 peak 9 spectrum 1 weight 0.10000E+01 volume 0.91059E-03 ppm1 9.795 ppm2 9.193 CV 1
ASSI { 11}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.800 1.800 1.800 peak 11 spectrum 1 weight 0.10000E+01 volume 0.73500E-03 ppm1 9.798 ppm2 2.816 CV 1
ASSI { 27}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HG2 ))
4.300 2.400 1.700 peak 27 spectrum 1 weight 0.10000E+01 volume 0.54970E-03 ppm1 9.194 ppm2 2.200 CV 1
ASSI { 37}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 29 and name HZ3 ))
4.400 2.400 1.600 peak 37 spectrum 1 weight 0.10000E+01 volume 0.69916E-03 ppm1 9.053 ppm2 7.505 CV 1
ASSI { 38}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HN ))
2.200 0.600 0.600 peak 38 spectrum 1 weight 0.10000E+01 volume 0.19352E-02 ppm1 9.053 ppm2 7.226 CV 1
ASSI { 47}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 28 and name HG1 ))
5.000 3.100 1.000 peak 47 spectrum 1 weight 0.10000E+01 volume 0.44955E-03 ppm1 9.054 ppm2 1.337 CV 1
OR { 47}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 49}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.900 1.900 1.900 peak 49 spectrum 1 weight 0.10000E+01 volume 0.12189E-02 ppm1 9.053 ppm2 0.498 CV 1
ASSI { 51}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HN ))
3.400 1.400 1.400 peak 51 spectrum 1 weight 0.10000E+01 volume 0.62755E-03 ppm1 8.970 ppm2 6.896 CV 1
ASSI { 58}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HN ))
2.700 0.900 0.900 peak 58 spectrum 1 weight 0.10000E+01 volume 0.21191E-02 ppm1 8.913 ppm2 7.223 CV 1
ASSI { 60}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
3.300 1.400 1.400 peak 60 spectrum 1 weight 0.10000E+01 volume 0.88034E-03 ppm1 8.913 ppm2 3.879 CV 1
ASSI { 67}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HA ))
2.700 0.900 0.900 peak 67 spectrum 1 weight 0.10000E+01 volume 0.62929E-03 ppm1 8.732 ppm2 5.643 CV 1
ASSI { 71}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 9 and name HB2 ))
3.300 3.300 2.700 peak 71 spectrum 1 weight 0.10000E+01 volume 0.23329E-02 ppm1 8.685 ppm2 2.247 CV 1
ASSI { 80}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 11 and name HB2 ))
3.700 1.800 1.800 peak 80 spectrum 1 weight 0.10000E+01 volume 0.14189E-02 ppm1 8.568 ppm2 2.134 CV 1
ASSI { 81}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HB2 ))
3.200 1.300 1.300 peak 81 spectrum 1 weight 0.10000E+01 volume 0.91476E-03 ppm1 8.743 ppm2 2.023 CV 1
ASSI { 83}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 27 and name HB ))
4.100 2.100 1.900 peak 83 spectrum 1 weight 0.10000E+01 volume 0.72838E-03 ppm1 8.727 ppm2 1.224 CV 1
ASSI { 86}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 54 and name HN ))
3.500 1.600 1.600 peak 86 spectrum 1 weight 0.10000E+01 volume 0.10312E-02 ppm1 8.698 ppm2 7.646 CV 1
ASSI { 92}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB2 ))
2.600 0.800 0.800 peak 92 spectrum 1 weight 0.10000E+01 volume 0.50448E-02 ppm1 8.711 ppm2 2.600 CV 1
ASSI { 95}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HA2 ))
2.100 0.600 0.600 peak 95 spectrum 1 weight 0.10000E+01 volume 0.23166E-02 ppm1 8.676 ppm2 3.825 CV 1
ASSI { 102}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.300 1.400 1.400 peak 102 spectrum 1 weight 0.10000E+01 volume 0.16661E-02 ppm1 8.691 ppm2 2.816 CV 1
ASSI { 103}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB2 ))
3.300 1.300 1.300 peak 103 spectrum 1 weight 0.10000E+01 volume 0.43043E-02 ppm1 8.480 ppm2 2.910 CV 1
ASSI { 109}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
3.400 1.500 1.500 peak 109 spectrum 1 weight 0.10000E+01 volume 0.53855E-03 ppm1 8.600 ppm2 7.792 CV 1
ASSI { 114}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HA ))
2.700 0.900 0.900 peak 114 spectrum 1 weight 0.10000E+01 volume 0.13372E-02 ppm1 8.494 ppm2 4.357 CV 1
ASSI { 115}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HN ))
4.700 2.700 1.300 peak 115 spectrum 1 weight 0.10000E+01 volume 0.79376E-03 ppm1 8.501 ppm2 7.688 CV 1
ASSI { 117}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HN ))
2.800 1.000 1.000 peak 117 spectrum 1 weight 0.10000E+01 volume 0.13730E-02 ppm1 8.479 ppm2 7.470 CV 1
ASSI { 118}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 29 and name HD1 ))
4.300 2.400 1.700 peak 118 spectrum 1 weight 0.10000E+01 volume 0.49057E-03 ppm1 8.494 ppm2 7.062 CV 1
ASSI { 124}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 53 and name HB2 ))
4.900 3.000 1.100 peak 124 spectrum 1 weight 0.10000E+01 volume 0.50170E-03 ppm1 8.493 ppm2 2.592 CV 1
ASSI { 125}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HG2 ))
3.800 1.800 1.800 peak 125 spectrum 1 weight 0.10000E+01 volume 0.12019E-02 ppm1 8.479 ppm2 2.423 CV 1
ASSI { 126}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HB ))
2.600 0.800 0.800 peak 126 spectrum 1 weight 0.10000E+01 volume 0.24383E-02 ppm1 8.495 ppm2 1.143 CV 1
ASSI { 135}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HG2 ))
4.000 2.000 2.000 peak 135 spectrum 1 weight 0.10000E+01 volume 0.11230E-02 ppm1 8.135 ppm2 1.333 CV 1
OR { 135}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 139}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HB ))
4.400 2.400 1.600 peak 139 spectrum 1 weight 0.10000E+01 volume 0.51109E-03 ppm1 8.133 ppm2 1.204 CV 1
ASSI { 141}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 12 and name HN ))
3.500 1.500 1.500 peak 141 spectrum 1 weight 0.10000E+01 volume 0.14905E-02 ppm1 8.317 ppm2 7.225 CV 1
ASSI { 147}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HB2 ))
3.500 1.600 1.600 peak 147 spectrum 1 weight 0.10000E+01 volume 0.98881E-03 ppm1 8.302 ppm2 2.770 CV 1
ASSI { 154}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 53 and name HB2 ))
4.100 2.100 1.900 peak 154 spectrum 1 weight 0.10000E+01 volume 0.13323E-02 ppm1 8.303 ppm2 2.598 CV 1
ASSI { 161}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HN ))
2.800 1.000 1.000 peak 161 spectrum 1 weight 0.10000E+01 volume 0.14352E-02 ppm1 8.271 ppm2 7.893 CV 1
ASSI { 162}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HN ))
2.500 0.800 0.800 peak 162 spectrum 1 weight 0.10000E+01 volume 0.14742E-02 ppm1 8.269 ppm2 7.777 CV 1
ASSI { 166}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HD2 ))
3.400 1.400 1.400 peak 166 spectrum 1 weight 0.10000E+01 volume 0.65189E-03 ppm1 8.074 ppm2 6.986 CV 1
ASSI { 186}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 4 and name HA ))
4.200 2.200 1.800 peak 186 spectrum 1 weight 0.10000E+01 volume 0.31555E-03 ppm1 8.022 ppm2 4.063 CV 1
ASSI { 190}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 57 and name HN ))
3.300 1.400 1.400 peak 190 spectrum 1 weight 0.10000E+01 volume 0.77983E-03 ppm1 7.999 ppm2 7.602 CV 1
ASSI { 193}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HB2 ))
3.700 1.700 1.700 peak 193 spectrum 1 weight 0.10000E+01 volume 0.66024E-03 ppm1 7.999 ppm2 1.647 CV 1
ASSI { 196}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 7 and name HD% )
4.000 2.000 2.000 peak 196 spectrum 1 weight 0.10000E+01 volume 0.91682E-03 ppm1 7.956 ppm2 7.177 CV 1
ASSI { 198}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 57 and name HB2 ))
5.800 4.200 0.200 peak 198 spectrum 1 weight 0.10000E+01 volume 0.31930E-03 ppm1 7.966 ppm2 2.846 CV 1
ASSI { 204}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HB2 ))
2.100 0.600 0.600 peak 204 spectrum 1 weight 0.10000E+01 volume 0.36437E-02 ppm1 7.914 ppm2 2.631 CV 1
ASSI { 206}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HN ))
2.600 0.900 0.900 peak 206 spectrum 1 weight 0.10000E+01 volume 0.98984E-03 ppm1 7.894 ppm2 7.469 CV 1
ASSI { 210}
(( segid " " and resid 42 and name HE1 ))
(( segid " " and resid 42 and name HD2 ))
4.900 3.000 1.100 peak 210 spectrum 1 weight 0.10000E+01 volume 0.68426E-03 ppm1 7.872 ppm2 6.986 CV 1
ASSI { 211}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HN ))
2.600 0.800 0.800 peak 211 spectrum 1 weight 0.10000E+01 volume 0.17015E-02 ppm1 7.793 ppm2 8.068 CV 1
ASSI { 213}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
3.600 1.600 1.600 peak 213 spectrum 1 weight 0.10000E+01 volume 0.48258E-03 ppm1 7.799 ppm2 4.262 CV 1
ASSI { 218}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB ))
2.200 0.600 0.600 peak 218 spectrum 1 weight 0.10000E+01 volume 0.27734E-02 ppm1 7.792 ppm2 2.051 CV 1
ASSI { 221}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HN ))
2.800 0.900 0.900 peak 221 spectrum 1 weight 0.10000E+01 volume 0.14713E-02 ppm1 7.782 ppm2 7.173 CV 1
ASSI { 222}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 29 and name HD1 ))
5.200 3.300 0.800 peak 222 spectrum 1 weight 0.10000E+01 volume 0.49892E-03 ppm1 7.509 ppm2 7.071 CV 1
ASSI { 223}
(( segid " " and resid 57 and name HN ))
( segid " " and resid 57 and name HD% )
3.600 1.600 1.600 peak 223 spectrum 1 weight 0.10000E+01 volume 0.67173E-03 ppm1 7.597 ppm2 7.070 CV 1
ASSI { 238}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HB2 ))
4.900 2.900 1.100 peak 238 spectrum 1 weight 0.10000E+01 volume 0.30999E-03 ppm1 7.607 ppm2 1.964 CV 1
ASSI { 240}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 25 and name HD% )
2.700 2.700 3.300 peak 240 spectrum 1 weight 0.10000E+01 volume 0.82922E-02 ppm1 7.448 ppm2 6.803 CV 1
ASSI { 243}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 47 and name HB ))
3.500 1.500 1.500 peak 243 spectrum 1 weight 0.10000E+01 volume 0.12791E-02 ppm1 7.520 ppm2 1.948 CV 1
ASSI { 244}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 24 and name HB2 ))
4.300 2.300 1.700 peak 244 spectrum 1 weight 0.10000E+01 volume 0.11790E-02 ppm1 7.523 ppm2 1.748 CV 1
ASSI { 248}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 51 and name HE% )
4.200 2.200 1.800 peak 248 spectrum 1 weight 0.10000E+01 volume 0.34698E-02 ppm1 7.506 ppm2 6.596 CV 1
ASSI { 250}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 29 and name HB2 ))
4.300 2.300 1.700 peak 250 spectrum 1 weight 0.10000E+01 volume 0.15200E-02 ppm1 7.506 ppm2 3.495 CV 1
ASSI { 252}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 28 and name HD2 ))
4.100 2.100 1.900 peak 252 spectrum 1 weight 0.10000E+01 volume 0.21316E-02 ppm1 7.504 ppm2 3.087 CV 1
ASSI { 253}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 9 and name HB2 ))
3.200 1.300 1.300 peak 253 spectrum 1 weight 0.10000E+01 volume 0.12885E-02 ppm1 7.505 ppm2 2.229 CV 1
ASSI { 255}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 28 and name HG2 ))
4.200 2.200 1.800 peak 255 spectrum 1 weight 0.10000E+01 volume 0.77847E-03 ppm1 7.493 ppm2 1.330 CV 1
OR { 255}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 261}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HB2 ))
2.400 0.700 0.700 peak 261 spectrum 1 weight 0.10000E+01 volume 0.37306E-02 ppm1 7.472 ppm2 2.924 CV 1
ASSI { 262}
(( segid " " and resid 29 and name HZ3 ))
(( segid " " and resid 31 and name HB2 ))
5.000 3.100 1.000 peak 262 spectrum 1 weight 0.10000E+01 volume 0.85459E-03 ppm1 7.475 ppm2 2.744 CV 1
ASSI { 264}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HN ))
3.100 1.200 1.200 peak 264 spectrum 1 weight 0.10000E+01 volume 0.94322E-03 ppm1 7.319 ppm2 7.649 CV 1
ASSI { 266}
(( segid " " and resid 37 and name HZ2 ))
(( segid " " and resid 37 and name HZ3 ))
4.100 2.100 1.900 peak 266 spectrum 1 weight 0.10000E+01 volume 0.71689E-03 ppm1 7.280 ppm2 6.674 CV 1
ASSI { 267}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 56 and name HN ))
3.500 1.500 1.500 peak 267 spectrum 1 weight 0.10000E+01 volume 0.74405E-03 ppm1 7.314 ppm2 7.993 CV 1
ASSI { 269}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HA2 ))
4.700 2.800 1.300 peak 269 spectrum 1 weight 0.10000E+01 volume 0.48883E-03 ppm1 7.307 ppm2 3.991 CV 1
ASSI { 271}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA ))
2.900 1.100 1.100 peak 271 spectrum 1 weight 0.10000E+01 volume 0.19727E-02 ppm1 7.179 ppm2 4.600 CV 1
ASSI { 272}
( segid " " and resid 7 and name HD% )
(( segid " " and resid 7 and name HA ))
3.200 1.200 1.200 peak 272 spectrum 1 weight 0.10000E+01 volume 0.22189E-02 ppm1 7.175 ppm2 4.512 CV 1
ASSI { 278}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 28 and name HG1 ))
4.400 2.400 1.600 peak 278 spectrum 1 weight 0.10000E+01 volume 0.78086E-03 ppm1 7.224 ppm2 1.336 CV 1
OR { 278}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 280}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.500 1.500 1.500 peak 280 spectrum 1 weight 0.10000E+01 volume 0.20853E-02 ppm1 7.222 ppm2 0.496 CV 1
ASSI { 284}
( segid " " and resid 7 and name HD% )
(( segid " " and resid 9 and name HB2 ))
4.200 2.200 1.800 peak 284 spectrum 1 weight 0.10000E+01 volume 0.15774E-02 ppm1 7.180 ppm2 2.230 CV 1
ASSI { 286}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HG2 ))
2.200 0.600 0.600 peak 286 spectrum 1 weight 0.10000E+01 volume 0.28736E-02 ppm1 7.226 ppm2 2.387 CV 1
ASSI { 297}
(( segid " " and resid 37 and name HD1 ))
(( segid " " and resid 37 and name HE1 ))
1.800 1.800 4.200 peak 297 spectrum 1 weight 0.10000E+01 volume 0.63313E-02 ppm1 7.165 ppm2 10.066 CV 1
ASSI { 298}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HN ))
2.300 0.700 0.700 peak 298 spectrum 1 weight 0.10000E+01 volume 0.23402E-02 ppm1 7.165 ppm2 8.723 CV 1
ASSI { 302}
( segid " " and resid 7 and name HD% )
( segid " " and resid 7 and name HE% )
1.900 0.400 0.400 peak 302 spectrum 1 weight 0.10000E+01 volume 0.15607E-01 ppm1 7.175 ppm2 6.726 CV 1
ASSI { 303}
(( segid " " and resid 37 and name HD1 ))
(( segid " " and resid 42 and name HB2 ))
3.800 1.800 1.800 peak 303 spectrum 1 weight 0.10000E+01 volume 0.18277E-02 ppm1 7.184 ppm2 3.438 CV 1
ASSI { 304}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
2.600 0.800 0.800 peak 304 spectrum 1 weight 0.10000E+01 volume 0.13629E-02 ppm1 7.174 ppm2 3.569 CV 1
ASSI { 315}
( segid " " and resid 51 and name HD% )
( segid " " and resid 51 and name HE% )
1.900 0.400 0.400 peak 315 spectrum 1 weight 0.10000E+01 volume 0.11724E-01 ppm1 6.965 ppm2 6.596 CV 1
ASSI { 318}
(( segid " " and resid 29 and name HD1 ))
(( segid " " and resid 29 and name HB2 ))
4.100 2.100 1.900 peak 318 spectrum 1 weight 0.10000E+01 volume 0.12235E-02 ppm1 7.064 ppm2 3.491 CV 1
ASSI { 320}
(( segid " " and resid 29 and name HD1 ))
(( segid " " and resid 35 and name HB2 ))
3.900 1.900 1.900 peak 320 spectrum 1 weight 0.10000E+01 volume 0.56152E-03 ppm1 7.064 ppm2 2.765 CV 1
ASSI { 321}
( segid " " and resid 57 and name HD% )
(( segid " " and resid 5 and name HB2 ))
2.800 2.800 3.200 peak 321 spectrum 1 weight 0.10000E+01 volume 0.84347E-03 ppm1 7.065 ppm2 2.652 CV 1
ASSI { 326}
(( segid " " and resid 42 and name HD2 ))
(( segid " " and resid 38 and name HA ))
5.400 3.600 0.600 peak 326 spectrum 1 weight 0.10000E+01 volume 0.61714E-03 ppm1 6.976 ppm2 4.684 CV 1
ASSI { 327}
(( segid " " and resid 42 and name HD2 ))
(( segid " " and resid 42 and name HB2 ))
3.600 1.600 1.600 peak 327 spectrum 1 weight 0.10000E+01 volume 0.61329E-03 ppm1 6.986 ppm2 3.440 CV 1
ASSI { 330}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 52 and name HB2 ))
3.200 1.300 1.300 peak 330 spectrum 1 weight 0.10000E+01 volume 0.15367E-02 ppm1 6.978 ppm2 1.943 CV 1
ASSI { 331}
(( segid " " and resid 42 and name HD2 ))
(( segid " " and resid 38 and name HB ))
3.800 1.800 1.800 peak 331 spectrum 1 weight 0.10000E+01 volume 0.64007E-03 ppm1 6.977 ppm2 2.100 CV 1
ASSI { 339}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 52 and name HN ))
3.700 1.700 1.700 peak 339 spectrum 1 weight 0.10000E+01 volume 0.14818E-02 ppm1 6.965 ppm2 8.477 CV 1
ASSI { 340}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 51 and name HN ))
4.400 2.500 1.600 peak 340 spectrum 1 weight 0.10000E+01 volume 0.10705E-02 ppm1 6.962 ppm2 7.470 CV 1
ASSI { 341}
( segid " " and resid 51 and name HD% )
( segid " " and resid 25 and name HE% )
3.100 1.200 1.200 peak 341 spectrum 1 weight 0.10000E+01 volume 0.27018E-02 ppm1 6.955 ppm2 6.688 CV 1
ASSI { 343}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 52 and name HA ))
3.800 1.800 1.800 peak 343 spectrum 1 weight 0.10000E+01 volume 0.90012E-03 ppm1 6.964 ppm2 3.866 CV 1
ASSI { 344}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 51 and name HB2 ))
2.200 0.600 0.600 peak 344 spectrum 1 weight 0.10000E+01 volume 0.80764E-02 ppm1 6.965 ppm2 2.925 CV 1
ASSI { 346}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 52 and name HG2 ))
4.100 2.100 1.900 peak 346 spectrum 1 weight 0.10000E+01 volume 0.77148E-03 ppm1 6.967 ppm2 2.422 CV 1
ASSI { 353}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HG2 ))
4.800 2.900 1.200 peak 353 spectrum 1 weight 0.10000E+01 volume 0.67829E-03 ppm1 6.929 ppm2 2.200 CV 1
ASSI { 354}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HN ))
3.100 1.200 1.200 peak 354 spectrum 1 weight 0.10000E+01 volume 0.25780E-02 ppm1 6.893 ppm2 7.927 CV 1
ASSI { 359}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 26 and name HN ))
4.000 2.000 2.000 peak 359 spectrum 1 weight 0.10000E+01 volume 0.98638E-03 ppm1 6.803 ppm2 8.320 CV 1
ASSI { 360}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 16 and name HA ))
2.200 0.600 0.600 peak 360 spectrum 1 weight 0.10000E+01 volume 0.68426E-03 ppm1 6.803 ppm2 5.646 CV 1
ASSI { 366}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 40 and name HA1 ))
3.600 1.600 1.600 peak 366 spectrum 1 weight 0.10000E+01 volume 0.17527E-02 ppm1 6.801 ppm2 3.710 CV 1
ASSI { 367}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 51 and name HB2 ))
3.400 1.400 1.400 peak 367 spectrum 1 weight 0.10000E+01 volume 0.35011E-03 ppm1 6.799 ppm2 2.936 CV 1
ASSI { 369}
( segid " " and resid 25 and name HE% )
(( segid " " and resid 15 and name HG2 ))
3.700 1.700 1.700 peak 369 spectrum 1 weight 0.10000E+01 volume 0.18966E-02 ppm1 6.721 ppm2 2.398 CV 1
ASSI { 370}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 25 and name HB2 ))
2.100 0.600 0.600 peak 370 spectrum 1 weight 0.10000E+01 volume 0.32779E-02 ppm1 6.801 ppm2 2.293 CV 1
ASSI { 371}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 43 and name HB ))
3.200 1.300 1.300 peak 371 spectrum 1 weight 0.10000E+01 volume 0.12155E-02 ppm1 6.800 ppm2 2.055 CV 1
ASSI { 373}
( segid " " and resid 25 and name HE% )
(( segid " " and resid 49 and name HB2 ))
3.400 1.500 1.500 peak 373 spectrum 1 weight 0.10000E+01 volume 0.34406E-02 ppm1 6.691 ppm2 1.824 CV 1
ASSI { 374}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 49 and name HB2 ))
3.400 3.400 2.600 peak 374 spectrum 1 weight 0.10000E+01 volume 0.24654E-02 ppm1 6.800 ppm2 1.838 CV 1
ASSI { 377}
( segid " " and resid 7 and name HE% )
(( segid " " and resid 56 and name HB2 ))
3.200 3.200 2.800 peak 377 spectrum 1 weight 0.10000E+01 volume 0.12941E-02 ppm1 6.723 ppm2 1.976 CV 1
ASSI { 390}
(( segid " " and resid 37 and name HH2 ))
(( segid " " and resid 37 and name HZ2 ))
2.100 0.500 0.500 peak 390 spectrum 1 weight 0.10000E+01 volume 0.57507E-02 ppm1 6.725 ppm2 7.283 CV 1
OR { 390}
(( segid " " and resid 37 and name HZ3 ))
(( segid " " and resid 37 and name HZ2 ))
ASSI { 394}
(( segid " " and resid 37 and name HH2 ))
(( segid " " and resid 26 and name HN ))
4.200 2.200 1.800 peak 394 spectrum 1 weight 0.10000E+01 volume 0.11414E-02 ppm1 6.684 ppm2 8.320 CV 1
OR { 394}
(( segid " " and resid 37 and name HZ3 ))
(( segid " " and resid 26 and name HN ))
ASSI { 403}
(( segid " " and resid 37 and name HH2 ))
(( segid " " and resid 27 and name HB ))
2.900 1.100 1.100 peak 403 spectrum 1 weight 0.10000E+01 volume 0.20012E-02 ppm1 6.687 ppm2 1.199 CV 1
OR { 403}
(( segid " " and resid 37 and name HZ3 ))
(( segid " " and resid 27 and name HB ))
ASSI { 408}
( segid " " and resid 51 and name HE% )
(( segid " " and resid 52 and name HA ))
2.900 2.900 3.100 peak 408 spectrum 1 weight 0.10000E+01 volume 0.73814E-03 ppm1 6.598 ppm2 3.867 CV 1
ASSI { 418}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 26 and name HN ))
3.400 1.400 1.400 peak 418 spectrum 1 weight 0.10000E+01 volume 0.10618E-02 ppm1 5.647 ppm2 8.319 CV 1
ASSI { 427}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
3.500 1.500 1.500 peak 427 spectrum 1 weight 0.10000E+01 volume 0.86955E-03 ppm1 5.536 ppm2 8.491 CV 1
ASSI { 431}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HN ))
3.000 1.100 1.100 peak 431 spectrum 1 weight 0.10000E+01 volume 0.37306E-02 ppm1 5.298 ppm2 8.317 CV 1
ASSI { 432}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HN ))
3.400 1.500 1.500 peak 432 spectrum 1 weight 0.10000E+01 volume 0.11532E-02 ppm1 5.305 ppm2 8.382 CV 1
ASSI { 433}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 25 and name HD% )
2.000 0.500 0.500 peak 433 spectrum 1 weight 0.10000E+01 volume 0.26761E-02 ppm1 5.299 ppm2 6.801 CV 1
ASSI { 436}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 25 and name HE% )
3.900 1.900 1.900 peak 436 spectrum 1 weight 0.10000E+01 volume 0.16991E-02 ppm1 5.300 ppm2 6.680 CV 1
ASSI { 437}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 16 and name HA ))
4.400 2.400 1.600 peak 437 spectrum 1 weight 0.10000E+01 volume 0.13660E-02 ppm1 5.299 ppm2 5.642 CV 1
ASSI { 441}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HN ))
2.700 0.900 0.900 peak 441 spectrum 1 weight 0.10000E+01 volume 0.35880E-02 ppm1 4.984 ppm2 9.794 CV 1
ASSI { 452}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 20 and name HN ))
2.200 2.200 3.800 peak 452 spectrum 1 weight 0.10000E+01 volume 0.32104E-02 ppm1 4.771 ppm2 8.788 CV 1
ASSI { 455}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HN ))
2.500 0.800 0.800 peak 455 spectrum 1 weight 0.10000E+01 volume 0.49336E-02 ppm1 4.713 ppm2 8.493 CV 1
ASSI { 459}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HN ))
3.100 1.200 1.200 peak 459 spectrum 1 weight 0.10000E+01 volume 0.92588E-03 ppm1 4.990 ppm2 8.695 CV 1
ASSI { 464}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB2 ))
3.200 1.300 1.300 peak 464 spectrum 1 weight 0.10000E+01 volume 0.19216E-02 ppm1 4.985 ppm2 2.816 CV 1
ASSI { 466}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HG2 ))
2.700 0.900 0.900 peak 466 spectrum 1 weight 0.10000E+01 volume 0.15454E-02 ppm1 4.849 ppm2 2.198 CV 1
ASSI { 470}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HN ))
3.200 1.300 1.300 peak 470 spectrum 1 weight 0.10000E+01 volume 0.15141E-02 ppm1 4.900 ppm2 8.071 CV 1
ASSI { 471}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HN ))
3.400 1.400 1.400 peak 471 spectrum 1 weight 0.10000E+01 volume 0.16369E-02 ppm1 4.897 ppm2 7.790 CV 1
ASSI { 476}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 40 and name HA2 ))
4.200 2.200 1.800 peak 476 spectrum 1 weight 0.10000E+01 volume 0.15301E-02 ppm1 4.909 ppm2 3.840 CV 1
ASSI { 477}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB2 ))
3.200 1.300 1.300 peak 477 spectrum 1 weight 0.10000E+01 volume 0.31361E-02 ppm1 4.906 ppm2 3.476 CV 1
ASSI { 478}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB2 ))
3.900 1.900 1.900 peak 478 spectrum 1 weight 0.10000E+01 volume 0.96030E-03 ppm1 4.885 ppm2 3.431 CV 1
ASSI { 480}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 28 and name HD2 ))
3.600 1.700 1.700 peak 480 spectrum 1 weight 0.10000E+01 volume 0.16167E-02 ppm1 4.913 ppm2 3.072 CV 1
ASSI { 484}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HB ))
3.600 1.600 1.600 peak 484 spectrum 1 weight 0.10000E+01 volume 0.48084E-02 ppm1 4.791 ppm2 1.697 CV 1
ASSI { 488}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 36 and name HB2 ))
3.800 3.800 2.200 peak 488 spectrum 1 weight 0.10000E+01 volume 0.25909E-02 ppm1 4.852 ppm2 2.002 CV 1
ASSI { 492}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 28 and name HG2 ))
4.500 2.500 1.500 peak 492 spectrum 1 weight 0.10000E+01 volume 0.61611E-03 ppm1 4.912 ppm2 1.336 CV 1
OR { 492}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 498}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HN ))
2.900 1.100 1.100 peak 498 spectrum 1 weight 0.10000E+01 volume 0.33679E-02 ppm1 4.689 ppm2 8.980 CV 1
ASSI { 499}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HN ))
2.700 0.900 0.900 peak 499 spectrum 1 weight 0.10000E+01 volume 0.14964E-02 ppm1 4.631 ppm2 9.051 CV 1
ASSI { 500}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 24 and name HN ))
3.300 1.400 1.400 peak 500 spectrum 1 weight 0.10000E+01 volume 0.15374E-02 ppm1 4.779 ppm2 8.970 CV 1
ASSI { 503}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HN ))
2.500 0.800 0.800 peak 503 spectrum 1 weight 0.10000E+01 volume 0.24476E-02 ppm1 4.801 ppm2 6.891 CV 1
ASSI { 505}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 39 and name HA ))
5.400 3.700 0.600 peak 505 spectrum 1 weight 0.10000E+01 volume 0.38349E-03 ppm1 4.850 ppm2 4.352 CV 1
ASSI { 507}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 20 and name HA2 ))
2.300 2.300 3.700 peak 507 spectrum 1 weight 0.10000E+01 volume 0.27098E-02 ppm1 4.769 ppm2 3.895 CV 1
OR { 507}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 20 and name HA1 ))
ASSI { 514}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB2 ))
2.900 1.000 1.000 peak 514 spectrum 1 weight 0.10000E+01 volume 0.33996E-02 ppm1 4.709 ppm2 2.766 CV 1
ASSI { 516}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
2.600 0.800 0.800 peak 516 spectrum 1 weight 0.10000E+01 volume 0.58722E-02 ppm1 4.807 ppm2 2.908 CV 1
ASSI { 518}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 19 and name HN ))
3.000 1.100 1.100 peak 518 spectrum 1 weight 0.10000E+01 volume 0.29608E-02 ppm1 4.774 ppm2 7.799 CV 1
ASSI { 527}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 37 and name HZ3 ))
3.400 3.400 2.600 peak 527 spectrum 1 weight 0.10000E+01 volume 0.29539E-02 ppm1 4.775 ppm2 6.685 CV 1
ASSI { 540}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HN ))
3.000 1.100 1.100 peak 540 spectrum 1 weight 0.10000E+01 volume 0.99017E-03 ppm1 4.689 ppm2 9.795 CV 1
ASSI { 541}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 51 and name HE% )
3.800 1.800 1.800 peak 541 spectrum 1 weight 0.10000E+01 volume 0.94431E-03 ppm1 3.874 ppm2 6.598 CV 1
ASSI { 543}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 24 and name HA ))
2.500 2.500 3.500 peak 543 spectrum 1 weight 0.10000E+01 volume 0.61432E-02 ppm1 3.813 ppm2 4.863 CV 1
ASSI { 551}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.700 0.900 0.900 peak 551 spectrum 1 weight 0.10000E+01 volume 0.34559E-02 ppm1 4.630 ppm2 2.149 CV 1
ASSI { 552}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB ))
2.900 1.100 1.100 peak 552 spectrum 1 weight 0.10000E+01 volume 0.26552E-02 ppm1 4.692 ppm2 2.100 CV 1
ASSI { 553}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HB2 ))
2.800 1.000 1.000 peak 553 spectrum 1 weight 0.10000E+01 volume 0.28332E-02 ppm1 4.535 ppm2 1.730 CV 1
ASSI { 555}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB2 ))
2.600 0.800 0.800 peak 555 spectrum 1 weight 0.10000E+01 volume 0.21281E-02 ppm1 4.467 ppm2 2.006 CV 1
ASSI { 556}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB2 ))
2.700 0.900 0.900 peak 556 spectrum 1 weight 0.10000E+01 volume 0.33753E-02 ppm1 4.580 ppm2 1.907 CV 1
ASSI { 560}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 35 and name HN ))
2.400 2.400 3.600 peak 560 spectrum 1 weight 0.10000E+01 volume 0.19282E-02 ppm1 4.676 ppm2 8.369 CV 1
ASSI { 562}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB2 ))
2.400 0.700 0.700 peak 562 spectrum 1 weight 0.10000E+01 volume 0.39253E-02 ppm1 4.539 ppm2 1.615 CV 1
OR { 562}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB1 ))
ASSI { 569}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB2 ))
2.900 1.100 1.100 peak 569 spectrum 1 weight 0.10000E+01 volume 0.31736E-02 ppm1 4.574 ppm2 2.737 CV 1
ASSI { 571}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB2 ))
2.900 1.100 1.100 peak 571 spectrum 1 weight 0.10000E+01 volume 0.40713E-02 ppm1 4.526 ppm2 2.230 CV 1
ASSI { 572}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HG2 ))
3.300 1.300 1.300 peak 572 spectrum 1 weight 0.10000E+01 volume 0.37167E-02 ppm1 4.528 ppm2 2.332 CV 1
ASSI { 573}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HG2 ))
3.300 1.400 1.400 peak 573 spectrum 1 weight 0.10000E+01 volume 0.34639E-02 ppm1 4.610 ppm2 2.396 CV 1
ASSI { 574}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HG2 ))
4.000 2.000 2.000 peak 574 spectrum 1 weight 0.10000E+01 volume 0.74405E-03 ppm1 4.467 ppm2 2.282 CV 1
ASSI { 576}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HN ))
2.700 0.900 0.900 peak 576 spectrum 1 weight 0.10000E+01 volume 0.10347E-02 ppm1 4.461 ppm2 8.306 CV 1
ASSI { 577}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HN ))
3.300 1.300 1.300 peak 577 spectrum 1 weight 0.10000E+01 volume 0.20659E-02 ppm1 4.581 ppm2 8.083 CV 1
ASSI { 578}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 4 and name HN ))
4.600 2.600 1.400 peak 578 spectrum 1 weight 0.10000E+01 volume 0.29907E-03 ppm1 4.560 ppm2 8.018 CV 1
ASSI { 587}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 5 and name HA ))
2.700 2.700 3.300 peak 587 spectrum 1 weight 0.10000E+01 volume 0.11487E-02 ppm1 4.568 ppm2 5.536 CV 1
ASSI { 588}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HN ))
4.000 2.000 2.000 peak 588 spectrum 1 weight 0.10000E+01 volume 0.43738E-03 ppm1 4.528 ppm2 8.796 CV 1
ASSI { 589}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HN ))
3.200 1.300 1.300 peak 589 spectrum 1 weight 0.10000E+01 volume 0.13483E-02 ppm1 4.536 ppm2 7.812 CV 1
ASSI { 590}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 29 and name HZ3 ))
4.100 2.100 1.900 peak 590 spectrum 1 weight 0.10000E+01 volume 0.67553E-03 ppm1 4.539 ppm2 7.505 CV 1
ASSI { 595}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 35 and name HN ))
5.700 4.100 0.300 peak 595 spectrum 1 weight 0.10000E+01 volume 0.25036E-03 ppm1 4.478 ppm2 8.385 CV 1
ASSI { 598}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HA1 ))
4.100 2.100 1.900 peak 598 spectrum 1 weight 0.10000E+01 volume 0.19929E-02 ppm1 4.436 ppm2 3.791 CV 1
ASSI { 599}
(( segid " " and resid 32 and name HA1 ))
(( segid " " and resid 32 and name HA2 ))
1.900 0.500 0.500 peak 599 spectrum 1 weight 0.10000E+01 volume 0.75169E-02 ppm1 4.289 ppm2 3.763 CV 1
ASSI { 600}
(( segid " " and resid 18 and name HA1 ))
(( segid " " and resid 18 and name HA2 ))
2.000 0.500 0.500 peak 600 spectrum 1 weight 0.10000E+01 volume 0.56358E-02 ppm1 4.216 ppm2 3.627 CV 1
ASSI { 601}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HA2 ))
4.700 2.700 1.300 peak 601 spectrum 1 weight 0.10000E+01 volume 0.45789E-03 ppm1 4.356 ppm2 3.818 CV 1
ASSI { 606}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 10 and name HN ))
4.500 2.600 1.500 peak 606 spectrum 1 weight 0.10000E+01 volume 0.87687E-03 ppm1 4.391 ppm2 8.576 CV 1
ASSI { 607}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 11 and name HB2 ))
3.300 3.300 2.700 peak 607 spectrum 1 weight 0.10000E+01 volume 0.33673E-02 ppm1 4.393 ppm2 2.133 CV 1
ASSI { 608}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 24 and name HG2 ))
3.500 1.600 1.600 peak 608 spectrum 1 weight 0.10000E+01 volume 0.19067E-02 ppm1 4.363 ppm2 2.200 CV 1
ASSI { 609}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HB ))
3.100 1.200 1.200 peak 609 spectrum 1 weight 0.10000E+01 volume 0.14724E-02 ppm1 4.277 ppm2 2.048 CV 1
ASSI { 612}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB2 ))
2.400 0.700 0.700 peak 612 spectrum 1 weight 0.10000E+01 volume 0.34542E-02 ppm1 4.360 ppm2 1.771 CV 1
ASSI { 625}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG1 ))
5.200 3.400 0.800 peak 625 spectrum 1 weight 0.10000E+01 volume 0.35672E-03 ppm1 4.254 ppm2 1.345 CV 1
OR { 625}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 627}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HN ))
2.500 0.800 0.800 peak 627 spectrum 1 weight 0.10000E+01 volume 0.12958E-02 ppm1 4.354 ppm2 8.977 CV 1
ASSI { 630}
(( segid " " and resid 18 and name HA1 ))
(( segid " " and resid 19 and name HN ))
2.900 1.000 1.000 peak 630 spectrum 1 weight 0.10000E+01 volume 0.33290E-02 ppm1 4.221 ppm2 7.812 CV 1
ASSI { 632}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HN ))
2.800 1.000 1.000 peak 632 spectrum 1 weight 0.10000E+01 volume 0.13970E-02 ppm1 4.357 ppm2 7.228 CV 1
ASSI { 634}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HB ))
4.300 2.300 1.700 peak 634 spectrum 1 weight 0.10000E+01 volume 0.80802E-03 ppm1 4.357 ppm2 1.139 CV 1
ASSI { 640}
(( segid " " and resid 32 and name HA1 ))
(( segid " " and resid 32 and name HN ))
3.200 1.300 1.300 peak 640 spectrum 1 weight 0.10000E+01 volume 0.13344E-02 ppm1 4.292 ppm2 8.079 CV 1
ASSI { 642}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 4 and name HN ))
3.400 1.400 1.400 peak 642 spectrum 1 weight 0.10000E+01 volume 0.46519E-02 ppm1 4.231 ppm2 8.017 CV 1
ASSI { 643}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HN ))
2.600 0.800 0.800 peak 643 spectrum 1 weight 0.10000E+01 volume 0.41026E-02 ppm1 4.181 ppm2 7.992 CV 1
ASSI { 644}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HN ))
3.300 1.400 1.400 peak 644 spectrum 1 weight 0.10000E+01 volume 0.94675E-03 ppm1 4.220 ppm2 7.954 CV 1
ASSI { 646}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HD% )
2.300 0.700 0.700 peak 646 spectrum 1 weight 0.10000E+01 volume 0.39878E-02 ppm1 4.217 ppm2 6.963 CV 1
ASSI { 649}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB2 ))
4.100 2.100 1.900 peak 649 spectrum 1 weight 0.10000E+01 volume 0.69434E-03 ppm1 4.346 ppm2 2.839 CV 1
ASSI { 650}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HE% )
4.500 2.500 1.500 peak 650 spectrum 1 weight 0.10000E+01 volume 0.11126E-02 ppm1 4.216 ppm2 6.594 CV 1
ASSI { 651}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HN ))
2.600 0.900 0.900 peak 651 spectrum 1 weight 0.10000E+01 volume 0.43043E-02 ppm1 4.276 ppm2 8.597 CV 1
ASSI { 652}
(( segid " " and resid 32 and name HA1 ))
(( segid " " and resid 33 and name HN ))
3.500 1.500 1.500 peak 652 spectrum 1 weight 0.10000E+01 volume 0.86050E-03 ppm1 4.290 ppm2 7.687 CV 1
ASSI { 653}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB2 ))
2.200 0.600 0.600 peak 653 spectrum 1 weight 0.10000E+01 volume 0.57193E-02 ppm1 4.217 ppm2 2.924 CV 1
ASSI { 664}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 42 and name HN ))
3.400 1.500 1.500 peak 664 spectrum 1 weight 0.10000E+01 volume 0.13403E-02 ppm1 4.126 ppm2 8.066 CV 1
ASSI { 666}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 57 and name HN ))
2.800 0.900 0.900 peak 666 spectrum 1 weight 0.10000E+01 volume 0.41061E-02 ppm1 4.220 ppm2 7.603 CV 1
ASSI { 667}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HN ))
2.900 1.000 1.000 peak 667 spectrum 1 weight 0.10000E+01 volume 0.15788E-02 ppm1 4.216 ppm2 7.469 CV 1
ASSI { 668}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HG2 ))
3.700 1.700 1.700 peak 668 spectrum 1 weight 0.10000E+01 volume 0.10076E-02 ppm1 4.224 ppm2 2.200 CV 1
ASSI { 669}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB2 ))
2.800 1.000 1.000 peak 669 spectrum 1 weight 0.10000E+01 volume 0.20179E-02 ppm1 4.219 ppm2 1.958 CV 1
ASSI { 671}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 4 and name HB ))
1.800 0.400 0.400 peak 671 spectrum 1 weight 0.10000E+01 volume 0.87161E-02 ppm1 4.192 ppm2 1.832 CV 1
ASSI { 672}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HN ))
2.800 1.000 1.000 peak 672 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 4.125 ppm2 7.521 CV 1
ASSI { 673}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HN ))
3.100 1.200 1.200 peak 673 spectrum 1 weight 0.10000E+01 volume 0.16914E-02 ppm1 4.176 ppm2 7.310 CV 1
ASSI { 674}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB ))
2.900 1.100 1.100 peak 674 spectrum 1 weight 0.10000E+01 volume 0.37584E-02 ppm1 4.128 ppm2 1.716 CV 1
ASSI { 675}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB2 ))
3.100 1.200 1.200 peak 675 spectrum 1 weight 0.10000E+01 volume 0.31166E-02 ppm1 4.180 ppm2 1.648 CV 1
ASSI { 677}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
2.300 0.600 0.600 peak 677 spectrum 1 weight 0.10000E+01 volume 0.65607E-02 ppm1 4.128 ppm2 8.964 CV 1
ASSI { 679}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 18 and name HN ))
4.700 2.700 1.300 peak 679 spectrum 1 weight 0.10000E+01 volume 0.68041E-03 ppm1 4.116 ppm2 8.290 CV 1
ASSI { 682}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 15 and name HN ))
3.800 1.800 1.800 peak 682 spectrum 1 weight 0.10000E+01 volume 0.13330E-02 ppm1 3.965 ppm2 7.227 CV 1
ASSI { 683}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HN ))
2.800 1.000 1.000 peak 683 spectrum 1 weight 0.10000E+01 volume 0.22846E-02 ppm1 4.130 ppm2 6.890 CV 1
ASSI { 684}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HA ))
3.300 1.400 1.400 peak 684 spectrum 1 weight 0.10000E+01 volume 0.10775E-02 ppm1 4.118 ppm2 4.001 CV 1
ASSI { 685}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB ))
2.700 0.900 0.900 peak 685 spectrum 1 weight 0.10000E+01 volume 0.60950E-02 ppm1 4.124 ppm2 2.076 CV 1
ASSI { 691}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 5 and name HN ))
3.300 1.300 1.300 peak 691 spectrum 1 weight 0.10000E+01 volume 0.25537E-02 ppm1 4.069 ppm2 8.479 CV 1
ASSI { 694}
(( segid " " and resid 33 and name HA2 ))
(( segid " " and resid 33 and name HN ))
2.800 1.000 1.000 peak 694 spectrum 1 weight 0.10000E+01 volume 0.44920E-02 ppm1 3.994 ppm2 7.685 CV 1
ASSI { 696}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HN ))
3.100 1.200 1.200 peak 696 spectrum 1 weight 0.10000E+01 volume 0.13883E-02 ppm1 3.989 ppm2 8.596 CV 1
ASSI { 698}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HN ))
2.700 0.900 0.900 peak 698 spectrum 1 weight 0.10000E+01 volume 0.31024E-02 ppm1 3.961 ppm2 8.715 CV 1
ASSI { 699}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HN ))
2.700 0.900 0.900 peak 699 spectrum 1 weight 0.10000E+01 volume 0.29031E-02 ppm1 3.968 ppm2 8.266 CV 1
ASSI { 703}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name HN ))
3.600 1.600 1.600 peak 703 spectrum 1 weight 0.10000E+01 volume 0.15308E-02 ppm1 3.969 ppm2 7.890 CV 1
ASSI { 705}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 28 and name HD2 ))
2.900 1.100 1.100 peak 705 spectrum 1 weight 0.10000E+01 volume 0.93352E-03 ppm1 3.983 ppm2 3.097 CV 1
ASSI { 706}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HB2 ))
2.800 1.000 1.000 peak 706 spectrum 1 weight 0.10000E+01 volume 0.65504E-02 ppm1 3.954 ppm2 2.020 CV 1
ASSI { 708}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB2 ))
2.500 0.800 0.800 peak 708 spectrum 1 weight 0.10000E+01 volume 0.70475E-02 ppm1 3.969 ppm2 1.811 CV 1
ASSI { 709}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 14 and name HN ))
2.500 0.800 0.800 peak 709 spectrum 1 weight 0.10000E+01 volume 0.38975E-02 ppm1 3.960 ppm2 8.912 CV 1
ASSI { 711}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 15 and name HG2 ))
3.600 1.600 1.600 peak 711 spectrum 1 weight 0.10000E+01 volume 0.32320E-02 ppm1 3.963 ppm2 2.377 CV 1
ASSI { 713}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.800 2.800 3.200 peak 713 spectrum 1 weight 0.10000E+01 volume 0.38592E-02 ppm1 3.966 ppm2 2.145 CV 1
ASSI { 714}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB ))
3.200 1.300 1.300 peak 714 spectrum 1 weight 0.10000E+01 volume 0.19901E-02 ppm1 3.877 ppm2 1.633 CV 1
ASSI { 715}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 28 and name HB1 ))
3.200 1.300 1.300 peak 715 spectrum 1 weight 0.10000E+01 volume 0.42834E-02 ppm1 3.966 ppm2 1.604 CV 1
ASSI { 717}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB ))
3.500 1.500 1.500 peak 717 spectrum 1 weight 0.10000E+01 volume 0.72909E-03 ppm1 3.961 ppm2 1.144 CV 1
ASSI { 722}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HN ))
3.200 1.300 1.300 peak 722 spectrum 1 weight 0.10000E+01 volume 0.11845E-02 ppm1 3.864 ppm2 8.474 CV 1
ASSI { 723}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 55 and name HN ))
3.200 1.300 1.300 peak 723 spectrum 1 weight 0.10000E+01 volume 0.14888E-02 ppm1 3.802 ppm2 7.310 CV 1
ASSI { 726}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG2 ))
4.000 2.000 2.000 peak 726 spectrum 1 weight 0.10000E+01 volume 0.11581E-02 ppm1 3.864 ppm2 2.419 CV 1
ASSI { 729}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 43 and name HB ))
2.900 1.100 1.100 peak 729 spectrum 1 weight 0.10000E+01 volume 0.55247E-03 ppm1 3.816 ppm2 2.053 CV 1
ASSI { 734}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HN ))
2.400 0.700 0.700 peak 734 spectrum 1 weight 0.10000E+01 volume 0.32195E-02 ppm1 3.841 ppm2 9.052 CV 1
ASSI { 735}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HN ))
2.600 0.900 0.900 peak 735 spectrum 1 weight 0.10000E+01 volume 0.85491E-03 ppm1 3.839 ppm2 8.588 CV 1
ASSI { 736}
(( segid " " and resid 32 and name HA2 ))
(( segid " " and resid 32 and name HN ))
3.500 1.500 1.500 peak 736 spectrum 1 weight 0.10000E+01 volume 0.14550E-02 ppm1 3.765 ppm2 8.083 CV 1
ASSI { 748}
(( segid " " and resid 40 and name HA1 ))
(( segid " " and resid 47 and name HB ))
2.900 1.000 1.000 peak 748 spectrum 1 weight 0.10000E+01 volume 0.88066E-03 ppm1 3.696 ppm2 1.949 CV 1
ASSI { 759}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 50 and name HB2 ))
4.200 2.200 1.800 peak 759 spectrum 1 weight 0.10000E+01 volume 0.89563E-03 ppm1 3.579 ppm2 2.616 CV 1
ASSI { 760}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB ))
2.500 0.800 0.800 peak 760 spectrum 1 weight 0.10000E+01 volume 0.14335E-02 ppm1 3.574 ppm2 1.941 CV 1
ASSI { 762}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 31 and name HN ))
3.900 1.900 1.900 peak 762 spectrum 1 weight 0.10000E+01 volume 0.63172E-03 ppm1 3.501 ppm2 8.712 CV 1
ASSI { 766}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 28 and name HD2 ))
3.400 3.400 2.600 peak 766 spectrum 1 weight 0.10000E+01 volume 0.67347E-02 ppm1 3.496 ppm2 3.076 CV 1
ASSI { 767}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HN ))
2.900 1.000 1.000 peak 767 spectrum 1 weight 0.10000E+01 volume 0.10834E-02 ppm1 3.440 ppm2 8.068 CV 1
ASSI { 775}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 12 and name HG2 ))
3.700 1.700 1.700 peak 775 spectrum 1 weight 0.10000E+01 volume 0.92691E-03 ppm1 3.112 ppm2 1.913 CV 1
ASSI { 776}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 28 and name HG1 ))
2.400 0.700 0.700 peak 776 spectrum 1 weight 0.10000E+01 volume 0.39774E-02 ppm1 3.108 ppm2 1.333 CV 1
OR { 776}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 781}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 25 and name HE% )
3.100 1.200 1.200 peak 781 spectrum 1 weight 0.10000E+01 volume 0.16083E-02 ppm1 2.931 ppm2 6.685 CV 1
ASSI { 782}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 51 and name HE% )
3.600 1.600 1.600 peak 782 spectrum 1 weight 0.10000E+01 volume 0.32557E-02 ppm1 2.926 ppm2 6.596 CV 1
ASSI { 783}
(( segid " " and resid 7 and name HB2 ))
( segid " " and resid 7 and name HE% )
4.700 2.700 1.300 peak 783 spectrum 1 weight 0.10000E+01 volume 0.99608E-03 ppm1 2.865 ppm2 6.724 CV 1
ASSI { 794}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 31 and name HN ))
4.300 2.300 1.700 peak 794 spectrum 1 weight 0.10000E+01 volume 0.11018E-02 ppm1 3.088 ppm2 8.714 CV 1
ASSI { 819}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HN ))
3.400 1.400 1.400 peak 819 spectrum 1 weight 0.10000E+01 volume 0.27884E-02 ppm1 2.908 ppm2 7.926 CV 1
ASSI { 820}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 8 and name HN ))
3.500 1.500 1.500 peak 820 spectrum 1 weight 0.10000E+01 volume 0.47458E-03 ppm1 2.853 ppm2 7.962 CV 1
ASSI { 823}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 50 and name HB2 ))
2.500 2.500 3.500 peak 823 spectrum 1 weight 0.10000E+01 volume 0.14185E-01 ppm1 2.907 ppm2 2.639 CV 1
ASSI { 831}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HN ))
3.400 1.400 1.400 peak 831 spectrum 1 weight 0.10000E+01 volume 0.20597E-02 ppm1 2.851 ppm2 7.603 CV 1
ASSI { 832}
(( segid " " and resid 7 and name HB2 ))
( segid " " and resid 7 and name HD% )
2.000 0.500 0.500 peak 832 spectrum 1 weight 0.10000E+01 volume 0.99364E-02 ppm1 2.872 ppm2 7.177 CV 1
ASSI { 833}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 57 and name HD% )
3.700 1.700 1.700 peak 833 spectrum 1 weight 0.10000E+01 volume 0.99993E-03 ppm1 2.852 ppm2 7.065 CV 1
ASSI { 842}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 24 and name HB2 ))
2.200 0.600 0.600 peak 842 spectrum 1 weight 0.10000E+01 volume 0.43077E-02 ppm1 2.060 ppm2 1.732 CV 1
ASSI { 843}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 28 and name HB2 ))
2.400 0.700 0.700 peak 843 spectrum 1 weight 0.10000E+01 volume 0.33659E-02 ppm1 2.152 ppm2 1.613 CV 1
OR { 843}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 28 and name HB1 ))
ASSI { 847}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 24 and name HB2 ))
2.400 0.700 0.700 peak 847 spectrum 1 weight 0.10000E+01 volume 0.42869E-02 ppm1 2.199 ppm2 1.726 CV 1
ASSI { 849}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 52 and name HB2 ))
2.900 1.000 1.000 peak 849 spectrum 1 weight 0.10000E+01 volume 0.61470E-02 ppm1 2.413 ppm2 1.940 CV 1
ASSI { 851}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 36 and name HB2 ))
3.300 3.300 2.700 peak 851 spectrum 1 weight 0.10000E+01 volume 0.75549E-02 ppm1 2.205 ppm2 1.988 CV 1
ASSI { 852}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 12 and name HB2 ))
2.700 0.900 0.900 peak 852 spectrum 1 weight 0.10000E+01 volume 0.45511E-02 ppm1 1.932 ppm2 1.776 CV 1
ASSI { 853}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 47 and name HA ))
3.800 1.900 1.900 peak 853 spectrum 1 weight 0.10000E+01 volume 0.95369E-03 ppm1 2.748 ppm2 3.573 CV 1
ASSI { 854}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HN ))
3.000 1.100 1.100 peak 854 spectrum 1 weight 0.10000E+01 volume 0.46589E-02 ppm1 2.768 ppm2 8.494 CV 1
ASSI { 861}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 50 and name HN ))
3.700 1.800 1.800 peak 861 spectrum 1 weight 0.10000E+01 volume 0.24035E-02 ppm1 2.747 ppm2 7.891 CV 1
ASSI { 862}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 51 and name HN ))
4.700 2.800 1.300 peak 862 spectrum 1 weight 0.10000E+01 volume 0.83236E-03 ppm1 2.742 ppm2 7.474 CV 1
ASSI { 867}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
3.000 1.100 1.100 peak 867 spectrum 1 weight 0.10000E+01 volume 0.10378E-02 ppm1 2.719 ppm2 4.327 CV 1
ASSI { 869}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 25 and name HE% )
3.400 1.400 1.400 peak 869 spectrum 1 weight 0.10000E+01 volume 0.99055E-03 ppm1 2.702 ppm2 6.685 CV 1
ASSI { 871}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 49 and name HB2 ))
3.700 1.700 1.700 peak 871 spectrum 1 weight 0.10000E+01 volume 0.13309E-02 ppm1 2.617 ppm2 1.822 CV 1
ASSI { 872}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 49 and name HB2 ))
4.400 2.400 1.600 peak 872 spectrum 1 weight 0.10000E+01 volume 0.10799E-02 ppm1 2.711 ppm2 1.822 CV 1
ASSI { 891}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HN ))
2.900 1.000 1.000 peak 891 spectrum 1 weight 0.10000E+01 volume 0.41061E-02 ppm1 2.648 ppm2 8.500 CV 1
ASSI { 900}
(( segid " " and resid 5 and name HB2 ))
( segid " " and resid 7 and name HE% )
3.800 1.800 1.800 peak 900 spectrum 1 weight 0.10000E+01 volume 0.76313E-03 ppm1 2.612 ppm2 6.730 CV 1
ASSI { 902}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 46 and name HA ))
3.400 1.500 1.500 peak 902 spectrum 1 weight 0.10000E+01 volume 0.93352E-03 ppm1 2.613 ppm2 4.332 CV 1
ASSI { 903}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 46 and name HB2 ))
2.200 2.200 3.800 peak 903 spectrum 1 weight 0.10000E+01 volume 0.42938E-01 ppm1 2.607 ppm2 2.730 CV 1
ASSI { 915}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HN ))
2.600 0.800 0.800 peak 915 spectrum 1 weight 0.10000E+01 volume 0.23830E-02 ppm1 2.343 ppm2 8.131 CV 1
ASSI { 916}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HN ))
3.100 1.200 1.200 peak 916 spectrum 1 weight 0.10000E+01 volume 0.25391E-02 ppm1 2.233 ppm2 8.129 CV 1
ASSI { 917}
(( segid " " and resid 15 and name HG2 ))
( segid " " and resid 51 and name HD% )
3.400 1.400 1.400 peak 917 spectrum 1 weight 0.10000E+01 volume 0.53682E-03 ppm1 2.420 ppm2 6.963 CV 1
ASSI { 923}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 10 and name HN ))
2.700 0.900 0.900 peak 923 spectrum 1 weight 0.10000E+01 volume 0.18663E-02 ppm1 2.227 ppm2 8.585 CV 1
ASSI { 924}
(( segid " " and resid 15 and name HG2 ))
(( segid " " and resid 16 and name HN ))
2.100 0.600 0.600 peak 924 spectrum 1 weight 0.10000E+01 volume 0.24282E-02 ppm1 2.401 ppm2 8.730 CV 1
ASSI { 925}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 10 and name HN ))
3.400 1.400 1.400 peak 925 spectrum 1 weight 0.10000E+01 volume 0.81637E-03 ppm1 2.345 ppm2 8.582 CV 1
ASSI { 929}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 53 and name HN ))
3.300 1.400 1.400 peak 929 spectrum 1 weight 0.10000E+01 volume 0.46206E-02 ppm1 1.937 ppm2 8.700 CV 1
ASSI { 934}
(( segid " " and resid 9 and name HG2 ))
( segid " " and resid 7 and name HD% )
4.600 2.600 1.400 peak 934 spectrum 1 weight 0.10000E+01 volume 0.89248E-03 ppm1 2.343 ppm2 7.182 CV 1
ASSI { 950}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 29 and name HZ3 ))
4.500 2.500 1.500 peak 950 spectrum 1 weight 0.10000E+01 volume 0.97488E-03 ppm1 2.349 ppm2 7.513 CV 1
ASSI { 955}
(( segid " " and resid 36 and name HG2 ))
(( segid " " and resid 29 and name HE1 ))
3.800 1.800 1.800 peak 955 spectrum 1 weight 0.10000E+01 volume 0.11685E-02 ppm1 2.254 ppm2 10.122 CV 1
ASSI { 957}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 12 and name HN ))
2.700 0.900 0.900 peak 957 spectrum 1 weight 0.10000E+01 volume 0.17523E-02 ppm1 2.156 ppm2 7.224 CV 1
ASSI { 960}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HN ))
2.400 0.700 0.700 peak 960 spectrum 1 weight 0.10000E+01 volume 0.20506E-02 ppm1 2.154 ppm2 9.052 CV 1
ASSI { 963}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HN ))
3.400 1.400 1.400 peak 963 spectrum 1 weight 0.10000E+01 volume 0.11731E-02 ppm1 1.958 ppm2 7.993 CV 1
ASSI { 994}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 25 and name HN ))
3.200 1.300 1.300 peak 994 spectrum 1 weight 0.10000E+01 volume 0.19230E-02 ppm1 2.058 ppm2 9.195 CV 1
ASSI { 997}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 25 and name HE% )
3.700 1.700 1.700 peak 997 spectrum 1 weight 0.10000E+01 volume 0.18135E-02 ppm1 2.057 ppm2 6.683 CV 1
ASSI { 1005}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 37 and name HB2 ))
4.400 2.400 1.600 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.12968E-02 ppm1 2.041 ppm2 2.815 CV 1
ASSI { 1014}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HG2 ))
2.700 0.900 0.900 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.86852E-02 ppm1 1.989 ppm2 2.202 CV 1
ASSI { 1015}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HG2 ))
2.600 0.800 0.800 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.41756E-02 ppm1 2.024 ppm2 2.266 CV 1
ASSI { 1018}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HN ))
2.500 0.800 0.800 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.38766E-02 ppm1 1.645 ppm2 7.312 CV 1
ASSI { 1021}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 37 and name HZ2 ))
3.900 1.900 1.900 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.12899E-02 ppm1 1.977 ppm2 7.280 CV 1
ASSI { 1024}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HN ))
2.800 1.000 1.000 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.36263E-02 ppm1 1.935 ppm2 8.479 CV 1
ASSI { 1025}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 5 and name HN ))
2.700 0.900 0.900 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.38314E-02 ppm1 1.836 ppm2 8.497 CV 1
ASSI { 1026}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HA ))
2.800 1.000 1.000 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.28555E-02 ppm1 1.932 ppm2 3.861 CV 1
ASSI { 1029}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 11 and name HB2 ))
2.700 0.900 0.900 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.51560E-02 ppm1 1.875 ppm2 2.144 CV 1
ASSI { 1033}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 50 and name HN ))
1.800 0.400 0.400 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.32539E-02 ppm1 1.820 ppm2 7.893 CV 1
ASSI { 1036}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 4 and name HN ))
2.800 1.000 1.000 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.30144E-02 ppm1 1.847 ppm2 8.018 CV 1
ASSI { 1037}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 56 and name HN ))
4.100 2.100 1.900 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.14049E-02 ppm1 1.813 ppm2 7.994 CV 1
ASSI { 1038}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 4 and name HA ))
3.200 1.300 1.300 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.10875E-02 ppm1 1.854 ppm2 4.072 CV 1
ASSI { 1039}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HN ))
1.900 0.400 0.400 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.68458E-02 ppm1 1.821 ppm2 8.266 CV 1
ASSI { 1040}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 55 and name HA ))
3.700 3.700 2.300 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.29904E-02 ppm1 1.833 ppm2 4.183 CV 1
ASSI { 1043}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 51 and name HB2 ))
3.900 3.900 2.100 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.42938E-02 ppm1 1.825 ppm2 2.937 CV 1
ASSI { 1045}
(( segid " " and resid 4 and name HB ))
(( segid " " and resid 56 and name HB2 ))
2.700 2.700 3.300 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.88657E-02 ppm1 1.795 ppm2 1.958 CV 1
ASSI { 1046}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 14 and name HN ))
3.200 1.300 1.300 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.21511E-02 ppm1 1.627 ppm2 8.907 CV 1
ASSI { 1055}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 28 and name HB1 ))
3.100 1.200 1.200 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.83686E-02 ppm1 1.788 ppm2 1.598 CV 1
OR { 1055}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 28 and name HB2 ))
ASSI { 1060}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 29 and name HN ))
2.500 0.800 0.800 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.42104E-02 ppm1 1.599 ppm2 8.677 CV 1
OR { 1060}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 29 and name HN ))
ASSI { 1061}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HN ))
2.900 1.100 1.100 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.23482E-02 ppm1 1.600 ppm2 8.128 CV 1
OR { 1061}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HN ))
ASSI { 1062}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 19 and name HN ))
3.800 1.800 1.800 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.21020E-02 ppm1 1.617 ppm2 7.813 CV 1
ASSI { 1105}
(( segid " " and resid 28 and name HG1 ))
(( segid " " and resid 12 and name HN ))
3.200 1.300 1.300 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.18343E-02 ppm1 1.329 ppm2 7.222 CV 1
ASSI { 1122}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 37 and name HZ3 ))
2.900 1.100 1.100 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.29076E-02 ppm1 1.210 ppm2 6.685 CV 1
ASSI { 1124}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 16 and name HA ))
4.300 2.300 1.700 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.54168E-03 ppm1 1.212 ppm2 5.645 CV 1
ASSI { 1132}
(( segid " " and resid 13 and name HB ))
( segid " " and resid 51 and name HD% )
3.100 1.200 1.200 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.36437E-02 ppm1 1.133 ppm2 6.969 CV 1
ASSI { 1144}
(( segid " " and resid 13 and name HB ))
( segid " " and resid 7 and name HD% )
3.400 1.500 1.500 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.28301E-02 ppm1 1.123 ppm2 7.187 CV 1
ASSI { 1237}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HB ))
3.800 1.800 1.800 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.23489E-02 ppm1 0.500 ppm2 1.213 CV 1
ASSI { 1239}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 13 and name HN ))
4.800 2.900 1.200 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.43877E-03 ppm1 0.496 ppm2 8.493 CV 1
ASSI { 1241}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 28 and name HN ))
4.200 2.200 1.800 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.93178E-03 ppm1 0.497 ppm2 8.132 CV 1
ASSI { 1325}
(( segid " " and resid 54 and name HA2 ))
(( segid " " and resid 54 and name HA1 ))
1.900 0.500 0.500 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.75934E-02 ppm1 3.983 ppm2 3.789 CV 1
ASSI { 1326}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 41 and name HN ))
2.600 0.900 0.900 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.25519E-02 ppm1 3.839 ppm2 7.506 CV 1
ASSI { 1327}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 54 and name HN ))
3.100 1.200 1.200 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.28266E-02 ppm1 3.799 ppm2 7.643 CV 1
ASSI { 1332}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HN ))
2.900 1.100 1.100 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.11807E-02 ppm1 8.694 ppm2 8.477 CV 1
ASSI { 1333}
(( segid " " and resid 40 and name HA2 ))
( segid " " and resid 25 and name HD% )
3.100 1.200 1.200 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.28339E-02 ppm1 3.817 ppm2 6.802 CV 1
ASSI { 1334}
(( segid " " and resid 40 and name HA2 ))
( segid " " and resid 25 and name HE% )
3.800 1.800 1.800 peak 1334 spectrum 1 weight 0.10000E+01 volume 0.29560E-02 ppm1 3.818 ppm2 6.688 CV 1
ASSI { 1339}
(( segid " " and resid 40 and name HA1 ))
(( segid " " and resid 40 and name HN ))
2.500 0.800 0.800 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.23507E-02 ppm1 3.704 ppm2 8.674 CV 1
ASSI { 1340}
(( segid " " and resid 18 and name HA2 ))
(( segid " " and resid 18 and name HN ))
2.300 0.600 0.600 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.81528E-02 ppm1 3.628 ppm2 8.298 CV 1
ASSI { 1341}
(( segid " " and resid 18 and name HA2 ))
(( segid " " and resid 19 and name HN ))
2.700 0.900 0.900 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.56673E-02 ppm1 3.642 ppm2 7.811 CV 1
ASSI { 1345}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 28 and name HG1 ))
2.700 0.900 0.900 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.31688E-02 ppm1 2.153 ppm2 1.336 CV 1
OR { 1345}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 1349}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 28 and name HG1 ))
3.700 1.700 1.700 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.40296E-02 ppm1 1.789 ppm2 1.335 CV 1
OR { 1349}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 1352}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HG1 ))
1.800 0.400 0.400 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.23559E-01 ppm1 1.634 ppm2 1.331 CV 1
OR { 1352}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HG2 ))
OR { 1352}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HG2 ))
OR { 1352}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HG1 ))
ASSI { 1356}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 38 and name HB ))
2.200 0.600 0.600 peak 1356 spectrum 1 weight 0.10000E+01 volume 0.39427E-02 ppm1 2.212 ppm2 2.104 CV 1
Contact the webmaster for help, if required. Saturday, May 11, 2024 11:44:20 PM GMT (wattos1)