NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
8369 |
1m3v   |
5309 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 153}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HA ))
6.000 4.500 0.000 peak 153 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.783 ppm2 6.171 CV 1
ASSI { 154}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HA ))
6.000 4.500 0.000 peak 154 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.846 ppm2 5.598 CV 1
ASSI { 155}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name HA ))
6.000 4.500 0.000 peak 155 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.574 ppm2 5.673 CV 1
ASSI { 157}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HA ))
6.000 4.500 0.000 peak 157 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.896 ppm2 5.600 CV 1
ASSI { 158}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HA ))
6.000 4.500 0.000 peak 158 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.864 ppm2 5.390 CV 1
ASSI { 160}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HN ))
6.000 4.500 0.000 peak 160 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.158 ppm2 9.573 CV 1
ASSI { 162}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HN ))
6.000 4.500 0.000 peak 162 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.217 ppm2 9.208 CV 1
ASSI { 163}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 10 and name HN ))
6.000 4.500 0.000 peak 163 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.305 ppm2 9.117 CV 1
ASSI { 164}
(( segid " " and resid 106 and name HB ))
(( segid " " and resid 106 and name HN ))
6.000 4.500 0.000 peak 164 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.277 ppm2 9.063 CV 1
ASSI { 165}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HN ))
6.000 4.500 0.000 peak 165 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.465 ppm2 8.968 CV 1
ASSI { 166}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HN ))
6.000 4.500 0.000 peak 166 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.944 ppm2 9.151 CV 1
ASSI { 168}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 168 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.671 ppm2 9.133 CV 1
ASSI { 175}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 110 and name HN ))
6.000 4.500 0.000 peak 175 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.627 ppm2 8.810 CV 1
ASSI { 176}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HN ))
6.000 4.500 0.000 peak 176 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.636 ppm2 8.670 CV 1
ASSI { 177}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HN ))
6.000 4.500 0.000 peak 177 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.435 ppm2 8.661 CV 1
ASSI { 180}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 180 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.059 ppm2 8.844 CV 1
ASSI { 182}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HN ))
6.000 4.500 0.000 peak 182 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.419 ppm2 8.569 CV 1
ASSI { 183}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HN ))
6.000 4.500 0.000 peak 183 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.301 ppm2 8.492 CV 1
ASSI { 186}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 186 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.559 ppm2 8.369 CV 1
ASSI { 188}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HN ))
6.000 4.500 0.000 peak 188 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.510 ppm2 8.391 CV 1
ASSI { 193}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HN ))
6.000 4.500 0.000 peak 193 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.622 ppm2 8.301 CV 1
ASSI { 196}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HN ))
6.000 4.500 0.000 peak 196 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.093 ppm2 8.085 CV 1
ASSI { 197}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HN ))
6.000 4.500 0.000 peak 197 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.052 ppm2 7.754 CV 1
ASSI { 198}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 198 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.278 ppm2 7.793 CV 1
ASSI { 199}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HN ))
6.000 4.500 0.000 peak 199 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.387 ppm2 7.877 CV 1
ASSI { 207}
(( segid " " and resid 118 and name HA2 ))
(( segid " " and resid 118 and name HN ))
6.000 4.500 0.000 peak 207 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.950 ppm2 8.295 CV 1
OR { 207}
(( segid " " and resid 118 and name HA1 ))
(( segid " " and resid 118 and name HN ))
ASSI { 208}
(( segid " " and resid 95 and name HA2 ))
(( segid " " and resid 95 and name HN ))
6.000 4.500 0.000 peak 208 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.973 ppm2 8.275 CV 1
OR { 208}
(( segid " " and resid 95 and name HA1 ))
(( segid " " and resid 95 and name HN ))
ASSI { 213}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HN ))
6.000 4.500 0.000 peak 213 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.103 ppm2 8.259 CV 1
ASSI { 214}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HN ))
6.000 4.500 0.000 peak 214 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.128 ppm2 8.191 CV 1
ASSI { 215}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HN ))
6.000 4.500 0.000 peak 215 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.332 ppm2 8.131 CV 1
ASSI { 217}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 119 and name HN ))
6.000 4.500 0.000 peak 217 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.179 ppm2 7.983 CV 1
ASSI { 219}
(( segid " " and resid 122 and name HA ))
(( segid " " and resid 122 and name HN ))
6.000 4.500 0.000 peak 219 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.098 ppm2 7.915 CV 1
ASSI { 220}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 220 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.287 ppm2 7.816 CV 1
ASSI { 222}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 112 and name HN ))
6.000 4.500 0.000 peak 222 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.282 ppm2 7.882 CV 1
ASSI { 223}
(( segid " " and resid 12 and name HA1 ))
(( segid " " and resid 12 and name HN ))
6.000 4.500 0.000 peak 223 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.255 ppm2 8.133 CV 1
ASSI { 224}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HN ))
6.000 4.500 0.000 peak 224 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.305 ppm2 8.242 CV 1
ASSI { 227}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HN ))
6.000 4.500 0.000 peak 227 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.850 ppm2 7.866 CV 1
ASSI { 229}
(( segid " " and resid 88 and name HA2 ))
(( segid " " and resid 88 and name HN ))
6.000 4.500 0.000 peak 229 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.950 ppm2 8.418 CV 1
OR { 229}
(( segid " " and resid 88 and name HA1 ))
(( segid " " and resid 88 and name HN ))
ASSI { 231}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 104 and name HN ))
6.000 4.500 0.000 peak 231 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.384 ppm2 8.246 CV 1
ASSI { 232}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HN ))
6.000 4.500 0.000 peak 232 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.427 ppm2 8.124 CV 1
ASSI { 234}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 99 and name HN ))
6.000 4.500 0.000 peak 234 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.456 ppm2 7.857 CV 1
ASSI { 235}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HN ))
6.000 4.500 0.000 peak 235 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.445 ppm2 7.609 CV 1
ASSI { 236}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 236 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.635 ppm2 7.736 CV 1
ASSI { 238}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 116 and name HN ))
6.000 4.500 0.000 peak 238 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.249 ppm2 8.212 CV 1
ASSI { 239}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 89 and name HN ))
6.000 4.500 0.000 peak 239 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.618 ppm2 8.166 CV 1
ASSI { 240}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HN ))
6.000 4.500 0.000 peak 240 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.635 ppm2 8.113 CV 1
ASSI { 242}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HN ))
6.000 4.500 0.000 peak 242 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.581 ppm2 7.206 CV 1
ASSI { 243}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 243 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.519 ppm2 7.115 CV 1
ASSI { 248}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HN ))
6.000 4.500 0.000 peak 248 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.635 ppm2 6.672 CV 1
ASSI { 250}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HN ))
6.000 4.500 0.000 peak 250 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.155 ppm2 6.963 CV 1
ASSI { 253}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 23 and name HN ))
6.000 4.500 0.000 peak 253 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.021 ppm2 8.968 CV 1
ASSI { 254}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 23 and name HB% )
6.000 4.500 0.000 peak 254 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.466 ppm2 1.025 CV 1
ASSI { 257}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HB3 ))
6.000 4.500 0.000 peak 257 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.942 ppm2 1.618 CV 1
OR { 257}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HB2 ))
ASSI { 258}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HN ))
6.000 4.500 0.000 peak 258 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.617 ppm2 9.152 CV 1
OR { 258}
(( segid " " and resid 108 and name HB3 ))
(( segid " " and resid 108 and name HN ))
ASSI { 260}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 260 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.116 ppm2 9.117 CV 1
ASSI { 262}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HN ))
6.000 4.500 0.000 peak 262 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.572 ppm2 8.932 CV 1
ASSI { 264}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB3 ))
6.000 4.500 0.000 peak 264 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.576 ppm2 3.564 CV 1
ASSI { 266}
(( segid " " and resid 110 and name HB3 ))
(( segid " " and resid 110 and name HN ))
6.000 4.500 0.000 peak 266 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.437 ppm2 8.810 CV 1
ASSI { 268}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 110 and name HB2 ))
6.000 4.500 0.000 peak 268 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.627 ppm2 3.189 CV 1
ASSI { 269}
(( segid " " and resid 110 and name HB2 ))
(( segid " " and resid 110 and name HB3 ))
6.000 4.500 0.000 peak 269 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.188 ppm2 2.436 CV 1
ASSI { 272}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HB2 ))
6.000 4.500 0.000 peak 272 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.439 ppm2 1.926 CV 1
OR { 272}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HB3 ))
ASSI { 273}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HG2 ))
6.000 4.500 0.000 peak 273 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.438 ppm2 2.003 CV 1
OR { 273}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HG3 ))
ASSI { 274}
(( segid " " and resid 109 and name HB2 ))
(( segid " " and resid 109 and name HN ))
6.000 4.500 0.000 peak 274 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.922 ppm2 8.663 CV 1
OR { 274}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 109 and name HN ))
ASSI { 275}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 109 and name HN ))
6.000 4.500 0.000 peak 275 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.003 ppm2 8.663 CV 1
OR { 275}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 109 and name HN ))
ASSI { 276}
(( segid " " and resid 107 and name HG2 ))
(( segid " " and resid 107 and name HN ))
6.000 4.500 0.000 peak 276 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.591 ppm2 8.930 CV 1
ASSI { 277}
(( segid " " and resid 107 and name HG3 ))
(( segid " " and resid 107 and name HN ))
6.000 4.500 0.000 peak 277 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.458 ppm2 8.930 CV 1
ASSI { 278}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 107 and name HG2 ))
6.000 4.500 0.000 peak 278 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.015 ppm2 1.592 CV 1
ASSI { 279}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 107 and name HG3 ))
6.000 4.500 0.000 peak 279 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.015 ppm2 1.458 CV 1
ASSI { 281}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 107 and name HB2 ))
6.000 4.500 0.000 peak 281 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.015 ppm2 1.848 CV 1
ASSI { 282}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 107 and name HN ))
6.000 4.500 0.000 peak 282 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.848 ppm2 8.930 CV 1
ASSI { 283}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HB2 ))
6.000 4.500 0.000 peak 283 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.064 ppm2 2.412 CV 1
ASSI { 284}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 284 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.413 ppm2 8.844 CV 1
ASSI { 285}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 285 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.085 ppm2 8.845 CV 1
ASSI { 297}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HB2 ))
6.000 4.500 0.000 peak 297 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.427 ppm2 2.577 CV 1
ASSI { 298}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HB3 ))
6.000 4.500 0.000 peak 298 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.429 ppm2 2.428 CV 1
ASSI { 299}
(( segid " " and resid 114 and name HB3 ))
(( segid " " and resid 114 and name HN ))
6.000 4.500 0.000 peak 299 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.427 ppm2 8.124 CV 1
ASSI { 300}
(( segid " " and resid 114 and name HB2 ))
(( segid " " and resid 114 and name HN ))
6.000 4.500 0.000 peak 300 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.575 ppm2 8.124 CV 1
ASSI { 301}
(( segid " " and resid 113 and name HB3 ))
(( segid " " and resid 113 and name HN ))
6.000 4.500 0.000 peak 301 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.004 ppm2 7.554 CV 1
OR { 301}
(( segid " " and resid 113 and name HB2 ))
(( segid " " and resid 113 and name HN ))
ASSI { 302}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HN ))
6.000 4.500 0.000 peak 302 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.337 ppm2 7.554 CV 1
ASSI { 303}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 26 and name HN ))
6.000 4.500 0.000 peak 303 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.488 ppm2 7.206 CV 1
ASSI { 304}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HN ))
6.000 4.500 0.000 peak 304 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.574 ppm2 7.206 CV 1
ASSI { 306}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HN ))
6.000 4.500 0.000 peak 306 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.567 ppm2 7.323 CV 1
ASSI { 307}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB2 ))
6.000 4.500 0.000 peak 307 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.635 ppm2 3.151 CV 1
ASSI { 308}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 19 and name HB2 ))
3.100 3.100 2.900 peak 308 spectrum 1 weight 0.10000E+01 volume 0.78147E-02 ppm1 4.655 ppm2 2.983 CV 1
ASSI { 309}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 309 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.151 ppm2 7.735 CV 1
ASSI { 310}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 310 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.964 ppm2 7.735 CV 1
ASSI { 311}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB3 ))
6.000 4.500 0.000 peak 311 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.447 ppm2 3.277 CV 1
ASSI { 312}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 32 and name HN ))
6.000 4.500 0.000 peak 312 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.272 ppm2 7.611 CV 1
ASSI { 313}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HB2 ))
6.000 4.500 0.000 peak 313 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.052 ppm2 3.667 CV 1
ASSI { 314}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HB3 ))
6.000 4.500 0.000 peak 314 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.052 ppm2 3.576 CV 1
ASSI { 315}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HN ))
6.000 4.500 0.000 peak 315 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.571 ppm2 7.754 CV 1
ASSI { 316}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HN ))
6.000 4.500 0.000 peak 316 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.667 ppm2 7.755 CV 1
ASSI { 322}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 89 and name HN ))
6.000 4.500 0.000 peak 322 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.268 ppm2 8.166 CV 1
OR { 322}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name HN ))
ASSI { 325}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HN ))
6.000 4.500 0.000 peak 325 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.039 ppm2 8.166 CV 1
ASSI { 326}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 89 and name HN ))
6.000 4.500 0.000 peak 326 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.897 ppm2 8.166 CV 1
ASSI { 332}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 89 and name HB3 ))
6.000 4.500 0.000 peak 332 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.618 ppm2 1.897 CV 1
ASSI { 333}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name HB2 ))
6.000 4.500 0.000 peak 333 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.269 ppm2 2.039 CV 1
OR { 333}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 89 and name HB2 ))
ASSI { 334}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 89 and name HB3 ))
6.000 4.500 0.000 peak 334 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.269 ppm2 1.898 CV 1
OR { 334}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name HB3 ))
ASSI { 344}
(( segid " " and resid 122 and name HB2 ))
(( segid " " and resid 122 and name HN ))
6.000 4.500 0.000 peak 344 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.022 ppm2 7.915 CV 1
ASSI { 345}
(( segid " " and resid 122 and name HB3 ))
(( segid " " and resid 122 and name HN ))
6.000 4.500 0.000 peak 345 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.894 ppm2 7.914 CV 1
ASSI { 346}
(( segid " " and resid 96 and name HG2 ))
(( segid " " and resid 96 and name HN ))
6.000 4.500 0.000 peak 346 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.171 ppm2 8.492 CV 1
ASSI { 347}
(( segid " " and resid 96 and name HG3 ))
(( segid " " and resid 96 and name HN ))
6.000 4.500 0.000 peak 347 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.099 ppm2 8.491 CV 1
ASSI { 348}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 96 and name HN ))
6.000 4.500 0.000 peak 348 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.948 ppm2 8.491 CV 1
ASSI { 349}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 96 and name HN ))
6.000 4.500 0.000 peak 349 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.877 ppm2 8.491 CV 1
ASSI { 350}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HG2 ))
6.000 4.500 0.000 peak 350 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.301 ppm2 2.172 CV 1
ASSI { 351}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HG3 ))
6.000 4.500 0.000 peak 351 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.302 ppm2 2.107 CV 1
ASSI { 352}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HB2 ))
6.000 4.500 0.000 peak 352 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.302 ppm2 1.949 CV 1
ASSI { 353}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HB3 ))
6.000 4.500 0.000 peak 353 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.301 ppm2 1.877 CV 1
ASSI { 370}
(( segid " " and resid 104 and name HB3 ))
(( segid " " and resid 104 and name HN ))
6.000 4.500 0.000 peak 370 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.603 ppm2 8.247 CV 1
ASSI { 371}
(( segid " " and resid 104 and name HB2 ))
(( segid " " and resid 104 and name HN ))
6.000 4.500 0.000 peak 371 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.650 ppm2 8.247 CV 1
ASSI { 372}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 104 and name HB2 ))
6.000 4.500 0.000 peak 372 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.384 ppm2 1.654 CV 1
ASSI { 373}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 104 and name HB3 ))
6.000 4.500 0.000 peak 373 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.384 ppm2 1.604 CV 1
ASSI { 376}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HB ))
6.000 4.500 0.000 peak 376 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.128 ppm2 2.028 CV 1
ASSI { 377}
(( segid " " and resid 86 and name HA ))
( segid " " and resid 86 and name HG2%)
6.000 4.500 0.000 peak 377 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.128 ppm2 0.910 CV 1
OR { 377}
(( segid " " and resid 86 and name HA ))
( segid " " and resid 86 and name HG1%)
ASSI { 379}
(( segid " " and resid 86 and name HB ))
(( segid " " and resid 86 and name HN ))
6.000 4.500 0.000 peak 379 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.028 ppm2 8.191 CV 1
ASSI { 380}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 86 and name HN ))
6.000 4.500 0.000 peak 380 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.910 ppm2 8.191 CV 1
OR { 380}
( segid " " and resid 86 and name HG1%)
(( segid " " and resid 86 and name HN ))
ASSI { 381}
(( segid " " and resid 120 and name HA ))
(( segid " " and resid 120 and name HB2 ))
6.000 4.500 0.000 peak 381 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.636 ppm2 2.712 CV 1
ASSI { 382}
(( segid " " and resid 120 and name HA ))
(( segid " " and resid 120 and name HB3 ))
6.000 4.500 0.000 peak 382 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.636 ppm2 2.577 CV 1
ASSI { 393}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HB3 ))
6.000 4.500 0.000 peak 393 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.621 ppm2 2.583 CV 1
OR { 393}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HB2 ))
ASSI { 398}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HN ))
6.000 4.500 0.000 peak 398 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.582 ppm2 8.301 CV 1
OR { 398}
(( segid " " and resid 83 and name HB3 ))
(( segid " " and resid 83 and name HN ))
ASSI { 401}
(( segid " " and resid 91 and name HB ))
(( segid " " and resid 91 and name HN ))
6.000 4.500 0.000 peak 401 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.203 ppm2 8.242 CV 1
ASSI { 403}
(( segid " " and resid 91 and name HA ))
( segid " " and resid 91 and name HG2%)
6.000 4.500 0.000 peak 403 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.306 ppm2 1.218 CV 1
ASSI { 404}
(( segid " " and resid 91 and name HB ))
( segid " " and resid 91 and name HG2%)
6.000 4.500 0.000 peak 404 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.206 ppm2 1.218 CV 1
ASSI { 405}
(( segid " " and resid 87 and name HB ))
(( segid " " and resid 87 and name HN ))
6.000 4.500 0.000 peak 405 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.043 ppm2 8.260 CV 1
ASSI { 406}
( segid " " and resid 87 and name HG1%)
(( segid " " and resid 87 and name HN ))
6.000 4.500 0.000 peak 406 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.929 ppm2 8.260 CV 1
OR { 406}
( segid " " and resid 87 and name HG2%)
(( segid " " and resid 87 and name HN ))
ASSI { 408}
(( segid " " and resid 87 and name HA ))
( segid " " and resid 87 and name HG1%)
6.000 4.500 0.000 peak 408 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.103 ppm2 0.925 CV 1
OR { 408}
(( segid " " and resid 87 and name HA ))
( segid " " and resid 87 and name HG2%)
ASSI { 409}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB ))
6.000 4.500 0.000 peak 409 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.103 ppm2 2.044 CV 1
ASSI { 412}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HN ))
6.000 4.500 0.000 peak 412 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.987 ppm2 7.877 CV 1
ASSI { 413}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HN ))
6.000 4.500 0.000 peak 413 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.864 ppm2 7.877 CV 1
ASSI { 414}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HB2 ))
6.000 4.500 0.000 peak 414 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.384 ppm2 2.988 CV 1
ASSI { 422}
(( segid " " and resid 119 and name HB ))
(( segid " " and resid 119 and name HN ))
6.000 4.500 0.000 peak 422 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.846 ppm2 7.983 CV 1
ASSI { 423}
(( segid " " and resid 119 and name HG12))
(( segid " " and resid 119 and name HN ))
6.000 4.500 0.000 peak 423 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.380 ppm2 7.983 CV 1
ASSI { 425}
( segid " " and resid 119 and name HG2%)
(( segid " " and resid 119 and name HN ))
6.000 4.500 0.000 peak 425 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.876 ppm2 7.983 CV 1
ASSI { 426}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 119 and name HB ))
6.000 4.500 0.000 peak 426 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.178 ppm2 1.846 CV 1
ASSI { 427}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 119 and name HG12))
6.000 4.500 0.000 peak 427 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.180 ppm2 1.380 CV 1
ASSI { 428}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 119 and name HG13))
6.000 4.500 0.000 peak 428 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.179 ppm2 1.113 CV 1
ASSI { 429}
(( segid " " and resid 119 and name HA ))
( segid " " and resid 119 and name HG2%)
6.000 4.500 0.000 peak 429 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.179 ppm2 0.876 CV 1
ASSI { 430}
(( segid " " and resid 119 and name HA ))
( segid " " and resid 119 and name HD1%)
6.000 4.500 0.000 peak 430 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.179 ppm2 0.819 CV 1
ASSI { 431}
(( segid " " and resid 119 and name HB ))
(( segid " " and resid 119 and name HG12))
6.000 4.500 0.000 peak 431 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.846 ppm2 1.381 CV 1
ASSI { 433}
(( segid " " and resid 119 and name HB ))
( segid " " and resid 119 and name HG2%)
6.000 4.500 0.000 peak 433 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.846 ppm2 0.876 CV 1
ASSI { 434}
(( segid " " and resid 119 and name HB ))
( segid " " and resid 119 and name HD1%)
6.000 4.500 0.000 peak 434 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.845 ppm2 0.818 CV 1
ASSI { 441}
( segid " " and resid 119 and name HD1%)
(( segid " " and resid 119 and name HN ))
6.000 4.500 0.000 peak 441 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.821 ppm2 7.982 CV 1
ASSI { 443}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HB3 ))
6.000 4.500 0.000 peak 443 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.336 ppm2 3.004 CV 1
OR { 443}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HB2 ))
ASSI { 444}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HN ))
6.000 4.500 0.000 peak 444 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.952 ppm2 8.490 CV 1
ASSI { 447}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HN ))
3.000 1.100 1.100 peak 447 spectrum 1 weight 0.10000E+01 volume 0.98680E-02 ppm1 2.929 ppm2 8.489 CV 1
ASSI { 448}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HN ))
6.000 4.500 0.000 peak 448 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.758 ppm2 8.489 CV 1
ASSI { 452}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 452 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.993 ppm2 8.882 CV 1
ASSI { 453}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HN ))
6.000 4.500 0.000 peak 453 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.224 ppm2 8.580 CV 1
ASSI { 454}
( segid " " and resid 40 and name HB% )
(( segid " " and resid 40 and name HN ))
6.000 4.500 0.000 peak 454 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.399 ppm2 8.580 CV 1
ASSI { 455}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 40 and name HB% )
6.000 4.500 0.000 peak 455 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.228 ppm2 1.402 CV 1
ASSI { 463}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 112 and name HG2 ))
6.000 4.500 0.000 peak 463 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.279 ppm2 2.028 CV 1
OR { 463}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 112 and name HG3 ))
ASSI { 464}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 112 and name HB2 ))
6.000 4.500 0.000 peak 464 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.279 ppm2 1.772 CV 1
OR { 464}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 112 and name HB3 ))
ASSI { 466}
(( segid " " and resid 112 and name HG2 ))
(( segid " " and resid 112 and name HN ))
6.000 4.500 0.000 peak 466 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.023 ppm2 7.882 CV 1
OR { 466}
(( segid " " and resid 112 and name HG3 ))
(( segid " " and resid 112 and name HN ))
ASSI { 468}
(( segid " " and resid 112 and name HB2 ))
(( segid " " and resid 112 and name HN ))
6.000 4.500 0.000 peak 468 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.771 ppm2 7.881 CV 1
OR { 468}
(( segid " " and resid 112 and name HB3 ))
(( segid " " and resid 112 and name HN ))
ASSI { 470}
(( segid " " and resid 93 and name HG3 ))
(( segid " " and resid 93 and name HN ))
6.000 4.500 0.000 peak 470 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.508 ppm2 8.392 CV 1
OR { 470}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 93 and name HN ))
ASSI { 471}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HN ))
6.000 4.500 0.000 peak 471 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.104 ppm2 8.391 CV 1
ASSI { 472}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 93 and name HN ))
6.000 4.500 0.000 peak 472 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.017 ppm2 8.391 CV 1
ASSI { 474}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HG3 ))
6.000 4.500 0.000 peak 474 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.510 ppm2 2.507 CV 1
OR { 474}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HG2 ))
ASSI { 476}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HB2 ))
6.000 4.500 0.000 peak 476 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.509 ppm2 2.104 CV 1
ASSI { 477}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HB3 ))
6.000 4.500 0.000 peak 477 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.509 ppm2 2.019 CV 1
ASSI { 478}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HN ))
6.000 4.500 0.000 peak 478 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.102 ppm2 8.030 CV 1
ASSI { 480}
( segid " " and resid 84 and name HG2%)
(( segid " " and resid 84 and name HN ))
6.000 4.500 0.000 peak 480 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.912 ppm2 8.030 CV 1
OR { 480}
( segid " " and resid 84 and name HG1%)
(( segid " " and resid 84 and name HN ))
ASSI { 481}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HB ))
6.000 4.500 0.000 peak 481 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.100 ppm2 2.085 CV 1
ASSI { 482}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 84 and name HG1%)
6.000 4.500 0.000 peak 482 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.101 ppm2 0.913 CV 1
OR { 482}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 84 and name HG2%)
ASSI { 490}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 90 and name HD2 ))
2.600 0.900 0.900 peak 490 spectrum 1 weight 0.10000E+01 volume 0.20076E-01 ppm1 4.618 ppm2 3.819 CV 1
ASSI { 491}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HN ))
6.000 4.500 0.000 peak 491 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.595 ppm2 9.359 CV 1
ASSI { 493}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HN ))
6.000 4.500 0.000 peak 493 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.755 ppm2 10.041 CV 1
ASSI { 496}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HB2 ))
6.000 4.500 0.000 peak 496 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.633 ppm2 2.596 CV 1
ASSI { 498}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HN ))
6.000 4.500 0.000 peak 498 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.895 ppm2 9.360 CV 1
ASSI { 499}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
2.400 0.700 0.700 peak 499 spectrum 1 weight 0.10000E+01 volume 0.35061E-01 ppm1 4.464 ppm2 10.041 CV 1
ASSI { 500}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB3 ))
6.000 4.500 0.000 peak 500 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.758 ppm2 2.279 CV 1
ASSI { 502}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HN ))
6.000 4.500 0.000 peak 502 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.280 ppm2 10.041 CV 1
ASSI { 503}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HN ))
6.000 4.500 0.000 peak 503 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.079 ppm2 10.041 CV 1
ASSI { 504}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HN ))
2.600 0.900 0.900 peak 504 spectrum 1 weight 0.10000E+01 volume 0.21847E-01 ppm1 3.761 ppm2 8.490 CV 1
ASSI { 540}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 540 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.417 ppm2 7.794 CV 1
ASSI { 541}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 541 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.109 ppm2 7.793 CV 1
ASSI { 542}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB2 ))
6.000 4.500 0.000 peak 542 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.279 ppm2 1.432 CV 1
ASSI { 543}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HG2 ))
6.000 4.500 0.000 peak 543 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.279 ppm2 1.107 CV 1
ASSI { 550}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 51 and name HN ))
6.000 4.500 0.000 peak 550 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.983 ppm2 8.570 CV 1
ASSI { 551}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HG2%)
6.000 4.500 0.000 peak 551 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.421 ppm2 1.093 CV 1
ASSI { 552}
(( segid " " and resid 51 and name HB ))
( segid " " and resid 51 and name HG2%)
6.000 4.500 0.000 peak 552 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.997 ppm2 1.094 CV 1
ASSI { 553}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB ))
6.000 4.500 0.000 peak 553 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.421 ppm2 3.991 CV 1
ASSI { 557}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 557 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.574 ppm2 9.135 CV 1
ASSI { 558}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HA ))
6.000 4.500 0.000 peak 558 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.486 ppm2 5.672 CV 1
ASSI { 559}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 559 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.491 ppm2 9.134 CV 1
ASSI { 560}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HB3 ))
6.000 4.500 0.000 peak 560 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.486 ppm2 2.575 CV 1
ASSI { 561}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HN ))
6.000 4.500 0.000 peak 561 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.782 ppm2 9.570 CV 1
ASSI { 562}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 106 and name HN ))
6.000 4.500 0.000 peak 562 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.303 ppm2 9.063 CV 1
ASSI { 567}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HB2 ))
6.000 4.500 0.000 peak 567 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.468 ppm2 2.282 CV 1
ASSI { 568}
(( segid " " and resid 90 and name HD2 ))
(( segid " " and resid 90 and name HB2 ))
6.000 4.500 0.000 peak 568 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.819 ppm2 2.281 CV 1
ASSI { 569}
(( segid " " and resid 90 and name HD3 ))
(( segid " " and resid 90 and name HB2 ))
6.000 4.500 0.000 peak 569 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.724 ppm2 2.281 CV 1
ASSI { 572}
(( segid " " and resid 90 and name HD3 ))
(( segid " " and resid 90 and name HB3 ))
6.000 4.500 0.000 peak 572 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.724 ppm2 1.919 CV 1
ASSI { 575}
(( segid " " and resid 90 and name HD2 ))
(( segid " " and resid 90 and name HB3 ))
6.000 4.500 0.000 peak 575 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.819 ppm2 1.920 CV 1
ASSI { 600}
(( segid " " and resid 90 and name HD3 ))
(( segid " " and resid 90 and name HG2 ))
6.000 4.500 0.000 peak 600 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.724 ppm2 2.028 CV 1
OR { 600}
(( segid " " and resid 90 and name HD3 ))
(( segid " " and resid 90 and name HG3 ))
ASSI { 602}
(( segid " " and resid 90 and name HD2 ))
(( segid " " and resid 90 and name HG3 ))
6.000 4.500 0.000 peak 602 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.819 ppm2 2.028 CV 1
ASSI { 603}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HG2 ))
6.000 4.500 0.000 peak 603 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.470 ppm2 2.028 CV 1
OR { 603}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HG3 ))
ASSI { 604}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HB3 ))
6.000 4.500 0.000 peak 604 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.468 ppm2 1.920 CV 1
ASSI { 618}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 107 and name HG3 ))
6.000 4.500 0.000 peak 618 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.910 ppm2 1.459 CV 1
OR { 618}
(( segid " " and resid 107 and name HD3 ))
(( segid " " and resid 107 and name HG3 ))
ASSI { 623}
(( segid " " and resid 107 and name HD3 ))
(( segid " " and resid 107 and name HG2 ))
6.000 4.500 0.000 peak 623 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.910 ppm2 1.592 CV 1
OR { 623}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 107 and name HG2 ))
ASSI { 624}
(( segid " " and resid 107 and name HD3 ))
(( segid " " and resid 107 and name HB2 ))
6.000 4.500 0.000 peak 624 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.910 ppm2 1.849 CV 1
OR { 624}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 107 and name HB2 ))
ASSI { 625}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 107 and name HG2 ))
6.000 4.500 0.000 peak 625 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.862 ppm2 1.594 CV 1
ASSI { 639}
(( segid " " and resid 46 and name HA2 ))
(( segid " " and resid 46 and name HN ))
6.000 4.500 0.000 peak 639 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.208 ppm2 7.641 CV 1
ASSI { 640}
(( segid " " and resid 46 and name HA1 ))
(( segid " " and resid 46 and name HN ))
6.000 4.500 0.000 peak 640 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.295 ppm2 7.642 CV 1
ASSI { 641}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 641 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.811 ppm2 8.933 CV 1
ASSI { 642}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 642 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.596 ppm2 8.631 CV 1
ASSI { 647}
(( segid " " and resid 106 and name HA ))
( segid " " and resid 106 and name HG2%)
6.000 4.500 0.000 peak 647 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.638 ppm2 1.309 CV 1
ASSI { 649}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 37 and name HN ))
6.000 4.500 0.000 peak 649 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.565 ppm2 8.930 CV 1
ASSI { 650}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 110 and name HB3 ))
6.000 4.500 0.000 peak 650 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.625 ppm2 2.437 CV 1
ASSI { 653}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HB3 ))
6.000 4.500 0.000 peak 653 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.062 ppm2 2.098 CV 1
ASSI { 654}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 51 and name HN ))
6.000 4.500 0.000 peak 654 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.088 ppm2 8.569 CV 1
ASSI { 657}
(( segid " " and resid 93 and name HG3 ))
(( segid " " and resid 93 and name HB2 ))
6.000 4.500 0.000 peak 657 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.507 ppm2 2.104 CV 1
OR { 657}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 93 and name HB2 ))
ASSI { 658}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 93 and name HB3 ))
6.000 4.500 0.000 peak 658 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.507 ppm2 2.019 CV 1
OR { 658}
(( segid " " and resid 93 and name HG3 ))
(( segid " " and resid 93 and name HB3 ))
ASSI { 679}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB2 ))
6.000 4.500 0.000 peak 679 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.446 ppm2 3.456 CV 1
ASSI { 680}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HN ))
6.000 4.500 0.000 peak 680 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.459 ppm2 7.611 CV 1
ASSI { 685}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB2 ))
6.000 4.500 0.000 peak 685 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.581 ppm2 3.573 CV 1
ASSI { 686}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB3 ))
6.000 4.500 0.000 peak 686 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.581 ppm2 3.488 CV 1
ASSI { 687}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HB ))
6.000 4.500 0.000 peak 687 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.514 ppm2 2.165 CV 1
ASSI { 688}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 688 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.162 ppm2 7.116 CV 1
ASSI { 694}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HB2 ))
6.000 4.500 0.000 peak 694 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.567 ppm2 1.904 CV 1
ASSI { 695}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HN ))
6.000 4.500 0.000 peak 695 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.900 ppm2 7.323 CV 1
ASSI { 697}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HN ))
6.000 4.500 0.000 peak 697 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.250 ppm2 8.038 CV 1
ASSI { 698}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HN ))
6.000 4.500 0.000 peak 698 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.532 ppm2 8.038 CV 1
ASSI { 699}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 115 and name HN ))
6.000 4.500 0.000 peak 699 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.140 ppm2 8.039 CV 1
ASSI { 700}
( segid " " and resid 115 and name HB% )
(( segid " " and resid 115 and name HN ))
6.000 4.500 0.000 peak 700 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.368 ppm2 8.039 CV 1
ASSI { 701}
(( segid " " and resid 115 and name HA ))
( segid " " and resid 115 and name HB% )
6.000 4.500 0.000 peak 701 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.139 ppm2 1.374 CV 1
ASSI { 702}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HN ))
6.000 4.500 0.000 peak 702 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.822 ppm2 8.284 CV 1
ASSI { 709}
(( segid " " and resid 84 and name HB ))
(( segid " " and resid 84 and name HN ))
6.000 4.500 0.000 peak 709 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.070 ppm2 8.030 CV 1
ASSI { 716}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 90 and name HG3 ))
6.000 4.500 0.000 peak 716 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.281 ppm2 2.028 CV 1
OR { 716}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 90 and name HG2 ))
ASSI { 717}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 90 and name HB3 ))
6.000 4.500 0.000 peak 717 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.280 ppm2 1.921 CV 1
ASSI { 724}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HB2 ))
6.000 4.500 0.000 peak 724 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.277 ppm2 1.483 CV 1
ASSI { 726}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 92 and name HD1%)
6.000 4.500 0.000 peak 726 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.277 ppm2 0.779 CV 1
ASSI { 727}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 92 and name HD2%)
6.000 4.500 0.000 peak 727 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.278 ppm2 0.730 CV 1
ASSI { 728}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HB3 ))
6.000 4.500 0.000 peak 728 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.277 ppm2 1.309 CV 1
ASSI { 729}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 92 and name HB3 ))
6.000 4.500 0.000 peak 729 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.483 ppm2 1.307 CV 1
ASSI { 730}
(( segid " " and resid 92 and name HB2 ))
( segid " " and resid 92 and name HD1%)
6.000 4.500 0.000 peak 730 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.481 ppm2 0.779 CV 1
ASSI { 731}
(( segid " " and resid 92 and name HB2 ))
( segid " " and resid 92 and name HD2%)
6.000 4.500 0.000 peak 731 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.482 ppm2 0.731 CV 1
ASSI { 732}
(( segid " " and resid 92 and name HB3 ))
( segid " " and resid 92 and name HD2%)
6.000 4.500 0.000 peak 732 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.309 ppm2 0.731 CV 1
ASSI { 733}
(( segid " " and resid 92 and name HB3 ))
( segid " " and resid 92 and name HD1%)
6.000 4.500 0.000 peak 733 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.310 ppm2 0.780 CV 1
ASSI { 739}
(( segid " " and resid 18 and name HD2 ))
(( segid " " and resid 18 and name HB2 ))
6.000 4.500 0.000 peak 739 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.827 ppm2 1.430 CV 1
OR { 739}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name HB2 ))
ASSI { 743}
(( segid " " and resid 18 and name HD2 ))
(( segid " " and resid 18 and name HG2 ))
6.000 4.500 0.000 peak 743 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.827 ppm2 1.063 CV 1
OR { 743}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name HG2 ))
ASSI { 748}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name HG3 ))
6.000 4.500 0.000 peak 748 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.827 ppm2 0.766 CV 1
OR { 748}
(( segid " " and resid 18 and name HD2 ))
(( segid " " and resid 18 and name HG3 ))
ASSI { 759}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HN ))
6.000 4.500 0.000 peak 759 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.689 ppm2 8.100 CV 1
ASSI { 764}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 66 and name HB2 ))
6.000 4.500 0.000 peak 764 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.041 ppm2 1.948 CV 1
ASSI { 765}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HN ))
6.000 4.500 0.000 peak 765 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.763 ppm2 7.561 CV 1
ASSI { 769}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HN ))
6.000 4.500 0.000 peak 769 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.355 ppm2 8.349 CV 1
ASSI { 771}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 771 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.353 ppm2 8.536 CV 1
ASSI { 772}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HN ))
6.000 4.500 0.000 peak 772 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.508 ppm2 8.342 CV 1
ASSI { 777}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB2 ))
6.000 4.500 0.000 peak 777 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.378 ppm2 3.934 CV 1
ASSI { 778}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB3 ))
6.000 4.500 0.000 peak 778 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.378 ppm2 3.878 CV 1
ASSI { 779}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HB2 ))
6.000 4.500 0.000 peak 779 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.353 ppm2 3.759 CV 1
ASSI { 780}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HB3 ))
6.000 4.500 0.000 peak 780 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.353 ppm2 3.709 CV 1
ASSI { 808}
(( segid " " and resid 5 and name HZ3 ))
(( segid " " and resid 5 and name HE3 ))
6.000 4.500 0.000 peak 808 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.963 ppm2 7.525 CV 1
ASSI { 809}
(( segid " " and resid 5 and name HZ3 ))
(( segid " " and resid 5 and name HZ2 ))
6.000 4.500 0.000 peak 809 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.962 ppm2 7.458 CV 1
ASSI { 811}
(( segid " " and resid 5 and name HZ3 ))
(( segid " " and resid 5 and name HH2 ))
6.000 4.500 0.000 peak 811 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.963 ppm2 7.176 CV 1
ASSI { 812}
(( segid " " and resid 5 and name HH2 ))
(( segid " " and resid 5 and name HE3 ))
6.000 4.500 0.000 peak 812 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.172 ppm2 7.528 CV 1
ASSI { 813}
(( segid " " and resid 5 and name HD1 ))
(( segid " " and resid 5 and name HE3 ))
6.000 4.500 0.000 peak 813 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.195 ppm2 7.528 CV 1
ASSI { 815}
(( segid " " and resid 5 and name HH2 ))
(( segid " " and resid 5 and name HZ2 ))
6.000 4.500 0.000 peak 815 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.171 ppm2 7.456 CV 1
ASSI { 816}
(( segid " " and resid 5 and name HD1 ))
(( segid " " and resid 5 and name HZ2 ))
6.000 4.500 0.000 peak 816 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.195 ppm2 7.458 CV 1
ASSI { 826}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HD1 ))
6.000 4.500 0.000 peak 826 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.636 ppm2 7.202 CV 1
ASSI { 827}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HE3 ))
6.000 4.500 0.000 peak 827 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.637 ppm2 7.527 CV 1
ASSI { 828}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HE3 ))
6.000 4.500 0.000 peak 828 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.151 ppm2 7.526 CV 1
ASSI { 829}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HD1 ))
6.000 4.500 0.000 peak 829 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.151 ppm2 7.201 CV 1
ASSI { 830}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 5 and name HE3 ))
6.000 4.500 0.000 peak 830 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.964 ppm2 7.526 CV 1
ASSI { 831}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 5 and name HD1 ))
6.000 4.500 0.000 peak 831 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.966 ppm2 7.201 CV 1
ASSI { 832}
(( segid " " and resid 5 and name HD1 ))
(( segid " " and resid 5 and name HE1 ))
6.000 4.500 0.000 peak 832 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.194 ppm2 10.194 CV 1
ASSI { 835}
( segid " " and resid 33 and name HD1%)
( segid " " and resid 33 and name HD2%)
6.000 4.500 0.000 peak 835 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.010 ppm2 -0.810 CV 1
ASSI { 846}
( segid " " and resid 66 and name HD% )
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 846 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.001 ppm2 7.161 CV 1
ASSI { 852}
( segid " " and resid 62 and name HE% )
( segid " " and resid 62 and name HD% )
6.000 4.500 0.000 peak 852 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.409 ppm2 6.520 CV 1
ASSI { 854}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 24 and name HN ))
3.000 1.100 1.100 peak 854 spectrum 1 weight 0.10000E+01 volume 0.10427E-01 ppm1 1.016 ppm2 10.039 CV 1
ASSI { 855}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 25 and name HN ))
6.000 4.500 0.000 peak 855 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.079 ppm2 8.491 CV 1
ASSI { 856}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 25 and name HN ))
3.700 1.700 1.700 peak 856 spectrum 1 weight 0.10000E+01 volume 0.25473E-02 ppm1 2.278 ppm2 8.491 CV 1
ASSI { 859}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 22 and name HD% )
6.000 4.500 0.000 peak 859 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.596 ppm2 7.224 CV 1
ASSI { 866}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 22 and name HD% )
6.000 4.500 0.000 peak 866 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.686 ppm2 7.223 CV 1
ASSI { 867}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 22 and name HE% )
6.000 4.500 0.000 peak 867 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.685 ppm2 6.709 CV 1
ASSI { 868}
( segid " " and resid 19 and name HD% )
(( segid " " and resid 19 and name HN ))
6.000 4.500 0.000 peak 868 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.148 ppm2 7.877 CV 1
ASSI { 874}
(( segid " " and resid 19 and name HB3 ))
( segid " " and resid 19 and name HD% )
6.000 4.500 0.000 peak 874 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.864 ppm2 7.159 CV 1
ASSI { 875}
(( segid " " and resid 19 and name HB3 ))
( segid " " and resid 19 and name HE% )
6.000 4.500 0.000 peak 875 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.864 ppm2 7.299 CV 1
ASSI { 876}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 19 and name HE% )
6.000 4.500 0.000 peak 876 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.987 ppm2 7.298 CV 1
ASSI { 877}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 19 and name HD% )
6.000 4.500 0.000 peak 877 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.987 ppm2 7.158 CV 1
ASSI { 879}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 20 and name HN ))
3.000 1.100 1.100 peak 879 spectrum 1 weight 0.10000E+01 volume 0.10240E-01 ppm1 2.868 ppm2 9.281 CV 1
ASSI { 880}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 20 and name HN ))
2.800 2.800 3.200 peak 880 spectrum 1 weight 0.10000E+01 volume 0.15455E-01 ppm1 2.990 ppm2 9.280 CV 1
ASSI { 886}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HN ))
6.000 4.500 0.000 peak 886 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.914 ppm2 9.240 CV 1
ASSI { 887}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 51 and name HN ))
6.000 4.500 0.000 peak 887 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.415 ppm2 8.571 CV 1
ASSI { 888}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 51 and name HN ))
3.200 1.300 1.300 peak 888 spectrum 1 weight 0.10000E+01 volume 0.68503E-02 ppm1 2.084 ppm2 8.571 CV 1
ASSI { 899}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 6 and name HN ))
2.900 1.100 1.100 peak 899 spectrum 1 weight 0.10000E+01 volume 0.11620E-01 ppm1 3.150 ppm2 9.206 CV 1
ASSI { 900}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 6 and name HN ))
3.300 1.300 1.300 peak 900 spectrum 1 weight 0.10000E+01 volume 0.56397E-02 ppm1 2.969 ppm2 9.206 CV 1
ASSI { 901}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 20 and name HD2%)
6.000 4.500 0.000 peak 901 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.987 ppm2 0.765 CV 1
ASSI { 906}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 20 and name HN ))
6.000 4.500 0.000 peak 906 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.761 ppm2 9.280 CV 1
ASSI { 907}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 20 and name HN ))
6.000 4.500 0.000 peak 907 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.975 ppm2 9.280 CV 1
ASSI { 908}
(( segid " " and resid 20 and name HG ))
(( segid " " and resid 20 and name HN ))
6.000 4.500 0.000 peak 908 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.661 ppm2 9.280 CV 1
ASSI { 909}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name HN ))
6.000 4.500 0.000 peak 909 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.783 ppm2 9.281 CV 1
ASSI { 910}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 21 and name HN ))
2.600 0.900 0.900 peak 910 spectrum 1 weight 0.10000E+01 volume 0.20561E-01 ppm1 4.872 ppm2 8.631 CV 1
ASSI { 914}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 914 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.757 ppm2 8.630 CV 1
ASSI { 916}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 916 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.979 ppm2 8.631 CV 1
ASSI { 917}
(( segid " " and resid 20 and name HG ))
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 917 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.659 ppm2 8.631 CV 1
ASSI { 918}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 21 and name HN ))
3.000 1.100 1.100 peak 918 spectrum 1 weight 0.10000E+01 volume 0.97698E-02 ppm1 1.784 ppm2 8.631 CV 1
ASSI { 923}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 57 and name HN ))
3.000 1.100 1.100 peak 923 spectrum 1 weight 0.10000E+01 volume 0.92938E-02 ppm1 8.839 ppm2 9.571 CV 1
ASSI { 924}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 57 and name HN ))
2.300 0.700 0.700 peak 924 spectrum 1 weight 0.10000E+01 volume 0.46324E-01 ppm1 4.635 ppm2 9.571 CV 1
ASSI { 925}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HN ))
6.000 4.500 0.000 peak 925 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.974 ppm2 9.570 CV 1
ASSI { 926}
( segid " " and resid 57 and name HD2%)
(( segid " " and resid 57 and name HN ))
6.000 4.500 0.000 peak 926 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.161 ppm2 9.570 CV 1
OR { 926}
( segid " " and resid 57 and name HD1%)
(( segid " " and resid 57 and name HN ))
ASSI { 929}
(( segid " " and resid 28 and name HZ2 ))
(( segid " " and resid 28 and name HE1 ))
6.000 4.500 0.000 peak 929 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.120 ppm2 9.576 CV 1
ASSI { 930}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 28 and name HE1 ))
6.000 4.500 0.000 peak 930 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.945 ppm2 9.577 CV 1
ASSI { 931}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HE1 ))
3.000 3.000 3.000 peak 931 spectrum 1 weight 0.10000E+01 volume 0.94114E-02 ppm1 5.597 ppm2 9.577 CV 1
OR { 931}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 28 and name HE1 ))
ASSI { 935}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 28 and name HE1 ))
2.600 0.900 0.900 peak 935 spectrum 1 weight 0.10000E+01 volume 0.21446E-01 ppm1 1.016 ppm2 9.576 CV 1
ASSI { 937}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HN ))
3.000 1.100 1.100 peak 937 spectrum 1 weight 0.10000E+01 volume 0.10059E-01 ppm1 8.486 ppm2 10.041 CV 1
ASSI { 939}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HN ))
2.800 1.000 1.000 peak 939 spectrum 1 weight 0.10000E+01 volume 0.13493E-01 ppm1 8.926 ppm2 10.177 CV 1
ASSI { 941}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 36 and name HN ))
3.100 1.200 1.200 peak 941 spectrum 1 weight 0.10000E+01 volume 0.75297E-02 ppm1 6.166 ppm2 10.177 CV 1
ASSI { 942}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HN ))
2.300 0.700 0.700 peak 942 spectrum 1 weight 0.10000E+01 volume 0.47998E-01 ppm1 4.483 ppm2 10.177 CV 1
ASSI { 943}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HN ))
6.000 4.500 0.000 peak 943 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.281 ppm2 10.177 CV 1
ASSI { 944}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HN ))
6.000 4.500 0.000 peak 944 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.878 ppm2 10.177 CV 1
OR { 944}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 36 and name HN ))
ASSI { 945}
( segid " " and resid 57 and name HD1%)
(( segid " " and resid 36 and name HN ))
2.800 1.000 1.000 peak 945 spectrum 1 weight 0.10000E+01 volume 0.13132E-01 ppm1 1.156 ppm2 10.177 CV 1
ASSI { 949}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 42 and name HN ))
2.700 0.900 0.900 peak 949 spectrum 1 weight 0.10000E+01 volume 0.16617E-01 ppm1 5.280 ppm2 7.950 CV 1
ASSI { 952}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 952 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.167 ppm2 7.945 CV 1
ASSI { 975}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HN ))
2.600 0.900 0.900 peak 975 spectrum 1 weight 0.10000E+01 volume 0.21031E-01 ppm1 8.831 ppm2 9.116 CV 1
ASSI { 976}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 61 and name HN ))
2.600 0.900 0.900 peak 976 spectrum 1 weight 0.10000E+01 volume 0.21751E-01 ppm1 8.346 ppm2 9.115 CV 1
ASSI { 978}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 978 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.533 ppm2 9.118 CV 1
ASSI { 984}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 20 and name HN ))
3.200 1.300 1.300 peak 984 spectrum 1 weight 0.10000E+01 volume 0.62028E-02 ppm1 4.435 ppm2 9.280 CV 1
ASSI { 985}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 6 and name HN ))
6.000 4.500 0.000 peak 985 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.586 ppm2 9.208 CV 1
OR { 985}
(( segid " " and resid 6 and name HG3 ))
(( segid " " and resid 6 and name HN ))
ASSI { 986}
(( segid " " and resid 6 and name HD3 ))
(( segid " " and resid 6 and name HN ))
6.000 4.500 0.000 peak 986 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.956 ppm2 9.208 CV 1
ASSI { 987}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HN ))
6.000 4.500 0.000 peak 987 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.190 ppm2 9.206 CV 1
ASSI { 988}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HN ))
6.000 4.500 0.000 peak 988 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.442 ppm2 9.208 CV 1
OR { 988}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HN ))
ASSI { 991}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 10 and name HN ))
2.800 1.000 1.000 peak 991 spectrum 1 weight 0.10000E+01 volume 0.14763E-01 ppm1 0.230 ppm2 9.114 CV 1
ASSI { 993}
(( segid " " and resid 28 and name HE3 ))
(( segid " " and resid 10 and name HN ))
6.000 4.500 0.000 peak 993 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.144 ppm2 9.115 CV 1
ASSI { 994}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HN ))
2.600 0.800 0.800 peak 994 spectrum 1 weight 0.10000E+01 volume 0.23190E-01 ppm1 8.084 ppm2 9.115 CV 1
ASSI { 995}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 10 and name HN ))
2.900 1.100 1.100 peak 995 spectrum 1 weight 0.10000E+01 volume 0.11306E-01 ppm1 8.739 ppm2 9.116 CV 1
ASSI { 996}
(( segid " " and resid 28 and name HE3 ))
(( segid " " and resid 29 and name HN ))
3.700 1.800 1.800 peak 996 spectrum 1 weight 0.10000E+01 volume 0.25224E-02 ppm1 7.147 ppm2 9.242 CV 1
ASSI { 999}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HN ))
6.000 4.500 0.000 peak 999 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.534 ppm2 9.242 CV 1
ASSI { 1004}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.958 ppm2 9.134 CV 1
OR { 1004}
(( segid " " and resid 6 and name HD3 ))
(( segid " " and resid 28 and name HN ))
ASSI { 1005}
( segid " " and resid 108 and name HD1%)
(( segid " " and resid 108 and name HN ))
6.000 4.500 0.000 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.961 ppm2 9.151 CV 1
OR { 1005}
( segid " " and resid 108 and name HD2%)
(( segid " " and resid 108 and name HN ))
ASSI { 1009}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 61 and name HN ))
4.000 2.000 2.000 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.15926E-02 ppm1 3.470 ppm2 9.117 CV 1
OR { 1009}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 61 and name HN ))
ASSI { 1013}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.945 ppm2 9.136 CV 1
ASSI { 1014}
( segid " " and resid 22 and name HD% )
(( segid " " and resid 28 and name HN ))
3.600 1.600 1.600 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.33733E-02 ppm1 7.219 ppm2 9.137 CV 1
ASSI { 1017}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 22 and name HN ))
3.200 1.300 1.300 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.63868E-02 ppm1 0.661 ppm2 9.363 CV 1
ASSI { 1018}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 22 and name HN ))
3.000 1.100 1.100 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.10059E-01 ppm1 0.859 ppm2 9.362 CV 1
ASSI { 1019}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 22 and name HN ))
3.000 1.100 1.100 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.99026E-02 ppm1 0.953 ppm2 9.360 CV 1
ASSI { 1020}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 22 and name HN ))
3.100 1.200 1.200 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.83377E-02 ppm1 1.190 ppm2 9.360 CV 1
ASSI { 1022}
(( segid " " and resid 106 and name HB ))
(( segid " " and resid 22 and name HN ))
3.900 1.900 1.900 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.20215E-02 ppm1 4.265 ppm2 9.361 CV 1
ASSI { 1025}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 40 and name HN ))
3.000 1.100 1.100 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.96923E-02 ppm1 3.281 ppm2 8.572 CV 1
OR { 1025}
(( segid " " and resid 101 and name HB2 ))
(( segid " " and resid 51 and name HN ))
ASSI { 1029}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HN ))
6.000 4.500 0.000 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.164 ppm2 8.085 CV 1
ASSI { 1030}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HN ))
6.000 4.500 0.000 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.354 ppm2 8.086 CV 1
ASSI { 1032}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 11 and name HN ))
6.000 4.500 0.000 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.305 ppm2 8.086 CV 1
ASSI { 1033}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 50 and name HN ))
3.400 1.400 1.400 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.49105E-02 ppm1 0.404 ppm2 8.845 CV 1
ASSI { 1062}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 48 and name HN ))
3.200 1.300 1.300 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.65238E-02 ppm1 0.312 ppm2 7.752 CV 1
ASSI { 1067}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HN ))
2.800 1.000 1.000 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.13777E-01 ppm1 4.510 ppm2 7.754 CV 1
ASSI { 1072}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 19 and name HN ))
3.300 1.400 1.400 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.52550E-02 ppm1 1.431 ppm2 7.879 CV 1
ASSI { 1073}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 19 and name HN ))
3.400 1.500 1.500 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.43474E-02 ppm1 3.571 ppm2 7.880 CV 1
ASSI { 1074}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 19 and name HN ))
3.200 1.300 1.300 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.66691E-02 ppm1 3.296 ppm2 7.876 CV 1
ASSI { 1079}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 86 and name HN ))
2.700 0.900 0.900 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.16271E-01 ppm1 4.494 ppm2 8.191 CV 1
ASSI { 1093}
(( segid " " and resid 113 and name HN ))
(( segid " " and resid 112 and name HN ))
3.300 1.300 1.300 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.56604E-02 ppm1 7.551 ppm2 7.878 CV 1
ASSI { 1097}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 12 and name HN ))
2.900 1.000 1.000 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.12105E-01 ppm1 3.354 ppm2 8.135 CV 1
ASSI { 1098}
(( segid " " and resid 12 and name HA2 ))
(( segid " " and resid 12 and name HN ))
6.000 4.500 0.000 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.875 ppm2 8.135 CV 1
ASSI { 1100}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 12 and name HN ))
3.200 1.300 1.300 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.59828E-02 ppm1 5.091 ppm2 8.135 CV 1
ASSI { 1109}
( segid " " and resid 113 and name HD% )
(( segid " " and resid 114 and name HN ))
6.000 4.500 0.000 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.143 ppm2 8.126 CV 1
ASSI { 1111}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.673 ppm2 7.735 CV 1
OR { 1111}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 5 and name HN ))
ASSI { 1112}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 5 and name HN ))
2.500 0.800 0.800 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.29222E-01 ppm1 4.345 ppm2 7.735 CV 1
ASSI { 1118}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HN ))
2.700 0.900 0.900 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.19468E-01 ppm1 6.963 ppm2 7.608 CV 1
ASSI { 1119}
( segid " " and resid 116 and name HB% )
(( segid " " and resid 116 and name HN ))
6.000 4.500 0.000 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.357 ppm2 8.214 CV 1
ASSI { 1123}
(( segid " " and resid 122 and name HN ))
(( segid " " and resid 121 and name HN ))
3.500 1.600 1.600 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.35601E-02 ppm1 7.904 ppm2 8.214 CV 1
ASSI { 1128}
(( segid " " and resid 88 and name HA1 ))
(( segid " " and resid 89 and name HN ))
3.000 1.100 1.100 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.91389E-02 ppm1 3.952 ppm2 8.166 CV 1
OR { 1128}
(( segid " " and resid 88 and name HA2 ))
(( segid " " and resid 89 and name HN ))
ASSI { 1129}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.958 ppm2 7.116 CV 1
ASSI { 1134}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 33 and name HN ))
6.000 4.500 0.000 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 -0.005 ppm2 6.964 CV 1
ASSI { 1135}
(( segid " " and resid 33 and name HG ))
(( segid " " and resid 33 and name HN ))
6.000 4.500 0.000 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.863 ppm2 6.962 CV 1
ASSI { 1139}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HN ))
6.000 4.500 0.000 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.744 ppm2 6.962 CV 1
ASSI { 1143}
( segid " " and resid 16 and name HB% )
(( segid " " and resid 17 and name HN ))
3.000 1.200 1.200 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.87985E-02 ppm1 1.213 ppm2 6.671 CV 1
ASSI { 1144}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HN ))
6.000 4.500 0.000 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.298 ppm2 6.671 CV 1
ASSI { 1145}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HN ))
6.000 4.500 0.000 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.278 ppm2 6.673 CV 1
ASSI { 1146}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 9 and name HN ))
6.000 4.500 0.000 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.233 ppm2 8.744 CV 1
ASSI { 1148}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 9 and name HN ))
6.000 4.500 0.000 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.251 ppm2 8.747 CV 1
ASSI { 1149}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HN ))
6.000 4.500 0.000 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.871 ppm2 8.745 CV 1
ASSI { 1153}
(( segid " " and resid 112 and name HG3 ))
(( segid " " and resid 113 and name HN ))
4.100 2.100 1.900 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.14680E-02 ppm1 2.022 ppm2 7.554 CV 1
OR { 1153}
(( segid " " and resid 112 and name HG2 ))
(( segid " " and resid 113 and name HN ))
ASSI { 1155}
( segid " " and resid 113 and name HD% )
(( segid " " and resid 113 and name HN ))
6.000 4.500 0.000 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.148 ppm2 7.555 CV 1
ASSI { 1173}
(( segid " " and resid 119 and name HN ))
(( segid " " and resid 120 and name HN ))
3.800 1.800 1.800 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.24297E-02 ppm1 7.980 ppm2 8.392 CV 1
ASSI { 1177}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.253 ppm2 8.536 CV 1
ASSI { 1178}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.352 ppm2 8.535 CV 1
ASSI { 1181}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HN ))
2.500 0.800 0.800 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.29596E-01 ppm1 4.564 ppm2 8.537 CV 1
ASSI { 1183}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 115 and name HN ))
2.600 0.900 0.900 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.20561E-01 ppm1 4.428 ppm2 8.039 CV 1
ASSI { 1184}
(( segid " " and resid 18 and name HG3 ))
(( segid " " and resid 110 and name HN ))
4.200 2.200 1.800 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.12093E-02 ppm1 0.760 ppm2 8.810 CV 1
ASSI { 1187}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 106 and name HN ))
2.600 0.800 0.800 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.22442E-01 ppm1 0.665 ppm2 9.063 CV 1
ASSI { 1188}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 106 and name HN ))
3.000 1.100 1.100 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.95996E-02 ppm1 1.019 ppm2 9.063 CV 1
ASSI { 1192}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 106 and name HN ))
2.700 0.900 0.900 peak 1192 spectrum 1 weight 0.10000E+01 volume 0.18900E-01 ppm1 4.353 ppm2 9.062 CV 1
ASSI { 1194}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 30 and name HN ))
6.000 4.500 0.000 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.001 ppm2 9.956 CV 1
ASSI { 1195}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HN ))
6.000 4.500 0.000 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.179 ppm2 9.956 CV 1
ASSI { 1198}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HN ))
6.000 4.500 0.000 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.480 ppm2 7.918 CV 1
ASSI { 1205}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 40 and name HN ))
3.500 1.500 1.500 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.38285E-02 ppm1 8.362 ppm2 8.579 CV 1
ASSI { 1207}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 40 and name HN ))
2.900 1.000 1.000 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.12883E-01 ppm1 7.908 ppm2 8.583 CV 1
ASSI { 1215}
( segid " " and resid 57 and name HD2%)
(( segid " " and resid 62 and name HN ))
2.900 1.000 1.000 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.12859E-01 ppm1 1.165 ppm2 8.830 CV 1
OR { 1215}
( segid " " and resid 57 and name HD1%)
(( segid " " and resid 62 and name HN ))
ASSI { 1219}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HN ))
6.000 4.500 0.000 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.667 ppm2 8.830 CV 1
ASSI { 1220}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HN ))
6.000 4.500 0.000 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.704 ppm2 8.830 CV 1
ASSI { 1222}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 62 and name HN ))
6.000 4.500 0.000 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.472 ppm2 8.831 CV 1
ASSI { 1223}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HN ))
6.000 4.500 0.000 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.131 ppm2 8.829 CV 1
ASSI { 1228}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.821 ppm2 8.933 CV 1
ASSI { 1229}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 58 and name HN ))
3.100 1.200 1.200 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.79116E-02 ppm1 3.113 ppm2 8.935 CV 1
ASSI { 1230}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.483 ppm2 8.933 CV 1
ASSI { 1231}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 37 and name HN ))
3.400 1.400 1.400 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.48579E-02 ppm1 4.480 ppm2 8.933 CV 1
OR { 1231}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 58 and name HN ))
ASSI { 1233}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 58 and name HN ))
2.300 0.600 0.600 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.49991E-01 ppm1 6.165 ppm2 8.933 CV 1
ASSI { 1235}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 59 and name HN ))
3.600 1.600 1.600 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.33207E-02 ppm1 0.757 ppm2 8.882 CV 1
ASSI { 1244}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HN ))
6.000 4.500 0.000 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.799 ppm2 8.930 CV 1
ASSI { 1245}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 37 and name HN ))
6.000 4.500 0.000 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.281 ppm2 8.930 CV 1
ASSI { 1264}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 66 and name HN ))
2.700 0.900 0.900 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.17406E-01 ppm1 7.001 ppm2 8.107 CV 1
ASSI { 1265}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HN ))
6.000 4.500 0.000 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.783 ppm2 7.561 CV 1
ASSI { 1266}
(( segid " " and resid 54 and name HA2 ))
(( segid " " and resid 54 and name HN ))
6.000 4.500 0.000 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.646 ppm2 8.729 CV 1
ASSI { 1268}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HN ))
2.800 1.000 1.000 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.13760E-01 ppm1 8.537 ppm2 9.192 CV 1
ASSI { 1269}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 13 and name HN ))
2.600 0.900 0.900 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.20409E-01 ppm1 8.128 ppm2 9.192 CV 1
ASSI { 1270}
(( segid " " and resid 13 and name HA1 ))
(( segid " " and resid 13 and name HN ))
6.000 4.500 0.000 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.332 ppm2 9.188 CV 1
ASSI { 1276}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HN ))
6.000 4.500 0.000 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.428 ppm2 8.550 CV 1
ASSI { 1277}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HN ))
6.000 4.500 0.000 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.209 ppm2 8.549 CV 1
ASSI { 1279}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HN ))
6.000 4.500 0.000 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.710 ppm2 8.580 CV 1
ASSI { 1284}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HN ))
2.400 0.700 0.700 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.35227E-01 ppm1 7.907 ppm2 8.285 CV 1
ASSI { 1286}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 38 and name HN ))
3.000 1.100 1.100 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.90074E-02 ppm1 3.803 ppm2 8.288 CV 1
ASSI { 1287}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 38 and name HN ))
2.900 1.100 1.100 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.11180E-01 ppm1 3.563 ppm2 8.286 CV 1
ASSI { 1291}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HN ))
6.000 4.500 0.000 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.224 ppm2 8.719 CV 1
ASSI { 1292}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HN ))
6.000 4.500 0.000 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.162 ppm2 8.719 CV 1
ASSI { 1294}
( segid " " and resid 40 and name HB% )
(( segid " " and resid 41 and name HN ))
2.400 0.700 0.700 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.36085E-01 ppm1 1.399 ppm2 8.721 CV 1
ASSI { 1295}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 101 and name HN ))
6.000 4.500 0.000 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.045 ppm2 8.219 CV 1
OR { 1295}
(( segid " " and resid 100 and name HB3 ))
(( segid " " and resid 101 and name HN ))
ASSI { 1298}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 101 and name HN ))
6.000 4.500 0.000 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.183 ppm2 8.219 CV 1
ASSI { 1299}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 101 and name HN ))
2.700 0.900 0.900 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.19966E-01 ppm1 7.317 ppm2 8.219 CV 1
ASSI { 1301}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 102 and name HN ))
3.500 1.500 1.500 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.38520E-02 ppm1 4.560 ppm2 7.323 CV 1
ASSI { 1302}
(( segid " " and resid 102 and name HB3 ))
(( segid " " and resid 102 and name HN ))
6.000 4.500 0.000 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.558 ppm2 7.323 CV 1
ASSI { 1305}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 63 and name HN ))
6.000 4.500 0.000 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.876 ppm2 8.411 CV 1
ASSI { 1307}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 63 and name HN ))
6.000 4.500 0.000 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.211 ppm2 8.409 CV 1
ASSI { 1309}
( segid " " and resid 63 and name HD1%)
(( segid " " and resid 63 and name HN ))
6.000 4.500 0.000 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.819 ppm2 8.410 CV 1
ASSI { 1310}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HN ))
6.000 4.500 0.000 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.897 ppm2 8.348 CV 1
ASSI { 1314}
( segid " " and resid 91 and name HG2%)
(( segid " " and resid 91 and name HN ))
6.000 4.500 0.000 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.218 ppm2 8.242 CV 1
ASSI { 1316}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HN ))
3.200 1.300 1.300 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.68254E-02 ppm1 7.598 ppm2 8.037 CV 1
ASSI { 1318}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HN ))
6.000 4.500 0.000 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.780 ppm2 8.037 CV 1
ASSI { 1319}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HN ))
6.000 4.500 0.000 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.632 ppm2 8.036 CV 1
OR { 1319}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HN ))
ASSI { 1324}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 65 and name HN ))
6.000 4.500 0.000 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.195 ppm2 7.865 CV 1
ASSI { 1326}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HN ))
6.000 4.500 0.000 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.899 ppm2 7.835 CV 1
ASSI { 1331}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 7 and name HN ))
3.700 1.700 1.700 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.26870E-02 ppm1 0.595 ppm2 8.369 CV 1
OR { 1331}
(( segid " " and resid 6 and name HG3 ))
(( segid " " and resid 7 and name HN ))
ASSI { 1332}
(( segid " " and resid 6 and name HD3 ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.958 ppm2 8.369 CV 1
ASSI { 1335}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HN ))
2.400 0.700 0.700 peak 1335 spectrum 1 weight 0.10000E+01 volume 0.35961E-01 ppm1 4.217 ppm2 8.369 CV 1
ASSI { 1336}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 1336 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.455 ppm2 8.370 CV 1
ASSI { 1339}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 10 and name HN ))
6.000 4.500 0.000 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.868 ppm2 9.115 CV 1
ASSI { 1340}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HN ))
2.400 0.700 0.700 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.39406E-01 ppm1 4.353 ppm2 8.744 CV 1
ASSI { 1341}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 10 and name HN ))
6.000 4.500 0.000 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.921 ppm2 9.115 CV 1
ASSI { 1343}
(( segid " " and resid 13 and name HA2 ))
(( segid " " and resid 13 and name HN ))
6.000 4.500 0.000 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.874 ppm2 9.188 CV 1
ASSI { 1344}
(( segid " " and resid 12 and name HA2 ))
(( segid " " and resid 13 and name HN ))
6.000 4.500 0.000 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.882 ppm2 9.188 CV 1
ASSI { 1346}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 14 and name HN ))
6.000 4.500 0.000 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.007 ppm2 8.548 CV 1
OR { 1346}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 14 and name HN ))
ASSI { 1348}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HN ))
6.000 4.500 0.000 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.855 ppm2 8.542 CV 1
ASSI { 1349}
(( segid " " and resid 15 and name HG12))
(( segid " " and resid 15 and name HN ))
6.000 4.500 0.000 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.261 ppm2 8.543 CV 1
ASSI { 1350}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 15 and name HN ))
6.000 4.500 0.000 peak 1350 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.563 ppm2 8.542 CV 1
ASSI { 1352}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.857 ppm2 8.631 CV 1
ASSI { 1354}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.952 ppm2 8.631 CV 1
ASSI { 1355}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.194 ppm2 8.631 CV 1
ASSI { 1357}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 22 and name HN ))
3.500 1.500 1.500 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.39710E-02 ppm1 1.849 ppm2 9.362 CV 1
ASSI { 1361}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 26 and name HN ))
3.300 1.400 1.400 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.49575E-02 ppm1 3.956 ppm2 7.206 CV 1
ASSI { 1362}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 26 and name HN ))
6.000 4.500 0.000 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.934 ppm2 7.206 CV 1
ASSI { 1363}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 27 and name HN ))
3.400 1.400 1.400 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.46269E-02 ppm1 3.488 ppm2 8.583 CV 1
ASSI { 1364}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HN ))
2.700 0.900 0.900 peak 1364 spectrum 1 weight 0.10000E+01 volume 0.17185E-01 ppm1 3.574 ppm2 8.583 CV 1
ASSI { 1366}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.597 ppm2 9.134 CV 1
ASSI { 1367}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.708 ppm2 9.134 CV 1
ASSI { 1368}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 29 and name HN ))
2.400 0.700 0.700 peak 1368 spectrum 1 weight 0.10000E+01 volume 0.36874E-01 ppm1 5.671 ppm2 9.241 CV 1
ASSI { 1370}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 29 and name HN ))
3.700 1.700 1.700 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.29361E-02 ppm1 3.490 ppm2 9.242 CV 1
ASSI { 1371}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 29 and name HN ))
3.000 1.100 1.100 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.99414E-02 ppm1 0.403 ppm2 9.240 CV 1
ASSI { 1372}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 29 and name HN ))
3.200 1.300 1.300 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.68822E-02 ppm1 2.574 ppm2 9.241 CV 1
ASSI { 1373}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 30 and name HN ))
2.500 0.800 0.800 peak 1373 spectrum 1 weight 0.10000E+01 volume 0.27686E-01 ppm1 4.997 ppm2 9.954 CV 1
ASSI { 1374}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HN ))
6.000 4.500 0.000 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.788 ppm2 9.955 CV 1
ASSI { 1375}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 31 and name HN ))
6.000 4.500 0.000 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.177 ppm2 8.037 CV 1
ASSI { 1376}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 31 and name HN ))
2.900 1.100 1.100 peak 1376 spectrum 1 weight 0.10000E+01 volume 0.10749E-01 ppm1 4.001 ppm2 8.037 CV 1
ASSI { 1377}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HN ))
6.000 4.500 0.000 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.790 ppm2 8.037 CV 1
ASSI { 1378}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HN ))
6.000 4.500 0.000 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.901 ppm2 8.036 CV 1
ASSI { 1379}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 32 and name HN ))
3.800 1.800 1.800 peak 1379 spectrum 1 weight 0.10000E+01 volume 0.24130E-02 ppm1 1.632 ppm2 7.610 CV 1
OR { 1379}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 32 and name HN ))
ASSI { 1380}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 32 and name HN ))
6.000 4.500 0.000 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.780 ppm2 7.609 CV 1
ASSI { 1381}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 32 and name HN ))
3.300 1.300 1.300 peak 1381 spectrum 1 weight 0.10000E+01 volume 0.58278E-02 ppm1 1.903 ppm2 7.612 CV 1
ASSI { 1383}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HN ))
3.700 1.700 1.700 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.25597E-02 ppm1 4.249 ppm2 7.610 CV 1
ASSI { 1384}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name HN ))
3.300 1.300 1.300 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.57974E-02 ppm1 4.449 ppm2 6.961 CV 1
ASSI { 1386}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name HN ))
2.400 0.700 0.700 peak 1386 spectrum 1 weight 0.10000E+01 volume 0.38838E-01 ppm1 5.279 ppm2 8.356 CV 1
ASSI { 1387}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HN ))
6.000 4.500 0.000 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.426 ppm2 8.355 CV 1
ASSI { 1388}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 35 and name HN ))
6.000 4.500 0.000 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.818 ppm2 8.355 CV 1
ASSI { 1390}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 36 and name HN ))
3.600 1.600 1.600 peak 1390 spectrum 1 weight 0.10000E+01 volume 0.30786E-02 ppm1 2.811 ppm2 10.177 CV 1
ASSI { 1391}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.150 ppm2 7.792 CV 1
ASSI { 1392}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 35 and name HN ))
6.000 4.500 0.000 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.109 ppm2 8.355 CV 1
ASSI { 1393}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HN ))
6.000 4.500 0.000 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.419 ppm2 8.356 CV 1
ASSI { 1394}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HN ))
6.000 4.500 0.000 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.484 ppm2 8.355 CV 1
ASSI { 1397}
( segid " " and resid 84 and name HG2%)
(( segid " " and resid 85 and name HN ))
6.000 4.500 0.000 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.911 ppm2 8.417 CV 1
ASSI { 1400}
(( segid " " and resid 84 and name HB ))
(( segid " " and resid 85 and name HN ))
6.000 4.500 0.000 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.070 ppm2 8.417 CV 1
ASSI { 1401}
(( segid " " and resid 120 and name HB3 ))
(( segid " " and resid 120 and name HN ))
6.000 4.500 0.000 peak 1401 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.576 ppm2 8.398 CV 1
ASSI { 1402}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 85 and name HN ))
6.000 4.500 0.000 peak 1402 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.102 ppm2 8.416 CV 1
ASSI { 1403}
(( segid " " and resid 120 and name HA ))
(( segid " " and resid 120 and name HN ))
6.000 4.500 0.000 peak 1403 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.634 ppm2 8.398 CV 1
ASSI { 1406}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HN ))
6.000 4.500 0.000 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.492 ppm2 8.417 CV 1
ASSI { 1407}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HN ))
6.000 4.500 0.000 peak 1407 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.578 ppm2 8.288 CV 1
ASSI { 1408}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 37 and name HN ))
3.400 1.500 1.500 peak 1408 spectrum 1 weight 0.10000E+01 volume 0.43737E-02 ppm1 3.879 ppm2 8.930 CV 1
OR { 1408}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 37 and name HN ))
ASSI { 1411}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HN ))
6.000 4.500 0.000 peak 1411 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.155 ppm2 7.918 CV 1
ASSI { 1412}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 42 and name HN ))
2.500 0.800 0.800 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.26317E-01 ppm1 4.227 ppm2 7.949 CV 1
ASSI { 1413}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.790 ppm2 7.951 CV 1
ASSI { 1414}
(( segid " " and resid 41 and name HG2 ))
(( segid " " and resid 41 and name HN ))
6.000 4.500 0.000 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.484 ppm2 8.720 CV 1
ASSI { 1415}
(( segid " " and resid 42 and name HG ))
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 1415 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.423 ppm2 7.949 CV 1
ASSI { 1416}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HN ))
6.000 4.500 0.000 peak 1416 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.228 ppm2 8.721 CV 1
ASSI { 1417}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 45 and name HN ))
3.100 1.200 1.200 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.75173E-02 ppm1 2.781 ppm2 7.116 CV 1
OR { 1417}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 45 and name HN ))
ASSI { 1418}
(( segid " " and resid 43 and name HA2 ))
(( segid " " and resid 44 and name HN ))
3.200 1.300 1.300 peak 1418 spectrum 1 weight 0.10000E+01 volume 0.59233E-02 ppm1 3.611 ppm2 7.560 CV 1
ASSI { 1419}
(( segid " " and resid 43 and name HA1 ))
(( segid " " and resid 44 and name HN ))
3.300 1.400 1.400 peak 1419 spectrum 1 weight 0.10000E+01 volume 0.50959E-02 ppm1 4.026 ppm2 7.560 CV 1
ASSI { 1420}
(( segid " " and resid 43 and name HA2 ))
(( segid " " and resid 43 and name HN ))
6.000 4.500 0.000 peak 1420 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.612 ppm2 9.801 CV 1
ASSI { 1421}
(( segid " " and resid 43 and name HA1 ))
(( segid " " and resid 43 and name HN ))
6.000 4.500 0.000 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.028 ppm2 9.798 CV 1
ASSI { 1422}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.155 ppm2 7.949 CV 1
ASSI { 1423}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 1423 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.092 ppm2 7.949 CV 1
ASSI { 1424}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.757 ppm2 7.949 CV 1
ASSI { 1426}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 43 and name HN ))
3.600 1.600 1.600 peak 1426 spectrum 1 weight 0.10000E+01 volume 0.34245E-02 ppm1 1.086 ppm2 9.801 CV 1
ASSI { 1429}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HN ))
3.400 1.500 1.500 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.42519E-02 ppm1 3.792 ppm2 9.802 CV 1
ASSI { 1431}
(( segid " " and resid 45 and name HG13))
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.211 ppm2 7.116 CV 1
ASSI { 1432}
(( segid " " and resid 45 and name HG13))
(( segid " " and resid 46 and name HN ))
3.500 1.500 1.500 peak 1432 spectrum 1 weight 0.10000E+01 volume 0.36888E-02 ppm1 1.215 ppm2 7.643 CV 1
ASSI { 1433}
(( segid " " and resid 45 and name HG12))
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.401 ppm2 7.116 CV 1
ASSI { 1434}
(( segid " " and resid 45 and name HG12))
(( segid " " and resid 46 and name HN ))
3.600 1.600 1.600 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.31464E-02 ppm1 1.400 ppm2 7.643 CV 1
ASSI { 1435}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 46 and name HN ))
3.300 1.400 1.400 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.50641E-02 ppm1 2.162 ppm2 7.643 CV 1
ASSI { 1437}
(( segid " " and resid 46 and name HA2 ))
(( segid " " and resid 47 and name HN ))
6.000 4.500 0.000 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.207 ppm2 8.342 CV 1
ASSI { 1438}
(( segid " " and resid 46 and name HA1 ))
(( segid " " and resid 47 and name HN ))
6.000 4.500 0.000 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.294 ppm2 8.342 CV 1
ASSI { 1439}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 47 and name HN ))
6.000 4.500 0.000 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.215 ppm2 8.342 CV 1
ASSI { 1440}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 48 and name HN ))
3.700 1.700 1.700 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.29070E-02 ppm1 1.218 ppm2 7.756 CV 1
ASSI { 1442}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 49 and name HN ))
3.200 1.300 1.300 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.66553E-02 ppm1 3.571 ppm2 8.670 CV 1
ASSI { 1443}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 49 and name HN ))
3.000 1.100 1.100 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.91486E-02 ppm1 3.667 ppm2 8.670 CV 1
ASSI { 1444}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 49 and name HN ))
2.500 0.800 0.800 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.30592E-01 ppm1 5.052 ppm2 8.670 CV 1
ASSI { 1445}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HN ))
6.000 4.500 0.000 peak 1445 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.509 ppm2 8.670 CV 1
ASSI { 1446}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HN ))
6.000 4.500 0.000 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.374 ppm2 8.669 CV 1
ASSI { 1447}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 50 and name HN ))
2.800 1.000 1.000 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.13019E-01 ppm1 3.374 ppm2 8.843 CV 1
ASSI { 1448}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 50 and name HN ))
3.600 1.600 1.600 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.31104E-02 ppm1 3.511 ppm2 8.844 CV 1
ASSI { 1449}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name HN ))
2.600 0.800 0.800 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.23176E-01 ppm1 4.636 ppm2 8.848 CV 1
ASSI { 1450}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 52 and name HN ))
3.400 1.400 1.400 peak 1450 spectrum 1 weight 0.10000E+01 volume 0.48330E-02 ppm1 1.090 ppm2 7.815 CV 1
ASSI { 1451}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 52 and name HN ))
3.200 1.300 1.300 peak 1451 spectrum 1 weight 0.10000E+01 volume 0.59966E-02 ppm1 3.989 ppm2 7.816 CV 1
ASSI { 1452}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name HN ))
2.300 0.700 0.700 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.47279E-01 ppm1 5.420 ppm2 7.816 CV 1
ASSI { 1454}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 1454 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.452 ppm2 7.817 CV 1
ASSI { 1455}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 1455 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.590 ppm2 7.817 CV 1
ASSI { 1457}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 1457 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.823 ppm2 8.880 CV 1
ASSI { 1459}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 1459 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.633 ppm2 8.328 CV 1
ASSI { 1460}
(( segid " " and resid 55 and name HG2 ))
(( segid " " and resid 55 and name HN ))
6.000 4.500 0.000 peak 1460 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.635 ppm2 8.112 CV 1
ASSI { 1461}
(( segid " " and resid 55 and name HG3 ))
(( segid " " and resid 55 and name HN ))
6.000 4.500 0.000 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.577 ppm2 8.112 CV 1
ASSI { 1465}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 56 and name HN ))
3.100 1.200 1.200 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.76681E-02 ppm1 1.912 ppm2 8.328 CV 1
ASSI { 1466}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HN ))
6.000 4.500 0.000 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.721 ppm2 8.349 CV 1
ASSI { 1468}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.721 ppm2 9.117 CV 1
ASSI { 1469}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.896 ppm2 9.117 CV 1
ASSI { 1470}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 61 and name HN ))
3.200 1.300 1.300 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.63564E-02 ppm1 4.354 ppm2 9.118 CV 1
ASSI { 1471}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 1471 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.472 ppm2 8.881 CV 1
ASSI { 1472}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name HN ))
3.200 1.300 1.300 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.66151E-02 ppm1 3.473 ppm2 8.347 CV 1
ASSI { 1473}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 1473 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.796 ppm2 8.879 CV 1
ASSI { 1474}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 1474 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.606 ppm2 8.882 CV 1
ASSI { 1475}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 60 and name HN ))
6.000 4.500 0.000 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.608 ppm2 8.348 CV 1
ASSI { 1476}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 60 and name HN ))
6.000 4.500 0.000 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.794 ppm2 8.348 CV 1
ASSI { 1477}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 60 and name HN ))
3.400 1.500 1.500 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.43377E-02 ppm1 1.993 ppm2 8.348 CV 1
ASSI { 1478}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 62 and name HN ))
3.300 1.400 1.400 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.50143E-02 ppm1 2.532 ppm2 8.830 CV 1
ASSI { 1479}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 62 and name HN ))
3.300 1.400 1.400 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.51360E-02 ppm1 3.115 ppm2 8.831 CV 1
ASSI { 1480}
( segid " " and resid 63 and name HD1%)
(( segid " " and resid 64 and name HN ))
6.000 4.500 0.000 peak 1480 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.823 ppm2 7.834 CV 1
ASSI { 1481}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name HN ))
6.000 4.500 0.000 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.210 ppm2 7.835 CV 1
ASSI { 1482}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 64 and name HN ))
6.000 4.500 0.000 peak 1482 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.873 ppm2 7.835 CV 1
ASSI { 1483}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HN ))
6.000 4.500 0.000 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.380 ppm2 8.411 CV 1
ASSI { 1484}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HN ))
3.300 1.400 1.400 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.52965E-02 ppm1 3.380 ppm2 7.836 CV 1
ASSI { 1486}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 63 and name HN ))
6.000 4.500 0.000 peak 1486 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.666 ppm2 8.411 CV 1
ASSI { 1487}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 63 and name HN ))
6.000 4.500 0.000 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.705 ppm2 8.411 CV 1
ASSI { 1489}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 64 and name HN ))
6.000 4.500 0.000 peak 1489 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.570 ppm2 7.834 CV 1
ASSI { 1490}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HN ))
6.000 4.500 0.000 peak 1490 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.947 ppm2 7.835 CV 1
ASSI { 1491}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 65 and name HN ))
3.700 1.700 1.700 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.28849E-02 ppm1 1.945 ppm2 7.866 CV 1
ASSI { 1492}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 65 and name HN ))
6.000 4.500 0.000 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.899 ppm2 7.866 CV 1
ASSI { 1493}
(( segid " " and resid 65 and name HB3 ))
(( segid " " and resid 66 and name HN ))
2.900 1.100 1.100 peak 1493 spectrum 1 weight 0.10000E+01 volume 0.10752E-01 ppm1 0.197 ppm2 8.101 CV 1
ASSI { 1494}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HN ))
6.000 4.500 0.000 peak 1494 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.697 ppm2 7.865 CV 1
ASSI { 1495}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HN ))
6.000 4.500 0.000 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.307 ppm2 7.865 CV 1
ASSI { 1496}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 66 and name HN ))
3.200 1.300 1.300 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.64228E-02 ppm1 1.307 ppm2 8.101 CV 1
ASSI { 1498}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HN ))
6.000 4.500 0.000 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.949 ppm2 8.101 CV 1
ASSI { 1499}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 66 and name HN ))
6.000 4.500 0.000 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.851 ppm2 8.101 CV 1
ASSI { 1500}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HN ))
3.500 1.600 1.600 peak 1500 spectrum 1 weight 0.10000E+01 volume 0.35933E-02 ppm1 4.688 ppm2 7.970 CV 1
ASSI { 1501}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 67 and name HN ))
6.000 4.500 0.000 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.967 ppm2 7.969 CV 1
ASSI { 1502}
(( segid " " and resid 67 and name HA2 ))
(( segid " " and resid 67 and name HN ))
6.000 4.500 0.000 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.749 ppm2 7.968 CV 1
ASSI { 1505}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 66 and name HN ))
6.000 4.500 0.000 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.040 ppm2 8.101 CV 1
ASSI { 1509}
(( segid " " and resid 68 and name HB3 ))
(( segid " " and resid 68 and name HN ))
6.000 4.500 0.000 peak 1509 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.718 ppm2 8.284 CV 1
ASSI { 1513}
(( segid " " and resid 121 and name HB3 ))
(( segid " " and resid 121 and name HN ))
6.000 4.500 0.000 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.585 ppm2 8.214 CV 1
ASSI { 1515}
(( segid " " and resid 121 and name HB3 ))
(( segid " " and resid 122 and name HN ))
3.600 1.700 1.700 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.29707E-02 ppm1 2.585 ppm2 7.916 CV 1
ASSI { 1516}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 121 and name HN ))
6.000 4.500 0.000 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.611 ppm2 8.214 CV 1
ASSI { 1517}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 122 and name HN ))
2.900 1.000 1.000 peak 1517 spectrum 1 weight 0.10000E+01 volume 0.12436E-01 ppm1 4.612 ppm2 7.916 CV 1
ASSI { 1518}
(( segid " " and resid 120 and name HB2 ))
(( segid " " and resid 120 and name HN ))
6.000 4.500 0.000 peak 1518 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.712 ppm2 8.399 CV 1
ASSI { 1519}
(( segid " " and resid 120 and name HB2 ))
(( segid " " and resid 121 and name HN ))
6.000 4.500 0.000 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.713 ppm2 8.214 CV 1
ASSI { 1521}
(( segid " " and resid 120 and name HB3 ))
(( segid " " and resid 121 and name HN ))
6.000 4.500 0.000 peak 1521 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.577 ppm2 8.214 CV 1
ASSI { 1529}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 117 and name HN ))
6.000 4.500 0.000 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.683 ppm2 8.109 CV 1
ASSI { 1531}
(( segid " " and resid 117 and name HB2 ))
(( segid " " and resid 118 and name HN ))
6.000 4.500 0.000 peak 1531 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.810 ppm2 8.294 CV 1
ASSI { 1532}
(( segid " " and resid 117 and name HB3 ))
(( segid " " and resid 118 and name HN ))
6.000 4.500 0.000 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.708 ppm2 8.295 CV 1
ASSI { 1533}
(( segid " " and resid 116 and name HA ))
(( segid " " and resid 117 and name HN ))
6.000 4.500 0.000 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.251 ppm2 8.109 CV 1
ASSI { 1534}
( segid " " and resid 116 and name HB% )
(( segid " " and resid 117 and name HN ))
3.600 1.600 1.600 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.31768E-02 ppm1 1.358 ppm2 8.109 CV 1
ASSI { 1535}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 116 and name HN ))
4.100 2.100 1.900 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.15358E-02 ppm1 4.140 ppm2 8.213 CV 1
ASSI { 1536}
( segid " " and resid 115 and name HB% )
(( segid " " and resid 116 and name HN ))
6.000 4.500 0.000 peak 1536 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.368 ppm2 8.213 CV 1
ASSI { 1537}
(( segid " " and resid 114 and name HB2 ))
(( segid " " and resid 115 and name HN ))
6.000 4.500 0.000 peak 1537 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.579 ppm2 8.039 CV 1
ASSI { 1538}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 114 and name HN ))
6.000 4.500 0.000 peak 1538 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.336 ppm2 8.124 CV 1
ASSI { 1539}
(( segid " " and resid 113 and name HB2 ))
(( segid " " and resid 114 and name HN ))
3.100 1.200 1.200 peak 1539 spectrum 1 weight 0.10000E+01 volume 0.79863E-02 ppm1 3.007 ppm2 8.124 CV 1
OR { 1539}
(( segid " " and resid 113 and name HB3 ))
(( segid " " and resid 114 and name HN ))
ASSI { 1540}
( segid " " and resid 106 and name HG2%)
(( segid " " and resid 107 and name HN ))
2.600 0.900 0.900 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.21806E-01 ppm1 1.304 ppm2 8.930 CV 1
ASSI { 1541}
(( segid " " and resid 106 and name HB ))
(( segid " " and resid 107 and name HN ))
6.000 4.500 0.000 peak 1541 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.278 ppm2 8.930 CV 1
ASSI { 1542}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name HN ))
6.000 4.500 0.000 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.640 ppm2 9.062 CV 1
ASSI { 1543}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 107 and name HN ))
2.200 0.600 0.600 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.62761E-01 ppm1 4.636 ppm2 8.930 CV 1
ASSI { 1544}
(( segid " " and resid 107 and name HG3 ))
(( segid " " and resid 108 and name HN ))
3.700 1.700 1.700 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.28185E-02 ppm1 1.459 ppm2 9.152 CV 1
ASSI { 1545}
(( segid " " and resid 107 and name HG2 ))
(( segid " " and resid 108 and name HN ))
6.000 4.500 0.000 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.590 ppm2 9.152 CV 1
ASSI { 1546}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 108 and name HN ))
4.300 2.300 1.700 peak 1546 spectrum 1 weight 0.10000E+01 volume 0.11636E-02 ppm1 1.847 ppm2 9.152 CV 1
ASSI { 1547}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 108 and name HN ))
6.000 4.500 0.000 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.015 ppm2 9.151 CV 1
ASSI { 1549}
( segid " " and resid 108 and name HD2%)
(( segid " " and resid 109 and name HN ))
3.400 1.400 1.400 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.44857E-02 ppm1 0.961 ppm2 8.662 CV 1
OR { 1549}
( segid " " and resid 108 and name HD1%)
(( segid " " and resid 109 and name HN ))
ASSI { 1550}
(( segid " " and resid 108 and name HB3 ))
(( segid " " and resid 109 and name HN ))
6.000 4.500 0.000 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.617 ppm2 8.662 CV 1
OR { 1550}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 109 and name HN ))
ASSI { 1551}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 109 and name HN ))
2.200 0.600 0.600 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.65736E-01 ppm1 4.944 ppm2 8.662 CV 1
ASSI { 1552}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 110 and name HN ))
2.300 0.700 0.700 peak 1552 spectrum 1 weight 0.10000E+01 volume 0.45480E-01 ppm1 4.434 ppm2 8.808 CV 1
ASSI { 1553}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 110 and name HN ))
3.600 1.600 1.600 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.32169E-02 ppm1 1.921 ppm2 8.809 CV 1
OR { 1553}
(( segid " " and resid 109 and name HB2 ))
(( segid " " and resid 110 and name HN ))
ASSI { 1554}
(( segid " " and resid 109 and name HG2 ))
(( segid " " and resid 110 and name HN ))
3.700 1.700 1.700 peak 1554 spectrum 1 weight 0.10000E+01 volume 0.27341E-02 ppm1 2.004 ppm2 8.809 CV 1
OR { 1554}
(( segid " " and resid 109 and name HG3 ))
(( segid " " and resid 110 and name HN ))
ASSI { 1557}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB2 ))
6.000 4.500 0.000 peak 1557 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.215 ppm2 1.450 CV 1
OR { 1557}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB3 ))
ASSI { 1558}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HD2 ))
6.000 4.500 0.000 peak 1558 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.215 ppm2 1.190 CV 1
ASSI { 1559}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HD3 ))
6.000 4.500 0.000 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.214 ppm2 0.958 CV 1
ASSI { 1560}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HG2 ))
6.000 4.500 0.000 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.217 ppm2 0.600 CV 1
ASSI { 1561}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HB3 ))
6.000 4.500 0.000 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.439 ppm2 1.450 CV 1
OR { 1561}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HB3 ))
OR { 1561}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HB2 ))
ASSI { 1562}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HD2 ))
6.000 4.500 0.000 peak 1562 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.439 ppm2 1.193 CV 1
OR { 1562}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HD2 ))
ASSI { 1563}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HD3 ))
6.000 4.500 0.000 peak 1563 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.439 ppm2 0.958 CV 1
OR { 1563}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HD3 ))
ASSI { 1564}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HG3 ))
6.000 4.500 0.000 peak 1564 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.439 ppm2 0.597 CV 1
OR { 1564}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HG3 ))
OR { 1564}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HG2 ))
ASSI { 1566}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HN ))
6.000 4.500 0.000 peak 1566 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.345 ppm2 8.057 CV 1
ASSI { 1567}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 4 and name HN ))
6.000 4.500 0.000 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.673 ppm2 8.057 CV 1
OR { 1567}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 4 and name HN ))
ASSI { 1568}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 9 and name HB% )
6.000 4.500 0.000 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.869 ppm2 0.239 CV 1
ASSI { 1571}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HN ))
6.000 4.500 0.000 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.251 ppm2 8.547 CV 1
ASSI { 1573}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HB3 ))
6.000 4.500 0.000 peak 1573 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.865 ppm2 1.785 CV 1
ASSI { 1574}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HG ))
6.000 4.500 0.000 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.866 ppm2 1.664 CV 1
ASSI { 1575}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 20 and name HD1%)
6.000 4.500 0.000 peak 1575 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.866 ppm2 0.990 CV 1
ASSI { 1577}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 20 and name HD2%)
6.000 4.500 0.000 peak 1577 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.866 ppm2 0.766 CV 1
ASSI { 1578}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HA ))
6.000 4.500 0.000 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.683 ppm2 5.600 CV 1
ASSI { 1580}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 27 and name HA ))
6.000 4.500 0.000 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.707 ppm2 5.603 CV 1
OR { 1580}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HA ))
ASSI { 1582}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HB3 ))
6.000 4.500 0.000 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.179 ppm2 3.999 CV 1
ASSI { 1583}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB3 ))
6.000 4.500 0.000 peak 1583 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.281 ppm2 3.880 CV 1
OR { 1583}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB2 ))
ASSI { 1585}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB2 ))
6.000 4.500 0.000 peak 1585 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.575 ppm2 3.796 CV 1
ASSI { 1588}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 40 and name HN ))
4.000 2.000 2.000 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.17946E-02 ppm1 2.480 ppm2 8.582 CV 1
ASSI { 1589}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 40 and name HN ))
6.000 4.500 0.000 peak 1589 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.386 ppm2 8.582 CV 1
ASSI { 1590}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HN ))
3.300 1.300 1.300 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.57808E-02 ppm1 4.155 ppm2 8.582 CV 1
ASSI { 1591}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB2 ))
6.000 4.500 0.000 peak 1591 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.154 ppm2 2.489 CV 1
ASSI { 1592}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB3 ))
6.000 4.500 0.000 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.152 ppm2 2.388 CV 1
ASSI { 1593}
(( segid " " and resid 43 and name HA1 ))
(( segid " " and resid 43 and name HA2 ))
6.000 4.500 0.000 peak 1593 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.026 ppm2 3.612 CV 1
ASSI { 1594}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB2 ))
6.000 4.500 0.000 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.765 ppm2 2.783 CV 1
OR { 1594}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB3 ))
ASSI { 1595}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HG12))
6.000 4.500 0.000 peak 1595 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.513 ppm2 1.407 CV 1
ASSI { 1596}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HG13))
6.000 4.500 0.000 peak 1596 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.510 ppm2 1.215 CV 1
ASSI { 1597}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 45 and name HG2%)
6.000 4.500 0.000 peak 1597 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.511 ppm2 0.955 CV 1
ASSI { 1599}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 84 and name HN ))
2.700 0.900 0.900 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.16092E-01 ppm1 4.621 ppm2 8.030 CV 1
ASSI { 1600}
(( segid " " and resid 83 and name HB3 ))
(( segid " " and resid 84 and name HN ))
6.000 4.500 0.000 peak 1600 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.583 ppm2 8.030 CV 1
OR { 1600}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 84 and name HN ))
ASSI { 1601}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HN ))
6.000 4.500 0.000 peak 1601 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.010 ppm2 8.417 CV 1
OR { 1601}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HN ))
ASSI { 1602}
(( segid " " and resid 118 and name HA2 ))
(( segid " " and resid 119 and name HN ))
6.000 4.500 0.000 peak 1602 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.950 ppm2 7.983 CV 1
OR { 1602}
(( segid " " and resid 118 and name HA1 ))
(( segid " " and resid 119 and name HN ))
ASSI { 1606}
(( segid " " and resid 119 and name HG13))
(( segid " " and resid 119 and name HN ))
6.000 4.500 0.000 peak 1606 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.111 ppm2 7.983 CV 1
ASSI { 1608}
(( segid " " and resid 119 and name HA ))
(( segid " " and resid 120 and name HN ))
3.000 1.100 1.100 peak 1608 spectrum 1 weight 0.10000E+01 volume 0.93879E-02 ppm1 4.180 ppm2 8.398 CV 1
ASSI { 1609}
(( segid " " and resid 120 and name HA ))
(( segid " " and resid 121 and name HN ))
3.100 1.200 1.200 peak 1609 spectrum 1 weight 0.10000E+01 volume 0.76625E-02 ppm1 4.636 ppm2 8.214 CV 1
ASSI { 1610}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 121 and name HB2 ))
6.000 4.500 0.000 peak 1610 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.613 ppm2 2.689 CV 1
ASSI { 1611}
(( segid " " and resid 121 and name HA ))
(( segid " " and resid 121 and name HB3 ))
6.000 4.500 0.000 peak 1611 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.613 ppm2 2.583 CV 1
ASSI { 1612}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 113 and name HN ))
3.900 1.900 1.900 peak 1612 spectrum 1 weight 0.10000E+01 volume 0.21322E-02 ppm1 4.283 ppm2 7.553 CV 1
ASSI { 1613}
(( segid " " and resid 116 and name HA ))
( segid " " and resid 116 and name HB% )
6.000 4.500 0.000 peak 1613 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.249 ppm2 1.363 CV 1
ASSI { 1614}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 86 and name HN ))
6.000 4.500 0.000 peak 1614 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.009 ppm2 8.191 CV 1
OR { 1614}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 86 and name HN ))
ASSI { 1615}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 87 and name HN ))
6.000 4.500 0.000 peak 1615 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.909 ppm2 8.259 CV 1
OR { 1615}
( segid " " and resid 86 and name HG1%)
(( segid " " and resid 87 and name HN ))
ASSI { 1616}
(( segid " " and resid 86 and name HB ))
(( segid " " and resid 87 and name HN ))
6.000 4.500 0.000 peak 1616 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.028 ppm2 8.259 CV 1
ASSI { 1617}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 87 and name HN ))
6.000 4.500 0.000 peak 1617 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.128 ppm2 8.259 CV 1
ASSI { 1618}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 88 and name HN ))
6.000 4.500 0.000 peak 1618 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.103 ppm2 8.418 CV 1
ASSI { 1619}
(( segid " " and resid 87 and name HB ))
(( segid " " and resid 88 and name HN ))
6.000 4.500 0.000 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.043 ppm2 8.418 CV 1
ASSI { 1620}
( segid " " and resid 87 and name HG1%)
(( segid " " and resid 88 and name HN ))
6.000 4.500 0.000 peak 1620 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.928 ppm2 8.417 CV 1
OR { 1620}
( segid " " and resid 87 and name HG2%)
(( segid " " and resid 88 and name HN ))
ASSI { 1621}
(( segid " " and resid 95 and name HA1 ))
(( segid " " and resid 96 and name HN ))
6.000 4.500 0.000 peak 1621 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.974 ppm2 8.491 CV 1
OR { 1621}
(( segid " " and resid 95 and name HA2 ))
(( segid " " and resid 96 and name HN ))
ASSI { 1622}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name HB ))
6.000 4.500 0.000 peak 1622 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.640 ppm2 4.278 CV 1
ASSI { 1623}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 106 and name HG2%)
6.000 4.500 0.000 peak 1623 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.278 ppm2 1.308 CV 1
ASSI { 1624}
(( segid " " and resid 107 and name HD3 ))
(( segid " " and resid 107 and name HN ))
6.000 4.500 0.000 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.909 ppm2 8.929 CV 1
OR { 1624}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 107 and name HN ))
ASSI { 1626}
(( segid " " and resid 110 and name HB2 ))
(( segid " " and resid 110 and name HN ))
6.000 4.500 0.000 peak 1626 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.186 ppm2 8.809 CV 1
ASSI { 1627}
(( segid " " and resid 54 and name HA2 ))
(( segid " " and resid 55 and name HN ))
3.300 1.400 1.400 peak 1627 spectrum 1 weight 0.10000E+01 volume 0.52467E-02 ppm1 3.649 ppm2 8.113 CV 1
ASSI { 1628}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 1628 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.636 ppm2 8.328 CV 1
ASSI { 1630}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 1630 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.598 ppm2 8.328 CV 1
ASSI { 1631}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.786 ppm2 8.328 CV 1
ASSI { 1632}
(( segid " " and resid 56 and name HB ))
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 1632 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.759 ppm2 8.328 CV 1
ASSI { 1635}
( segid " " and resid 57 and name HD1%)
(( segid " " and resid 58 and name HN ))
3.300 1.400 1.400 peak 1635 spectrum 1 weight 0.10000E+01 volume 0.49589E-02 ppm1 1.156 ppm2 8.933 CV 1
OR { 1635}
( segid " " and resid 57 and name HD2%)
(( segid " " and resid 58 and name HN ))
ASSI { 1636}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.787 ppm2 8.933 CV 1
ASSI { 1637}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 58 and name HN ))
2.900 1.000 1.000 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.11794E-01 ppm1 1.974 ppm2 8.933 CV 1
ASSI { 1638}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 57 and name HN ))
2.600 0.900 0.900 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.21681E-01 ppm1 0.598 ppm2 9.572 CV 1
ASSI { 1639}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 57 and name HN ))
3.100 1.200 1.200 peak 1639 spectrum 1 weight 0.10000E+01 volume 0.81731E-02 ppm1 0.783 ppm2 9.572 CV 1
OR { 1639}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 28 and name HE1 ))
ASSI { 1640}
(( segid " " and resid 56 and name HB ))
(( segid " " and resid 57 and name HN ))
6.000 4.500 0.000 peak 1640 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.764 ppm2 9.570 CV 1
ASSI { 1642}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB2 ))
6.000 4.500 0.000 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.354 ppm2 2.906 CV 1
ASSI { 1643}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB3 ))
6.000 4.500 0.000 peak 1643 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.354 ppm2 2.727 CV 1
ASSI { 1644}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 64 and name HN ))
6.000 4.500 0.000 peak 1644 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.869 ppm2 7.835 CV 1
ASSI { 1646}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB2 ))
6.000 4.500 0.000 peak 1646 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.636 ppm2 3.511 CV 1
ASSI { 1647}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB3 ))
6.000 4.500 0.000 peak 1647 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.636 ppm2 3.378 CV 1
ASSI { 1651}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 1651 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.264 ppm2 7.795 CV 1
ASSI { 1652}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 35 and name HN ))
6.000 4.500 0.000 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.264 ppm2 8.356 CV 1
ASSI { 1653}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB3 ))
6.000 4.500 0.000 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.279 ppm2 1.263 CV 1
ASSI { 1654}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.068 ppm2 7.793 CV 1
ASSI { 1655}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 35 and name HN ))
6.000 4.500 0.000 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.069 ppm2 8.355 CV 1
ASSI { 1656}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HG3 ))
6.000 4.500 0.000 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.279 ppm2 1.070 CV 1
ASSI { 1657}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HN ))
6.000 4.500 0.000 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.627 ppm2 7.864 CV 1
ASSI { 1658}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HB2 ))
6.000 4.500 0.000 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.857 ppm2 1.312 CV 1
ASSI { 1659}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 65 and name HD1%)
6.000 4.500 0.000 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.849 ppm2 0.699 CV 1
ASSI { 1660}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 65 and name HD2%)
6.000 4.500 0.000 peak 1660 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.851 ppm2 0.626 CV 1
ASSI { 1661}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HB3 ))
6.000 4.500 0.000 peak 1661 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.858 ppm2 0.206 CV 1
ASSI { 1662}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HB3 ))
6.000 4.500 0.000 peak 1662 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.622 ppm2 0.200 CV 1
ASSI { 1663}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HB3 ))
6.000 4.500 0.000 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.690 ppm2 0.199 CV 1
ASSI { 1664}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HB3 ))
6.000 4.500 0.000 peak 1664 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.305 ppm2 0.196 CV 1
ASSI { 1666}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 1666 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.746 ppm2 7.793 CV 1
ASSI { 1671}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 33 and name HD2%)
6.000 4.500 0.000 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.744 ppm2 -0.816 CV 1
ASSI { 1672}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 33 and name HD1%)
6.000 4.500 0.000 peak 1672 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.742 ppm2 0.006 CV 1
ASSI { 1673}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HG ))
6.000 4.500 0.000 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.744 ppm2 0.861 CV 1
ASSI { 1675}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB2 ))
6.000 4.500 0.000 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.153 ppm2 1.742 CV 1
ASSI { 1676}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HG ))
6.000 4.500 0.000 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.153 ppm2 0.858 CV 1
ASSI { 1677}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 33 and name HD1%)
6.000 4.500 0.000 peak 1677 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.153 ppm2 0.000 CV 1
ASSI { 1678}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 33 and name HD2%)
6.000 4.500 0.000 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.153 ppm2 -0.816 CV 1
ASSI { 1679}
(( segid " " and resid 5 and name HZ2 ))
(( segid " " and resid 5 and name HE1 ))
6.000 4.500 0.000 peak 1679 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.445 ppm2 10.194 CV 1
ASSI { 1680}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HE1 ))
6.000 4.500 0.000 peak 1680 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.999 ppm2 7.920 CV 1
ASSI { 1681}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HE1 ))
6.000 4.500 0.000 peak 1681 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.914 ppm2 7.920 CV 1
ASSI { 1682}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HE1 ))
6.000 4.500 0.000 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.534 ppm2 7.923 CV 1
ASSI { 1690}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB3 ))
6.000 4.500 0.000 peak 1690 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.687 ppm2 3.040 CV 1
ASSI { 1691}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 67 and name HN ))
2.800 1.000 1.000 peak 1691 spectrum 1 weight 0.10000E+01 volume 0.14902E-01 ppm1 3.390 ppm2 7.968 CV 1
ASSI { 1696}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 30 and name HN ))
3.600 3.600 2.400 peak 1696 spectrum 1 weight 0.10000E+01 volume 0.32252E-02 ppm1 3.534 ppm2 9.955 CV 1
ASSI { 1697}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB3 ))
6.000 4.500 0.000 peak 1697 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.000 ppm2 3.537 CV 1
ASSI { 1702}
(( segid " " and resid 90 and name HB3 ))
(( segid " " and resid 91 and name HN ))
4.000 2.000 2.000 peak 1702 spectrum 1 weight 0.10000E+01 volume 0.17461E-02 ppm1 1.922 ppm2 8.242 CV 1
ASSI { 1704}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 91 and name HN ))
6.000 4.500 0.000 peak 1704 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.281 ppm2 8.242 CV 1
ASSI { 1705}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 91 and name HN ))
2.700 0.900 0.900 peak 1705 spectrum 1 weight 0.10000E+01 volume 0.17835E-01 ppm1 4.468 ppm2 8.242 CV 1
ASSI { 1711}
(( segid " " and resid 108 and name HG ))
(( segid " " and resid 108 and name HN ))
6.000 4.500 0.000 peak 1711 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.655 ppm2 9.153 CV 1
ASSI { 1712}
(( segid " " and resid 108 and name HG ))
(( segid " " and resid 109 and name HN ))
6.000 4.500 0.000 peak 1712 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.654 ppm2 8.663 CV 1
ASSI { 1713}
(( segid " " and resid 107 and name HB3 ))
(( segid " " and resid 107 and name HN ))
6.000 4.500 0.000 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.636 ppm2 8.930 CV 1
ASSI { 1714}
(( segid " " and resid 107 and name HB3 ))
(( segid " " and resid 108 and name HN ))
6.000 4.500 0.000 peak 1714 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.637 ppm2 9.152 CV 1
ASSI { 1715}
(( segid " " and resid 39 and name HG2 ))
(( segid " " and resid 39 and name HN ))
6.000 4.500 0.000 peak 1715 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.326 ppm2 7.917 CV 1
ASSI { 1716}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 39 and name HN ))
6.000 4.500 0.000 peak 1716 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.178 ppm2 7.918 CV 1
ASSI { 1717}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 41 and name HN ))
6.000 4.500 0.000 peak 1717 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.278 ppm2 8.721 CV 1
ASSI { 1718}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 42 and name HN ))
3.700 1.700 1.700 peak 1718 spectrum 1 weight 0.10000E+01 volume 0.26815E-02 ppm1 2.284 ppm2 7.946 CV 1
ASSI { 1719}
(( segid " " and resid 41 and name HG2 ))
(( segid " " and resid 42 and name HN ))
3.900 1.900 1.900 peak 1719 spectrum 1 weight 0.10000E+01 volume 0.20367E-02 ppm1 2.490 ppm2 7.947 CV 1
ASSI { 1726}
(( segid " " and resid 67 and name HA2 ))
(( segid " " and resid 68 and name HN ))
6.000 4.500 0.000 peak 1726 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.750 ppm2 8.287 CV 1
ASSI { 1727}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 68 and name HN ))
6.000 4.500 0.000 peak 1727 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.967 ppm2 8.287 CV 1
ASSI { 1730}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 1730 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.355 ppm2 8.388 CV 1
ASSI { 1731}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 1731 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.414 ppm2 8.388 CV 1
ASSI { 1733}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 1733 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.657 ppm2 8.388 CV 1
ASSI { 1734}
(( segid " " and resid 105 and name HG12))
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 1734 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.419 ppm2 8.389 CV 1
ASSI { 1736}
( segid " " and resid 104 and name HD2%)
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 1736 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.853 ppm2 8.389 CV 1
ASSI { 1737}
( segid " " and resid 104 and name HD1%)
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 1737 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.904 ppm2 8.389 CV 1
ASSI { 1738}
(( segid " " and resid 104 and name HB3 ))
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 1738 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.603 ppm2 8.390 CV 1
ASSI { 1739}
(( segid " " and resid 104 and name HB2 ))
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 1739 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.655 ppm2 8.390 CV 1
ASSI { 1740}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 106 and name HN ))
3.600 1.600 1.600 peak 1740 spectrum 1 weight 0.10000E+01 volume 0.33595E-02 ppm1 1.414 ppm2 9.065 CV 1
ASSI { 1741}
(( segid " " and resid 100 and name HB3 ))
(( segid " " and resid 100 and name HN ))
6.000 4.500 0.000 peak 1741 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.045 ppm2 8.891 CV 1
ASSI { 1742}
(( segid " " and resid 100 and name HG3 ))
(( segid " " and resid 100 and name HN ))
6.000 4.500 0.000 peak 1742 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.309 ppm2 8.891 CV 1
OR { 1742}
(( segid " " and resid 100 and name HG2 ))
(( segid " " and resid 100 and name HN ))
ASSI { 1743}
(( segid " " and resid 99 and name HB3 ))
(( segid " " and resid 100 and name HN ))
6.000 4.500 0.000 peak 1743 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.668 ppm2 8.887 CV 1
ASSI { 1744}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HN ))
6.000 4.500 0.000 peak 1744 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.182 ppm2 8.890 CV 1
ASSI { 1746}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HN ))
2.600 0.800 0.800 peak 1746 spectrum 1 weight 0.10000E+01 volume 0.22692E-01 ppm1 8.208 ppm2 8.889 CV 1
ASSI { 1748}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 98 and name HN ))
3.000 1.100 1.100 peak 1748 spectrum 1 weight 0.10000E+01 volume 0.91181E-02 ppm1 3.126 ppm2 8.503 CV 1
OR { 1748}
(( segid " " and resid 97 and name HB3 ))
(( segid " " and resid 98 and name HN ))
ASSI { 1749}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 98 and name HN ))
2.400 0.700 0.700 peak 1749 spectrum 1 weight 0.10000E+01 volume 0.37925E-01 ppm1 4.636 ppm2 8.504 CV 1
ASSI { 1750}
(( segid " " and resid 97 and name HB3 ))
(( segid " " and resid 97 and name HN ))
6.000 4.500 0.000 peak 1750 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.126 ppm2 8.405 CV 1
OR { 1750}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 97 and name HN ))
ASSI { 1751}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HN ))
2.800 1.000 1.000 peak 1751 spectrum 1 weight 0.10000E+01 volume 0.13975E-01 ppm1 7.833 ppm2 8.409 CV 1
ASSI { 1772}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 66 and name HN ))
6.000 4.500 0.000 peak 1772 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.156 ppm2 8.103 CV 1
ASSI { 1773}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 65 and name HN ))
6.000 4.500 0.000 peak 1773 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.159 ppm2 7.865 CV 1
ASSI { 1774}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 65 and name HN ))
3.600 1.600 1.600 peak 1774 spectrum 1 weight 0.10000E+01 volume 0.34674E-02 ppm1 7.001 ppm2 7.865 CV 1
ASSI { 1775}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 1775 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.850 ppm2 7.161 CV 1
ASSI { 1777}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 66 and name HD% )
3.500 1.500 1.500 peak 1777 spectrum 1 weight 0.10000E+01 volume 0.40706E-02 ppm1 3.851 ppm2 7.008 CV 1
ASSI { 1778}
(( segid " " and resid 66 and name HA ))
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.685 ppm2 7.159 CV 1
ASSI { 1779}
(( segid " " and resid 66 and name HA ))
( segid " " and resid 66 and name HD% )
6.000 4.500 0.000 peak 1779 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.685 ppm2 7.010 CV 1
ASSI { 1780}
(( segid " " and resid 66 and name HB3 ))
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 1780 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.039 ppm2 7.159 CV 1
ASSI { 1781}
(( segid " " and resid 66 and name HB3 ))
( segid " " and resid 66 and name HD% )
6.000 4.500 0.000 peak 1781 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.039 ppm2 7.010 CV 1
ASSI { 1782}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 1782 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.307 ppm2 7.161 CV 1
ASSI { 1784}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.700 ppm2 7.161 CV 1
ASSI { 1785}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 66 and name HD% )
3.300 3.300 2.700 peak 1785 spectrum 1 weight 0.10000E+01 volume 0.51499E-02 ppm1 0.700 ppm2 7.008 CV 1
ASSI { 1786}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 66 and name HE% )
4.200 2.200 1.800 peak 1786 spectrum 1 weight 0.10000E+01 volume 0.12065E-02 ppm1 0.628 ppm2 7.161 CV 1
ASSI { 1787}
( segid " " and resid 65 and name HD2%)
( segid " " and resid 66 and name HD% )
4.800 2.900 1.200 peak 1787 spectrum 1 weight 0.10000E+01 volume 0.57836E-03 ppm1 0.628 ppm2 7.008 CV 1
ASSI { 1788}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 66 and name HE% )
3.700 1.800 1.800 peak 1788 spectrum 1 weight 0.10000E+01 volume 0.25099E-02 ppm1 0.197 ppm2 7.160 CV 1
ASSI { 1789}
(( segid " " and resid 65 and name HB3 ))
( segid " " and resid 66 and name HD% )
3.400 1.500 1.500 peak 1789 spectrum 1 weight 0.10000E+01 volume 0.43916E-02 ppm1 0.198 ppm2 7.008 CV 1
ASSI { 1790}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 65 and name HN ))
6.000 4.500 0.000 peak 1790 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.472 ppm2 7.865 CV 1
ASSI { 1792}
(( segid " " and resid 65 and name HG ))
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 1792 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.472 ppm2 7.161 CV 1
ASSI { 1793}
(( segid " " and resid 65 and name HG ))
( segid " " and resid 66 and name HD% )
3.600 1.700 1.700 peak 1793 spectrum 1 weight 0.10000E+01 volume 0.29457E-02 ppm1 1.473 ppm2 7.007 CV 1
ASSI { 1796}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 27 and name HD% )
6.000 4.500 0.000 peak 1796 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.679 ppm2 6.378 CV 1
ASSI { 1802}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HN ))
3.100 1.200 1.200 peak 1802 spectrum 1 weight 0.10000E+01 volume 0.85273E-02 ppm1 8.339 ppm2 8.878 CV 1
ASSI { 1819}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 50 and name HD% )
3.800 1.800 1.800 peak 1819 spectrum 1 weight 0.10000E+01 volume 0.24324E-02 ppm1 4.636 ppm2 6.454 CV 1
ASSI { 1820}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 50 and name HE% )
6.000 4.500 0.000 peak 1820 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.637 ppm2 6.182 CV 1
ASSI { 1825}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 1825 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.571 ppm2 7.155 CV 1
ASSI { 1827}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name HD1 ))
6.000 4.500 0.000 peak 1827 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.571 ppm2 6.954 CV 1
ASSI { 1828}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 1828 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.491 ppm2 7.155 CV 1
ASSI { 1834}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HN ))
3.100 1.200 1.200 peak 1834 spectrum 1 weight 0.10000E+01 volume 0.77276E-02 ppm1 8.107 ppm2 8.736 CV 1
ASSI { 1835}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 55 and name HN ))
3.100 1.200 1.200 peak 1835 spectrum 1 weight 0.10000E+01 volume 0.81551E-02 ppm1 4.153 ppm2 8.113 CV 1
ASSI { 1836}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 54 and name HN ))
6.000 4.500 0.000 peak 1836 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.154 ppm2 8.729 CV 1
ASSI { 1837}
(( segid " " and resid 54 and name HA1 ))
(( segid " " and resid 54 and name HA2 ))
6.000 4.500 0.000 peak 1837 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.153 ppm2 3.646 CV 1
ASSI { 1838}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HG2 ))
6.000 4.500 0.000 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.635 ppm2 2.635 CV 1
ASSI { 1839}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HG3 ))
6.000 4.500 0.000 peak 1839 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.633 ppm2 2.579 CV 1
ASSI { 1840}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB3 ))
6.000 4.500 0.000 peak 1840 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.632 ppm2 1.910 CV 1
ASSI { 1842}
(( segid " " and resid 55 and name HG2 ))
(( segid " " and resid 55 and name HB3 ))
6.000 4.500 0.000 peak 1842 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.635 ppm2 1.916 CV 1
ASSI { 1843}
(( segid " " and resid 55 and name HG3 ))
(( segid " " and resid 55 and name HB3 ))
6.000 4.500 0.000 peak 1843 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.579 ppm2 1.917 CV 1
ASSI { 1844}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 56 and name HN ))
3.500 1.500 1.500 peak 1844 spectrum 1 weight 0.10000E+01 volume 0.38313E-02 ppm1 8.108 ppm2 8.327 CV 1
ASSI { 1845}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB ))
6.000 4.500 0.000 peak 1845 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.633 ppm2 1.761 CV 1
ASSI { 1846}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 56 and name HD1%)
6.000 4.500 0.000 peak 1846 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.633 ppm2 0.783 CV 1
ASSI { 1847}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 56 and name HG2%)
6.000 4.500 0.000 peak 1847 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.634 ppm2 0.602 CV 1
ASSI { 1848}
(( segid " " and resid 56 and name HB ))
( segid " " and resid 56 and name HD1%)
6.000 4.500 0.000 peak 1848 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.747 ppm2 0.788 CV 1
ASSI { 1849}
(( segid " " and resid 56 and name HB ))
( segid " " and resid 56 and name HG2%)
6.000 4.500 0.000 peak 1849 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.747 ppm2 0.601 CV 1
ASSI { 1850}
( segid " " and resid 56 and name HD1%)
( segid " " and resid 56 and name HG2%)
6.000 4.500 0.000 peak 1850 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.783 ppm2 0.594 CV 1
ASSI { 1852}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HA ))
6.000 4.500 0.000 peak 1852 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.973 ppm2 6.171 CV 1
ASSI { 1856}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HB2 ))
6.000 4.500 0.000 peak 1856 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.974 ppm2 1.781 CV 1
ASSI { 1857}
(( segid " " and resid 57 and name HB3 ))
( segid " " and resid 57 and name HD1%)
6.000 4.500 0.000 peak 1857 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.970 ppm2 1.163 CV 1
OR { 1857}
(( segid " " and resid 57 and name HB3 ))
( segid " " and resid 57 and name HD2%)
ASSI { 1858}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 57 and name HD2%)
6.000 4.500 0.000 peak 1858 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.777 ppm2 1.163 CV 1
ASSI { 1860}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HB3 ))
6.000 4.500 0.000 peak 1860 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.812 ppm2 2.823 CV 1
ASSI { 1861}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HB3 ))
6.000 4.500 0.000 peak 1861 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.485 ppm2 2.822 CV 1
ASSI { 1864}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 1864 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.186 ppm2 8.881 CV 1
OR { 1864}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HN ))
ASSI { 1868}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HD2 ))
6.000 4.500 0.000 peak 1868 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.477 ppm2 3.187 CV 1
OR { 1868}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HD3 ))
ASSI { 1869}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB2 ))
6.000 4.500 0.000 peak 1869 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.471 ppm2 1.991 CV 1
ASSI { 1870}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB3 ))
6.000 4.500 0.000 peak 1870 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.470 ppm2 1.797 CV 1
ASSI { 1871}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HG2 ))
6.000 4.500 0.000 peak 1871 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.470 ppm2 1.607 CV 1
ASSI { 1872}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HB2 ))
6.000 4.500 0.000 peak 1872 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.188 ppm2 1.992 CV 1
OR { 1872}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 1873}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HB3 ))
6.000 4.500 0.000 peak 1873 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.188 ppm2 1.797 CV 1
OR { 1873}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HB3 ))
ASSI { 1874}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HG2 ))
6.000 4.500 0.000 peak 1874 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.188 ppm2 1.606 CV 1
OR { 1874}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 1875}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HB3 ))
6.000 4.500 0.000 peak 1875 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.904 ppm2 2.722 CV 1
ASSI { 1879}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 61 and name HB3 ))
6.000 4.500 0.000 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.113 ppm2 2.535 CV 1
ASSI { 1880}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB2 ))
6.000 4.500 0.000 peak 1880 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.129 ppm2 2.700 CV 1
ASSI { 1881}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB3 ))
6.000 4.500 0.000 peak 1881 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.129 ppm2 2.665 CV 1
ASSI { 1882}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HN ))
2.900 1.000 1.000 peak 1882 spectrum 1 weight 0.10000E+01 volume 0.12840E-01 ppm1 8.408 ppm2 8.830 CV 1
ASSI { 1890}
(( segid " " and resid 62 and name HB2 ))
( segid " " and resid 62 and name HD% )
6.000 4.500 0.000 peak 1890 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.702 ppm2 6.522 CV 1
ASSI { 1891}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 62 and name HD% )
6.000 4.500 0.000 peak 1891 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.666 ppm2 6.522 CV 1
ASSI { 1893}
(( segid " " and resid 62 and name HB2 ))
( segid " " and resid 62 and name HE% )
6.000 4.500 0.000 peak 1893 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.701 ppm2 6.415 CV 1
ASSI { 1895}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 62 and name HE% )
6.000 4.500 0.000 peak 1895 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.665 ppm2 6.415 CV 1
ASSI { 1896}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HB ))
6.000 4.500 0.000 peak 1896 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.378 ppm2 1.876 CV 1
ASSI { 1897}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HG2%)
6.000 4.500 0.000 peak 1897 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.379 ppm2 1.206 CV 1
ASSI { 1898}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HD1%)
6.000 4.500 0.000 peak 1898 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.380 ppm2 0.824 CV 1
ASSI { 1899}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 63 and name HG2%)
6.000 4.500 0.000 peak 1899 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.878 ppm2 1.208 CV 1
ASSI { 1900}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 63 and name HD1%)
6.000 4.500 0.000 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.878 ppm2 0.826 CV 1
ASSI { 1901}
( segid " " and resid 63 and name HG2%)
( segid " " and resid 63 and name HD1%)
6.000 4.500 0.000 peak 1901 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.207 ppm2 0.826 CV 1
ASSI { 1902}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HB2 ))
6.000 4.500 0.000 peak 1902 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.899 ppm2 1.945 CV 1
ASSI { 1903}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HB3 ))
6.000 4.500 0.000 peak 1903 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.898 ppm2 1.868 CV 1
ASSI { 1904}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HG2 ))
6.000 4.500 0.000 peak 1904 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.898 ppm2 1.571 CV 1
ASSI { 1905}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HG2 ))
6.000 4.500 0.000 peak 1905 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.946 ppm2 1.571 CV 1
ASSI { 1906}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 64 and name HG2 ))
6.000 4.500 0.000 peak 1906 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.868 ppm2 1.571 CV 1
ASSI { 1909}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 65 and name HN ))
3.600 1.700 1.700 peak 1909 spectrum 1 weight 0.10000E+01 volume 0.29900E-02 ppm1 1.869 ppm2 7.866 CV 1
ASSI { 1910}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HG ))
6.000 4.500 0.000 peak 1910 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.857 ppm2 1.467 CV 1
ASSI { 1911}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 65 and name HB3 ))
6.000 4.500 0.000 peak 1911 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.473 ppm2 0.198 CV 1
ASSI { 1912}
(( segid " " and resid 65 and name HG ))
( segid " " and resid 65 and name HD2%)
6.000 4.500 0.000 peak 1912 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.466 ppm2 0.626 CV 1
ASSI { 1913}
(( segid " " and resid 65 and name HG ))
( segid " " and resid 65 and name HD1%)
6.000 4.500 0.000 peak 1913 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.469 ppm2 0.699 CV 1
ASSI { 1914}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 65 and name HB2 ))
6.000 4.500 0.000 peak 1914 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.466 ppm2 1.312 CV 1
ASSI { 1915}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 65 and name HD2%)
6.000 4.500 0.000 peak 1915 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.311 ppm2 0.626 CV 1
ASSI { 1916}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 65 and name HD1%)
6.000 4.500 0.000 peak 1916 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.304 ppm2 0.699 CV 1
ASSI { 1924}
(( segid " " and resid 119 and name HN ))
(( segid " " and resid 118 and name HN ))
4.200 2.200 1.800 peak 1924 spectrum 1 weight 0.10000E+01 volume 0.13089E-02 ppm1 7.988 ppm2 8.294 CV 1
ASSI { 1925}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 67 and name HA2 ))
6.000 4.500 0.000 peak 1925 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.968 ppm2 3.750 CV 1
ASSI { 1926}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HG3 ))
6.000 4.500 0.000 peak 1926 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.181 ppm2 2.316 CV 1
OR { 1926}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HG2 ))
ASSI { 1927}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HB2 ))
6.000 4.500 0.000 peak 1927 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.181 ppm2 2.048 CV 1
OR { 1927}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HB3 ))
ASSI { 1928}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HB3 ))
6.000 4.500 0.000 peak 1928 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.569 ppm2 1.558 CV 1
ASSI { 1930}
(( segid " " and resid 101 and name HB2 ))
(( segid " " and resid 101 and name HN ))
6.000 4.500 0.000 peak 1930 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.289 ppm2 8.219 CV 1
ASSI { 1931}
(( segid " " and resid 110 and name HB2 ))
(( segid " " and resid 110 and name HD21))
6.000 4.500 0.000 peak 1931 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.189 ppm2 8.219 CV 1
ASSI { 1937}
(( segid " " and resid 102 and name HB3 ))
(( segid " " and resid 103 and name HN ))
3.400 1.500 1.500 peak 1937 spectrum 1 weight 0.10000E+01 volume 0.43487E-02 ppm1 1.558 ppm2 8.950 CV 1
ASSI { 1938}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 103 and name HN ))
6.000 4.500 0.000 peak 1938 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.898 ppm2 8.951 CV 1
ASSI { 1939}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 103 and name HN ))
6.000 4.500 0.000 peak 1939 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.567 ppm2 8.951 CV 1
ASSI { 1940}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB2 ))
6.000 4.500 0.000 peak 1940 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.485 ppm2 3.429 CV 1
ASSI { 1941}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB3 ))
6.000 4.500 0.000 peak 1941 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.485 ppm2 2.819 CV 1
ASSI { 1943}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 37 and name HN ))
3.200 1.300 1.300 peak 1943 spectrum 1 weight 0.10000E+01 volume 0.61309E-02 ppm1 7.911 ppm2 8.928 CV 1
ASSI { 1945}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 38 and name HN ))
3.000 1.100 1.100 peak 1945 spectrum 1 weight 0.10000E+01 volume 0.10455E-01 ppm1 3.426 ppm2 8.286 CV 1
ASSI { 1946}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 39 and name HN ))
6.000 4.500 0.000 peak 1946 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.263 ppm2 7.919 CV 1
ASSI { 1947}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 39 and name HN ))
2.900 1.100 1.100 peak 1947 spectrum 1 weight 0.10000E+01 volume 0.11458E-01 ppm1 3.427 ppm2 7.918 CV 1
ASSI { 1949}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HN ))
6.000 4.500 0.000 peak 1949 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.908 ppm2 8.287 CV 1
ASSI { 1950}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HN ))
3.600 1.700 1.700 peak 1950 spectrum 1 weight 0.10000E+01 volume 0.29734E-02 ppm1 4.907 ppm2 7.919 CV 1
ASSI { 1952}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HG2 ))
6.000 4.500 0.000 peak 1952 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.153 ppm2 2.325 CV 1
ASSI { 1953}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HG3 ))
6.000 4.500 0.000 peak 1953 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.153 ppm2 2.177 CV 1
ASSI { 1954}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HG3 ))
6.000 4.500 0.000 peak 1954 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.478 ppm2 2.179 CV 1
ASSI { 1955}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HG2 ))
6.000 4.500 0.000 peak 1955 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.480 ppm2 2.325 CV 1
ASSI { 1956}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 39 and name HG3 ))
6.000 4.500 0.000 peak 1956 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.377 ppm2 2.177 CV 1
ASSI { 1958}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HG2 ))
6.000 4.500 0.000 peak 1958 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.231 ppm2 2.494 CV 1
ASSI { 1959}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HG3 ))
6.000 4.500 0.000 peak 1959 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.232 ppm2 2.287 CV 1
ASSI { 1960}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB2 ))
6.000 4.500 0.000 peak 1960 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.233 ppm2 2.167 CV 1
ASSI { 1961}
(( segid " " and resid 41 and name HG2 ))
(( segid " " and resid 41 and name HB2 ))
6.000 4.500 0.000 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.488 ppm2 2.167 CV 1
ASSI { 1962}
(( segid " " and resid 41 and name HG2 ))
(( segid " " and resid 41 and name HG3 ))
6.000 4.500 0.000 peak 1962 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.488 ppm2 2.288 CV 1
ASSI { 1963}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 41 and name HB2 ))
6.000 4.500 0.000 peak 1963 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.286 ppm2 2.166 CV 1
ASSI { 1965}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HG ))
6.000 4.500 0.000 peak 1965 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.792 ppm2 1.420 CV 1
ASSI { 1966}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB2 ))
6.000 4.500 0.000 peak 1966 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.792 ppm2 1.157 CV 1
ASSI { 1967}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB3 ))
6.000 4.500 0.000 peak 1967 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.792 ppm2 1.092 CV 1
ASSI { 1968}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 42 and name HD1%)
6.000 4.500 0.000 peak 1968 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.798 ppm2 0.766 CV 1
ASSI { 1974}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
3.200 1.300 1.300 peak 1974 spectrum 1 weight 0.10000E+01 volume 0.66898E-02 ppm1 7.943 ppm2 9.803 CV 1
ASSI { 1975}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
2.700 0.900 0.900 peak 1975 spectrum 1 weight 0.10000E+01 volume 0.16299E-01 ppm1 7.554 ppm2 9.803 CV 1
ASSI { 1976}
(( segid " " and resid 87 and name HB ))
( segid " " and resid 87 and name HG1%)
6.000 4.500 0.000 peak 1976 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.045 ppm2 0.928 CV 1
OR { 1976}
(( segid " " and resid 87 and name HB ))
( segid " " and resid 87 and name HG2%)
ASSI { 1985}
(( segid " " and resid 13 and name HA1 ))
(( segid " " and resid 13 and name HA2 ))
6.000 4.500 0.000 peak 1985 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.332 ppm2 3.873 CV 1
ASSI { 1986}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB2 ))
6.000 4.500 0.000 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.257 ppm2 1.439 CV 1
ASSI { 1987}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB3 ))
6.000 4.500 0.000 peak 1987 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.254 ppm2 1.209 CV 1
ASSI { 1988}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HG2 ))
6.000 4.500 0.000 peak 1988 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.256 ppm2 1.015 CV 1
OR { 1988}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HG3 ))
ASSI { 1994}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HN ))
6.000 4.500 0.000 peak 1994 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.920 ppm2 8.542 CV 1
ASSI { 1999}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 9 and name HN ))
3.500 1.500 1.500 peak 1999 spectrum 1 weight 0.10000E+01 volume 0.37925E-02 ppm1 3.356 ppm2 8.747 CV 1
ASSI { 2010}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HD2 ))
6.000 4.500 0.000 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.445 ppm2 1.190 CV 1
OR { 2010}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HD2 ))
ASSI { 2011}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HD3 ))
6.000 4.500 0.000 peak 2011 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.445 ppm2 0.960 CV 1
ASSI { 2012}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HG3 ))
6.000 4.500 0.000 peak 2012 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.443 ppm2 0.595 CV 1
OR { 2012}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HG3 ))
OR { 2012}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HG2 ))
ASSI { 2013}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HG2 ))
6.000 4.500 0.000 peak 2013 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.199 ppm2 0.595 CV 1
OR { 2013}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HG3 ))
ASSI { 2014}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HD3 ))
6.000 4.500 0.000 peak 2014 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.199 ppm2 0.958 CV 1
ASSI { 2015}
(( segid " " and resid 6 and name HD3 ))
(( segid " " and resid 6 and name HG2 ))
6.000 4.500 0.000 peak 2015 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.955 ppm2 0.597 CV 1
OR { 2015}
(( segid " " and resid 6 and name HD3 ))
(( segid " " and resid 6 and name HG3 ))
ASSI { 2025}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 2025 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.280 ppm2 8.370 CV 1
OR { 2025}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 7 and name HN ))
ASSI { 2027}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 2027 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.280 ppm2 8.537 CV 1
ASSI { 2036}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB2 ))
6.000 4.500 0.000 peak 2036 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.567 ppm2 1.554 CV 1
ASSI { 2037}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB3 ))
6.000 4.500 0.000 peak 2037 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.562 ppm2 1.448 CV 1
ASSI { 2038}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG3 ))
6.000 4.500 0.000 peak 2038 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.564 ppm2 1.278 CV 1
OR { 2038}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG2 ))
ASSI { 2039}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HB2 ))
6.000 4.500 0.000 peak 2039 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.355 ppm2 3.353 CV 1
ASSI { 2040}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HB3 ))
6.000 4.500 0.000 peak 2040 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.359 ppm2 2.253 CV 1
ASSI { 2041}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 10 and name HA2 ))
6.000 4.500 0.000 peak 2041 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.291 ppm2 3.927 CV 1
ASSI { 2042}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HA ))
6.000 4.500 0.000 peak 2042 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.359 ppm2 5.097 CV 1
ASSI { 2043}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HA ))
6.000 4.500 0.000 peak 2043 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.167 ppm2 5.097 CV 1
ASSI { 2045}
(( segid " " and resid 12 and name HA1 ))
(( segid " " and resid 12 and name HA2 ))
6.000 4.500 0.000 peak 2045 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.256 ppm2 3.875 CV 1
ASSI { 2046}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 18 and name HN ))
6.000 4.500 0.000 peak 2046 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.635 ppm2 8.644 CV 1
ASSI { 2047}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 18 and name HN ))
4.300 2.400 1.700 peak 2047 spectrum 1 weight 0.10000E+01 volume 0.10267E-02 ppm1 2.596 ppm2 8.644 CV 1
ASSI { 2048}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HN ))
3.400 1.400 1.400 peak 2048 spectrum 1 weight 0.10000E+01 volume 0.49119E-02 ppm1 7.878 ppm2 8.644 CV 1
ASSI { 2059}
(( segid " " and resid 57 and name HG ))
(( segid " " and resid 57 and name HN ))
6.000 4.500 0.000 peak 2059 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.620 ppm2 9.570 CV 1
ASSI { 2060}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 28 and name HE1 ))
3.400 1.400 1.400 peak 2060 spectrum 1 weight 0.10000E+01 volume 0.48552E-02 ppm1 3.569 ppm2 9.576 CV 1
ASSI { 2062}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB3 ))
6.000 4.500 0.000 peak 2062 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.954 ppm2 2.939 CV 1
ASSI { 2063}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
6.000 4.500 0.000 peak 2063 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.953 ppm2 2.773 CV 1
ASSI { 2064}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HN ))
2.900 1.000 1.000 peak 2064 spectrum 1 weight 0.10000E+01 volume 0.12897E-01 ppm1 7.194 ppm2 8.491 CV 1
ASSI { 2065}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 26 and name HN ))
6.000 4.500 0.000 peak 2065 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.759 ppm2 7.206 CV 1
ASSI { 2066}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB3 ))
6.000 4.500 0.000 peak 2066 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.597 ppm2 2.708 CV 1
OR { 2066}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB2 ))
ASSI { 2067}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HN ))
6.000 4.500 0.000 peak 2067 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.637 ppm2 8.406 CV 1
ASSI { 2068}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HB2 ))
6.000 4.500 0.000 peak 2068 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.635 ppm2 3.127 CV 1
OR { 2068}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HB3 ))
ASSI { 2069}
(( segid " " and resid 98 and name HA1 ))
(( segid " " and resid 98 and name HN ))
6.000 4.500 0.000 peak 2069 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.302 ppm2 8.508 CV 1
ASSI { 2071}
(( segid " " and resid 98 and name HA2 ))
(( segid " " and resid 98 and name HN ))
6.000 4.500 0.000 peak 2071 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.873 ppm2 8.505 CV 1
ASSI { 2072}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 58 and name HN ))
2.900 1.000 1.000 peak 2072 spectrum 1 weight 0.10000E+01 volume 0.11887E-01 ppm1 0.758 ppm2 8.935 CV 1
ASSI { 2073}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 9 and name HN ))
3.000 1.100 1.100 peak 2073 spectrum 1 weight 0.10000E+01 volume 0.94225E-02 ppm1 5.662 ppm2 8.745 CV 1
ASSI { 2075}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 40 and name HN ))
3.100 1.200 1.200 peak 2075 spectrum 1 weight 0.10000E+01 volume 0.84374E-02 ppm1 2.818 ppm2 8.581 CV 1
ASSI { 2076}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 40 and name HN ))
3.300 1.300 1.300 peak 2076 spectrum 1 weight 0.10000E+01 volume 0.57891E-02 ppm1 3.441 ppm2 8.581 CV 1
ASSI { 2080}
(( segid " " and resid 63 and name HG12))
(( segid " " and resid 63 and name HN ))
6.000 4.500 0.000 peak 2080 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.714 ppm2 8.411 CV 1
ASSI { 2081}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 67 and name HN ))
3.400 1.400 1.400 peak 2081 spectrum 1 weight 0.10000E+01 volume 0.45079E-02 ppm1 1.949 ppm2 7.967 CV 1
ASSI { 2090}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 50 and name HN ))
3.700 1.700 1.700 peak 2090 spectrum 1 weight 0.10000E+01 volume 0.29139E-02 ppm1 0.598 ppm2 8.846 CV 1
ASSI { 2093}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 57 and name HN ))
3.500 1.500 1.500 peak 2093 spectrum 1 weight 0.10000E+01 volume 0.36846E-02 ppm1 2.404 ppm2 9.569 CV 1
ASSI { 2095}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HN ))
4.100 2.100 1.900 peak 2095 spectrum 1 weight 0.10000E+01 volume 0.15068E-02 ppm1 8.567 ppm2 8.841 CV 1
ASSI { 2097}
( segid " " and resid 57 and name HD1%)
(( segid " " and resid 61 and name HN ))
3.700 1.700 1.700 peak 2097 spectrum 1 weight 0.10000E+01 volume 0.25888E-02 ppm1 1.162 ppm2 9.120 CV 1
OR { 2097}
( segid " " and resid 57 and name HD2%)
(( segid " " and resid 61 and name HN ))
ASSI { 2099}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 20 and name HN ))
4.100 2.100 1.900 peak 2099 spectrum 1 weight 0.10000E+01 volume 0.15497E-02 ppm1 0.859 ppm2 9.279 CV 1
OR { 2099}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 20 and name HN ))
ASSI { 2102}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB2 ))
6.000 4.500 0.000 peak 2102 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.592 ppm2 1.193 CV 1
ASSI { 2103}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HD2%)
6.000 4.500 0.000 peak 2103 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.593 ppm2 0.956 CV 1
ASSI { 2104}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HG ))
6.000 4.500 0.000 peak 2104 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.592 ppm2 0.864 CV 1
ASSI { 2108}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 21 and name HN ))
2.800 1.000 1.000 peak 2108 spectrum 1 weight 0.10000E+01 volume 0.13584E-01 ppm1 2.083 ppm2 8.631 CV 1
ASSI { 2109}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HB2 ))
6.000 4.500 0.000 peak 2109 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.863 ppm2 2.092 CV 1
ASSI { 2114}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HN ))
6.000 4.500 0.000 peak 2114 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.600 ppm2 9.359 CV 1
ASSI { 2115}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 2115 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.850 ppm2 8.631 CV 1
ASSI { 2116}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HB2 ))
6.000 4.500 0.000 peak 2116 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.849 ppm2 1.195 CV 1
ASSI { 2117}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 21 and name HD2%)
6.000 4.500 0.000 peak 2117 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.849 ppm2 0.950 CV 1
ASSI { 2119}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 47 and name HG2%)
6.000 4.500 0.000 peak 2119 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.508 ppm2 1.216 CV 1
ASSI { 2120}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 47 and name HN ))
6.000 4.500 0.000 peak 2120 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.656 ppm2 8.342 CV 1
ASSI { 2121}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 48 and name HN ))
6.000 4.500 0.000 peak 2121 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.655 ppm2 7.754 CV 1
ASSI { 2122}
(( segid " " and resid 47 and name HB ))
( segid " " and resid 47 and name HG2%)
6.000 4.500 0.000 peak 2122 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.655 ppm2 1.216 CV 1
ASSI { 2123}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HB ))
6.000 4.500 0.000 peak 2123 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.355 ppm2 1.416 CV 1
ASSI { 2124}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 105 and name HG2%)
6.000 4.500 0.000 peak 2124 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.355 ppm2 0.671 CV 1
ASSI { 2125}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HG12))
6.000 4.500 0.000 peak 2125 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.355 ppm2 0.413 CV 1
OR { 2125}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HG13))
ASSI { 2126}
(( segid " " and resid 105 and name HB ))
( segid " " and resid 105 and name HG2%)
6.000 4.500 0.000 peak 2126 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.418 ppm2 0.671 CV 1
ASSI { 2127}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 105 and name HG12))
6.000 4.500 0.000 peak 2127 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.416 ppm2 0.414 CV 1
OR { 2127}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 105 and name HG13))
ASSI { 2130}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HE21))
6.000 4.500 0.000 peak 2130 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.163 ppm2 7.528 CV 1
ASSI { 2131}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 41 and name HE21))
6.000 4.500 0.000 peak 2131 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.282 ppm2 7.527 CV 1
ASSI { 2132}
(( segid " " and resid 41 and name HG2 ))
(( segid " " and resid 41 and name HE21))
6.000 4.500 0.000 peak 2132 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.489 ppm2 7.527 CV 1
ASSI { 2133}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HE21))
6.000 4.500 0.000 peak 2133 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.230 ppm2 7.528 CV 1
ASSI { 2136}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB3 ))
6.000 4.500 0.000 peak 2136 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.232 ppm2 2.029 CV 1
ASSI { 2137}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HN ))
6.000 4.500 0.000 peak 2137 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.025 ppm2 8.719 CV 1
ASSI { 2138}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HE21))
6.000 4.500 0.000 peak 2138 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.022 ppm2 7.528 CV 1
ASSI { 2140}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 117 and name HB2 ))
6.000 4.500 0.000 peak 2140 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.683 ppm2 2.809 CV 1
ASSI { 2141}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 117 and name HB3 ))
6.000 4.500 0.000 peak 2141 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.683 ppm2 2.708 CV 1
ASSI { 2144}
(( segid " " and resid 117 and name HB3 ))
(( segid " " and resid 117 and name HD21))
6.000 4.500 0.000 peak 2144 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.707 ppm2 7.639 CV 1
ASSI { 2145}
(( segid " " and resid 117 and name HB2 ))
(( segid " " and resid 117 and name HD21))
6.000 4.500 0.000 peak 2145 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.807 ppm2 7.638 CV 1
ASSI { 2146}
(( segid " " and resid 68 and name HB3 ))
(( segid " " and resid 68 and name HD21))
6.000 4.500 0.000 peak 2146 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.718 ppm2 7.563 CV 1
ASSI { 2147}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HD21))
6.000 4.500 0.000 peak 2147 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.822 ppm2 7.563 CV 1
ASSI { 2148}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HD21))
6.000 4.500 0.000 peak 2148 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.723 ppm2 7.716 CV 1
ASSI { 2149}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HD21))
6.000 4.500 0.000 peak 2149 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.901 ppm2 7.716 CV 1
ASSI { 2152}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name HN ))
6.000 4.500 0.000 peak 2152 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.515 ppm2 6.962 CV 1
ASSI { 2153}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB3 ))
6.000 4.500 0.000 peak 2153 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.153 ppm2 0.514 CV 1
ASSI { 2156}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HB3 ))
6.000 4.500 0.000 peak 2156 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.744 ppm2 0.515 CV 1
ASSI { 2157}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 34 and name HN ))
3.200 1.300 1.300 peak 2157 spectrum 1 weight 0.10000E+01 volume 0.65487E-02 ppm1 0.504 ppm2 7.792 CV 1
ASSI { 2158}
(( segid " " and resid 34 and name HD2 ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 2158 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.695 ppm2 7.795 CV 1
OR { 2158}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 34 and name HN ))
ASSI { 2161}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HD2 ))
6.000 4.500 0.000 peak 2161 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.282 ppm2 1.451 CV 1
ASSI { 2162}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HD3 ))
6.000 4.500 0.000 peak 2162 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.282 ppm2 0.830 CV 1
ASSI { 2163}
(( segid " " and resid 52 and name HG3 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 2163 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.486 ppm2 7.815 CV 1
ASSI { 2164}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 2164 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.552 ppm2 8.369 CV 1
ASSI { 2165}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 2165 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.555 ppm2 8.536 CV 1
ASSI { 2167}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HB2 ))
6.000 4.500 0.000 peak 2167 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.078 ppm2 1.554 CV 1
OR { 2167}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HB2 ))
ASSI { 2168}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HB3 ))
6.000 4.500 0.000 peak 2168 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.075 ppm2 1.453 CV 1
OR { 2168}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HB3 ))
ASSI { 2169}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HG3 ))
6.000 4.500 0.000 peak 2169 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.078 ppm2 1.278 CV 1
OR { 2169}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HG2 ))
OR { 2169}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HG2 ))
OR { 2169}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 2170}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 107 and name HB3 ))
6.000 4.500 0.000 peak 2170 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.015 ppm2 1.637 CV 1
ASSI { 2171}
(( segid " " and resid 107 and name HD3 ))
(( segid " " and resid 107 and name HB3 ))
6.000 4.500 0.000 peak 2171 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.910 ppm2 1.637 CV 1
OR { 2171}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 107 and name HB3 ))
ASSI { 2173}
(( segid " " and resid 60 and name HD22))
(( segid " " and resid 60 and name HD21))
6.000 4.500 0.000 peak 2173 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.978 ppm2 7.715 CV 1
ASSI { 2174}
(( segid " " and resid 5 and name HD1 ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 2174 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.197 ppm2 7.734 CV 1
ASSI { 2180}
(( segid " " and resid 24 and name HG3 ))
(( segid " " and resid 24 and name HN ))
6.000 4.500 0.000 peak 2180 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.442 ppm2 10.041 CV 1
OR { 2180}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 24 and name HN ))
ASSI { 2181}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HG3 ))
6.000 4.500 0.000 peak 2181 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.758 ppm2 2.450 CV 1
ASSI { 2182}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HB2 ))
6.000 4.500 0.000 peak 2182 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.492 ppm2 2.009 CV 1
OR { 2182}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HB3 ))
ASSI { 2183}
(( segid " " and resid 110 and name HB3 ))
(( segid " " and resid 110 and name HD21))
6.000 4.500 0.000 peak 2183 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.438 ppm2 8.219 CV 1
ASSI { 2185}
( segid " " and resid 55 and name HE% )
(( segid " " and resid 55 and name HN ))
6.000 4.500 0.000 peak 2185 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.229 ppm2 8.107 CV 1
ASSI { 2186}
( segid " " and resid 57 and name HD2%)
(( segid " " and resid 55 and name HN ))
3.500 1.500 1.500 peak 2186 spectrum 1 weight 0.10000E+01 volume 0.36943E-02 ppm1 1.164 ppm2 8.111 CV 1
OR { 2186}
( segid " " and resid 57 and name HD1%)
(( segid " " and resid 55 and name HN ))
ASSI { 2187}
(( segid " " and resid 18 and name HG3 ))
(( segid " " and resid 110 and name HD21))
4.000 2.000 2.000 peak 2187 spectrum 1 weight 0.10000E+01 volume 0.16147E-02 ppm1 0.758 ppm2 8.219 CV 1
ASSI { 2189}
(( segid " " and resid 102 and name HB3 ))
(( segid " " and resid 101 and name HN ))
4.200 2.300 1.800 peak 2189 spectrum 1 weight 0.10000E+01 volume 0.11899E-02 ppm1 1.555 ppm2 8.215 CV 1
ASSI { 2190}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 101 and name HN ))
3.900 1.900 1.900 peak 2190 spectrum 1 weight 0.10000E+01 volume 0.18375E-02 ppm1 1.898 ppm2 8.217 CV 1
OR { 2190}
(( segid " " and resid 122 and name HB3 ))
(( segid " " and resid 121 and name HN ))
ASSI { 2191}
( segid " " and resid 71 and name HB% )
(( segid " " and resid 95 and name HN ))
4.400 2.400 1.600 peak 2191 spectrum 1 weight 0.10000E+01 volume 0.95470E-03 ppm1 1.367 ppm2 8.275 CV 1
ASSI { 2192}
(( segid " " and resid 110 and name HD22))
(( segid " " and resid 110 and name HD21))
2.100 0.600 0.600 peak 2192 spectrum 1 weight 0.10000E+01 volume 0.75892E-01 ppm1 6.505 ppm2 8.218 CV 1
ASSI { 2194}
(( segid " " and resid 18 and name HD3 ))
( segid " " and resid 19 and name HE% )
6.000 4.500 0.000 peak 2194 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.825 ppm2 7.299 CV 1
OR { 2194}
(( segid " " and resid 18 and name HD2 ))
( segid " " and resid 19 and name HE% )
ASSI { 2198}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HB2 ))
6.000 4.500 0.000 peak 2198 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.573 ppm2 1.430 CV 1
ASSI { 2199}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HG2 ))
6.000 4.500 0.000 peak 2199 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.575 ppm2 1.063 CV 1
ASSI { 2200}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HG3 ))
6.000 4.500 0.000 peak 2200 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.571 ppm2 0.764 CV 1
ASSI { 2201}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HD2 ))
6.000 4.500 0.000 peak 2201 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.571 ppm2 2.834 CV 1
OR { 2201}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HD3 ))
ASSI { 2203}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 23 and name HN ))
2.700 0.900 0.900 peak 2203 spectrum 1 weight 0.10000E+01 volume 0.16299E-01 ppm1 6.945 ppm2 8.966 CV 1
ASSI { 2204}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 23 and name HN ))
2.900 1.100 1.100 peak 2204 spectrum 1 weight 0.10000E+01 volume 0.11509E-01 ppm1 7.197 ppm2 8.968 CV 1
ASSI { 2207}
(( segid " " and resid 56 and name HG12))
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 2207 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.617 ppm2 8.329 CV 1
OR { 2207}
(( segid " " and resid 56 and name HG13))
(( segid " " and resid 56 and name HN ))
ASSI { 2210}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 55 and name HN ))
6.000 4.500 0.000 peak 2210 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.911 ppm2 8.111 CV 1
ASSI { 2213}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 61 and name HN ))
3.800 1.800 1.800 peak 2213 spectrum 1 weight 0.10000E+01 volume 0.24034E-02 ppm1 1.972 ppm2 9.114 CV 1
ASSI { 2219}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 2219 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.315 ppm2 8.388 CV 1
ASSI { 2220}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 105 and name HD1%)
6.000 4.500 0.000 peak 2220 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.355 ppm2 0.318 CV 1
ASSI { 2221}
(( segid " " and resid 105 and name HB ))
( segid " " and resid 105 and name HD1%)
6.000 4.500 0.000 peak 2221 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.418 ppm2 0.320 CV 1
ASSI { 2224}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 2224 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.407 ppm2 7.949 CV 1
ASSI { 2225}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 42 and name HD2%)
6.000 4.500 0.000 peak 2225 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.796 ppm2 0.415 CV 1
ASSI { 2226}
(( segid " " and resid 18 and name HG3 ))
(( segid " " and resid 19 and name HN ))
6.000 4.500 0.000 peak 2226 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.764 ppm2 7.879 CV 1
ASSI { 2227}
( segid " " and resid 19 and name HD% )
( segid " " and resid 19 and name HE% )
6.000 4.500 0.000 peak 2227 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.146 ppm2 7.295 CV 1
ASSI { 2228}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 2228 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.570 ppm2 8.630 CV 1
ASSI { 2229}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HB3 ))
6.000 4.500 0.000 peak 2229 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.575 ppm2 1.260 CV 1
ASSI { 2230}
(( segid " " and resid 18 and name HD2 ))
(( segid " " and resid 18 and name HB3 ))
6.000 4.500 0.000 peak 2230 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.827 ppm2 1.260 CV 1
OR { 2230}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 18 and name HB3 ))
ASSI { 2231}
(( segid " " and resid 18 and name HD3 ))
( segid " " and resid 19 and name HD% )
6.000 4.500 0.000 peak 2231 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.825 ppm2 7.158 CV 1
OR { 2231}
(( segid " " and resid 18 and name HD2 ))
( segid " " and resid 19 and name HD% )
ASSI { 2233}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 19 and name HE% )
6.000 4.500 0.000 peak 2233 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.571 ppm2 7.298 CV 1
ASSI { 2240}
(( segid " " and resid 18 and name HD2 ))
(( segid " " and resid 19 and name HN ))
6.000 4.500 0.000 peak 2240 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.825 ppm2 7.880 CV 1
OR { 2240}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 19 and name HN ))
ASSI { 2241}
(( segid " " and resid 18 and name HG3 ))
(( segid " " and resid 18 and name HN ))
6.000 4.500 0.000 peak 2241 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.758 ppm2 8.644 CV 1
ASSI { 2242}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 18 and name HN ))
6.000 4.500 0.000 peak 2242 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.259 ppm2 8.644 CV 1
ASSI { 2243}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 18 and name HN ))
6.000 4.500 0.000 peak 2243 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.428 ppm2 8.644 CV 1
ASSI { 2244}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HN ))
6.000 4.500 0.000 peak 2244 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.569 ppm2 8.644 CV 1
ASSI { 2245}
(( segid " " and resid 15 and name HG12))
(( segid " " and resid 16 and name HN ))
3.800 1.800 1.800 peak 2245 spectrum 1 weight 0.10000E+01 volume 0.23646E-02 ppm1 1.254 ppm2 7.913 CV 1
OR { 2245}
(( segid " " and resid 15 and name HG12))
(( segid " " and resid 29 and name HE1 ))
ASSI { 2246}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 39 and name HN ))
6.000 4.500 0.000 peak 2246 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.385 ppm2 7.918 CV 1
ASSI { 2248}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 39 and name HE22))
6.000 4.500 0.000 peak 2248 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.175 ppm2 6.694 CV 1
ASSI { 2252}
(( segid " " and resid 117 and name HD22))
(( segid " " and resid 117 and name HD21))
6.000 4.500 0.000 peak 2252 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.890 ppm2 7.640 CV 1
ASSI { 2253}
(( segid " " and resid 41 and name HE22))
(( segid " " and resid 41 and name HE21))
6.000 4.500 0.000 peak 2253 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.843 ppm2 7.526 CV 1
ASSI { 2256}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 41 and name HE22))
6.000 4.500 0.000 peak 2256 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.024 ppm2 6.855 CV 1
ASSI { 2257}
(( segid " " and resid 112 and name HE22))
(( segid " " and resid 112 and name HE21))
6.000 4.500 0.000 peak 2257 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.562 ppm2 7.043 CV 1
ASSI { 2258}
(( segid " " and resid 68 and name HD22))
(( segid " " and resid 68 and name HD21))
6.000 4.500 0.000 peak 2258 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.842 ppm2 7.562 CV 1
ASSI { 2264}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 39 and name HN ))
6.000 4.500 0.000 peak 2264 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.825 ppm2 7.920 CV 1
ASSI { 2266}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 13 and name HN ))
3.400 1.400 1.400 peak 2266 spectrum 1 weight 0.10000E+01 volume 0.48939E-02 ppm1 2.248 ppm2 9.191 CV 1
ASSI { 2267}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 29 and name HN ))
3.000 1.200 1.200 peak 2267 spectrum 1 weight 0.10000E+01 volume 0.86643E-02 ppm1 3.266 ppm2 9.242 CV 1
ASSI { 2268}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 29 and name HN ))
4.000 2.000 2.000 peak 2268 spectrum 1 weight 0.10000E+01 volume 0.16977E-02 ppm1 3.355 ppm2 9.242 CV 1
ASSI { 2269}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 29 and name HN ))
4.100 2.100 1.900 peak 2269 spectrum 1 weight 0.10000E+01 volume 0.15552E-02 ppm1 4.351 ppm2 9.242 CV 1
ASSI { 2274}
(( segid " " and resid 5 and name HE3 ))
(( segid " " and resid 6 and name HN ))
3.700 1.700 1.700 peak 2274 spectrum 1 weight 0.10000E+01 volume 0.28046E-02 ppm1 7.525 ppm2 9.208 CV 1
ASSI { 2276}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 15 and name HN ))
6.000 4.500 0.000 peak 2276 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.251 ppm2 8.542 CV 1
ASSI { 2284}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 26 and name HN ))
6.000 4.500 0.000 peak 2284 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.593 ppm2 7.207 CV 1
OR { 2284}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 26 and name HN ))
ASSI { 2285}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 5 and name HD1 ))
6.000 4.500 0.000 peak 2285 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.380 ppm2 7.193 CV 1
OR { 2285}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 5 and name HD1 ))
ASSI { 2295}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HN ))
2.900 1.000 1.000 peak 2295 spectrum 1 weight 0.10000E+01 volume 0.12688E-01 ppm1 7.116 ppm2 7.558 CV 1
ASSI { 2297}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 2297 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.949 ppm2 7.159 CV 1
ASSI { 2298}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 66 and name HD% )
6.000 4.500 0.000 peak 2298 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.949 ppm2 7.011 CV 1
ASSI { 2299}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB2 ))
6.000 4.500 0.000 peak 2299 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.691 ppm2 1.948 CV 1
ASSI { 2300}
(( segid " " and resid 13 and name HA1 ))
(( segid " " and resid 7 and name HE ))
6.000 4.500 0.000 peak 2300 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.327 ppm2 7.266 CV 1
ASSI { 2301}
(( segid " " and resid 113 and name HA ))
( segid " " and resid 113 and name HD% )
6.000 4.500 0.000 peak 2301 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.335 ppm2 7.151 CV 1
ASSI { 2303}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 16 and name HN ))
2.600 0.800 0.800 peak 2303 spectrum 1 weight 0.10000E+01 volume 0.22359E-01 ppm1 0.858 ppm2 7.922 CV 1
ASSI { 2304}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 65 and name HN ))
4.300 2.300 1.700 peak 2304 spectrum 1 weight 0.10000E+01 volume 0.11581E-02 ppm1 1.571 ppm2 7.867 CV 1
ASSI { 2305}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HB2 ))
6.000 4.500 0.000 peak 2305 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.557 ppm2 2.768 CV 1
OR { 2305}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HB3 ))
ASSI { 2307}
(( segid " " and resid 99 and name HB2 ))
(( segid " " and resid 100 and name HN ))
6.000 4.500 0.000 peak 2307 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.793 ppm2 8.888 CV 1
ASSI { 2309}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 59 and name HN ))
4.300 2.300 1.700 peak 2309 spectrum 1 weight 0.10000E+01 volume 0.11498E-02 ppm1 0.855 ppm2 8.877 CV 1
ASSI { 2310}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 2310 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.355 ppm2 8.882 CV 1
ASSI { 2314}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 15 and name HD1%)
6.000 4.500 0.000 peak 2314 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.920 ppm2 0.411 CV 1
ASSI { 2315}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 15 and name HG2%)
6.000 4.500 0.000 peak 2315 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.920 ppm2 0.855 CV 1
ASSI { 2316}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HG12))
6.000 4.500 0.000 peak 2316 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.920 ppm2 1.272 CV 1
ASSI { 2317}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB ))
6.000 4.500 0.000 peak 2317 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.920 ppm2 1.555 CV 1
ASSI { 2318}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HG13))
6.000 4.500 0.000 peak 2318 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.920 ppm2 -0.561 CV 1
ASSI { 2319}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 15 and name HG13))
6.000 4.500 0.000 peak 2319 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.559 ppm2 -0.567 CV 1
ASSI { 2320}
(( segid " " and resid 15 and name HG12))
(( segid " " and resid 15 and name HG13))
6.000 4.500 0.000 peak 2320 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.267 ppm2 -0.565 CV 1
ASSI { 2321}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HG13))
6.000 4.500 0.000 peak 2321 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.857 ppm2 -0.566 CV 1
ASSI { 2322}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 15 and name HG13))
6.000 4.500 0.000 peak 2322 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.410 ppm2 -0.566 CV 1
ASSI { 2324}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 16 and name HN ))
6.000 4.500 0.000 peak 2324 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.406 ppm2 7.922 CV 1
ASSI { 2325}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 39 and name HN ))
6.000 4.500 0.000 peak 2325 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.800 ppm2 7.921 CV 1
ASSI { 2327}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 10 and name HN ))
3.500 1.500 1.500 peak 2327 spectrum 1 weight 0.10000E+01 volume 0.40208E-02 ppm1 3.350 ppm2 9.116 CV 1
ASSI { 2332}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 40 and name HN ))
4.000 2.000 2.000 peak 2332 spectrum 1 weight 0.10000E+01 volume 0.17448E-02 ppm1 0.761 ppm2 8.579 CV 1
ASSI { 2334}
(( segid " " and resid 71 and name HA ))
( segid " " and resid 71 and name HB% )
6.000 4.500 0.000 peak 2334 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.331 ppm2 1.384 CV 1
ASSI { 2335}
( segid " " and resid 71 and name HB% )
(( segid " " and resid 71 and name HN ))
6.000 4.500 0.000 peak 2335 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.377 ppm2 8.134 CV 1
ASSI { 2338}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB2 ))
6.000 4.500 0.000 peak 2338 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.257 ppm2 1.906 CV 1
ASSI { 2339}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB3 ))
6.000 4.500 0.000 peak 2339 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.254 ppm2 1.775 CV 1
ASSI { 2340}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HG3 ))
6.000 4.500 0.000 peak 2340 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.252 ppm2 1.640 CV 1
ASSI { 2341}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HG2 ))
6.000 4.500 0.000 peak 2341 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.543 ppm2 1.641 CV 1
OR { 2341}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HG3 ))
ASSI { 2342}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HB3 ))
6.000 4.500 0.000 peak 2342 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.539 ppm2 1.778 CV 1
ASSI { 2343}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HB2 ))
6.000 4.500 0.000 peak 2343 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.541 ppm2 1.906 CV 1
ASSI { 2346}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 62 and name HN ))
4.100 2.100 1.900 peak 2346 spectrum 1 weight 0.10000E+01 volume 0.14404E-02 ppm1 1.778 ppm2 8.833 CV 1
ASSI { 2349}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 62 and name HN ))
3.500 1.500 1.500 peak 2349 spectrum 1 weight 0.10000E+01 volume 0.37150E-02 ppm1 1.971 ppm2 8.833 CV 1
ASSI { 2351}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HN ))
2.800 2.800 3.200 peak 2351 spectrum 1 weight 0.10000E+01 volume 0.13392E-01 ppm1 7.751 ppm2 8.334 CV 1
ASSI { 2355}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 105 and name HN ))
6.000 4.500 0.000 peak 2355 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.384 ppm2 8.389 CV 1
ASSI { 2357}
(( segid " " and resid 107 and name HD3 ))
(( segid " " and resid 108 and name HN ))
6.000 4.500 0.000 peak 2357 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.910 ppm2 9.152 CV 1
OR { 2357}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 108 and name HN ))
ASSI { 2358}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 108 and name HN ))
6.000 4.500 0.000 peak 2358 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.596 ppm2 9.153 CV 1
ASSI { 2360}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HG ))
6.000 4.500 0.000 peak 2360 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.942 ppm2 1.655 CV 1
ASSI { 2361}
(( segid " " and resid 108 and name HA ))
( segid " " and resid 108 and name HD1%)
6.000 4.500 0.000 peak 2361 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.942 ppm2 0.962 CV 1
OR { 2361}
(( segid " " and resid 108 and name HA ))
( segid " " and resid 108 and name HD2%)
ASSI { 2363}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 33 and name HN ))
4.800 2.900 1.200 peak 2363 spectrum 1 weight 0.10000E+01 volume 0.55345E-03 ppm1 3.903 ppm2 6.962 CV 1
ASSI { 2364}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 45 and name HD1%)
6.000 4.500 0.000 peak 2364 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.509 ppm2 0.860 CV 1
ASSI { 2365}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 45 and name HG12))
6.000 4.500 0.000 peak 2365 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.164 ppm2 1.407 CV 1
ASSI { 2366}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 45 and name HG13))
6.000 4.500 0.000 peak 2366 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.162 ppm2 1.215 CV 1
ASSI { 2367}
(( segid " " and resid 45 and name HB ))
( segid " " and resid 45 and name HG2%)
6.000 4.500 0.000 peak 2367 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.164 ppm2 0.954 CV 1
ASSI { 2368}
(( segid " " and resid 45 and name HB ))
( segid " " and resid 45 and name HD1%)
6.000 4.500 0.000 peak 2368 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.164 ppm2 0.860 CV 1
ASSI { 2370}
(( segid " " and resid 113 and name HN ))
(( segid " " and resid 114 and name HN ))
3.800 1.800 1.800 peak 2370 spectrum 1 weight 0.10000E+01 volume 0.21571E-02 ppm1 7.558 ppm2 8.127 CV 1
ASSI { 2371}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 49 and name HN ))
3.500 1.600 1.600 peak 2371 spectrum 1 weight 0.10000E+01 volume 0.34950E-02 ppm1 0.314 ppm2 8.667 CV 1
ASSI { 2373}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HN ))
3.600 1.600 1.600 peak 2373 spectrum 1 weight 0.10000E+01 volume 0.30481E-02 ppm1 8.027 ppm2 9.959 CV 1
ASSI { 2377}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 48 and name HN ))
4.000 2.000 2.000 peak 2377 spectrum 1 weight 0.10000E+01 volume 0.17005E-02 ppm1 1.420 ppm2 7.756 CV 1
ASSI { 2380}
( segid " " and resid 113 and name HD% )
( segid " " and resid 113 and name HE% )
6.000 4.500 0.000 peak 2380 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.153 ppm2 7.202 CV 1
ASSI { 2381}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 57 and name HA ))
3.400 1.500 1.500 peak 2381 spectrum 1 weight 0.10000E+01 volume 0.41869E-02 ppm1 0.770 ppm2 6.170 CV 1
ASSI { 2383}
(( segid " " and resid 57 and name HG ))
(( segid " " and resid 57 and name HA ))
6.000 4.500 0.000 peak 2383 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.621 ppm2 6.171 CV 1
ASSI { 2385}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 57 and name HA ))
6.000 4.500 0.000 peak 2385 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.635 ppm2 6.171 CV 1
OR { 2385}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 50 and name HE% )
ASSI { 2389}
(( segid " " and resid 110 and name HB3 ))
(( segid " " and resid 110 and name HD22))
6.000 4.500 0.000 peak 2389 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.436 ppm2 6.509 CV 1
ASSI { 2392}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 90 and name HD3 ))
2.700 0.900 0.900 peak 2392 spectrum 1 weight 0.10000E+01 volume 0.16659E-01 ppm1 4.618 ppm2 3.732 CV 1
ASSI { 2393}
(( segid " " and resid 12 and name HA2 ))
(( segid " " and resid 11 and name HN ))
3.800 1.800 1.800 peak 2393 spectrum 1 weight 0.10000E+01 volume 0.23868E-02 ppm1 3.876 ppm2 8.086 CV 1
ASSI { 2397}
( segid " " and resid 66 and name HE% )
(( segid " " and resid 66 and name HZ ))
6.000 4.500 0.000 peak 2397 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.179 ppm2 7.088 CV 1
ASSI { 2404}
(( segid " " and resid 119 and name HG13))
( segid " " and resid 119 and name HG2%)
6.000 4.500 0.000 peak 2404 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.115 ppm2 0.878 CV 1
ASSI { 2405}
(( segid " " and resid 119 and name HG13))
( segid " " and resid 119 and name HD1%)
6.000 4.500 0.000 peak 2405 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.115 ppm2 0.815 CV 1
ASSI { 2407}
(( segid " " and resid 119 and name HG12))
( segid " " and resid 119 and name HD1%)
6.000 4.500 0.000 peak 2407 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.386 ppm2 0.820 CV 1
ASSI { 2408}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HD1 ))
6.000 4.500 0.000 peak 2408 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.491 ppm2 6.954 CV 1
ASSI { 2412}
(( segid " " and resid 28 and name HZ3 ))
(( segid " " and resid 28 and name HZ2 ))
6.000 4.500 0.000 peak 2412 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.891 ppm2 7.125 CV 1
ASSI { 2414}
(( segid " " and resid 28 and name HZ2 ))
(( segid " " and resid 28 and name HD1 ))
6.000 4.500 0.000 peak 2414 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.120 ppm2 6.954 CV 1
ASSI { 2415}
(( segid " " and resid 28 and name HE3 ))
(( segid " " and resid 28 and name HD1 ))
6.000 4.500 0.000 peak 2415 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.147 ppm2 6.954 CV 1
ASSI { 2418}
(( segid " " and resid 28 and name HZ2 ))
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 2418 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.119 ppm2 7.155 CV 1
ASSI { 2421}
(( segid " " and resid 28 and name HE3 ))
(( segid " " and resid 28 and name HZ3 ))
6.000 4.500 0.000 peak 2421 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.146 ppm2 6.902 CV 1
ASSI { 2425}
(( segid " " and resid 27 and name HB2 ))
( segid " " and resid 27 and name HD% )
6.000 4.500 0.000 peak 2425 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.702 ppm2 6.378 CV 1
OR { 2425}
(( segid " " and resid 27 and name HB3 ))
( segid " " and resid 27 and name HD% )
ASSI { 2427}
(( segid " " and resid 119 and name HG12))
( segid " " and resid 119 and name HG2%)
6.000 4.500 0.000 peak 2427 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.380 ppm2 0.876 CV 1
ASSI { 2429}
(( segid " " and resid 119 and name HG12))
(( segid " " and resid 119 and name HG13))
6.000 4.500 0.000 peak 2429 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.381 ppm2 1.112 CV 1
ASSI { 2434}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 20 and name HD1%)
6.000 4.500 0.000 peak 2434 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.079 ppm2 0.990 CV 1
ASSI { 2436}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 20 and name HD2%)
6.000 4.500 0.000 peak 2436 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.784 ppm2 0.767 CV 1
ASSI { 2438}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name HG ))
6.000 4.500 0.000 peak 2438 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.786 ppm2 1.664 CV 1
ASSI { 2439}
(( segid " " and resid 20 and name HG ))
( segid " " and resid 20 and name HD1%)
6.000 4.500 0.000 peak 2439 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.659 ppm2 0.990 CV 1
ASSI { 2440}
(( segid " " and resid 20 and name HG ))
( segid " " and resid 20 and name HD2%)
6.000 4.500 0.000 peak 2440 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.657 ppm2 0.766 CV 1
ASSI { 2447}
(( segid " " and resid 34 and name HD2 ))
(( segid " " and resid 34 and name HB2 ))
6.000 4.500 0.000 peak 2447 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.695 ppm2 1.424 CV 1
OR { 2447}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 34 and name HB2 ))
ASSI { 2448}
(( segid " " and resid 34 and name HD2 ))
(( segid " " and resid 34 and name HB3 ))
6.000 4.500 0.000 peak 2448 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.693 ppm2 1.265 CV 1
OR { 2448}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 34 and name HB3 ))
ASSI { 2449}
(( segid " " and resid 34 and name HD2 ))
(( segid " " and resid 34 and name HG2 ))
6.000 4.500 0.000 peak 2449 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.693 ppm2 1.107 CV 1
OR { 2449}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 34 and name HG2 ))
ASSI { 2450}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 34 and name HG3 ))
6.000 4.500 0.000 peak 2450 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.693 ppm2 1.071 CV 1
OR { 2450}
(( segid " " and resid 34 and name HD2 ))
(( segid " " and resid 34 and name HG3 ))
ASSI { 2451}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HG3 ))
6.000 4.500 0.000 peak 2451 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.423 ppm2 1.072 CV 1
ASSI { 2452}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HG2 ))
6.000 4.500 0.000 peak 2452 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.423 ppm2 1.109 CV 1
ASSI { 2453}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HB3 ))
6.000 4.500 0.000 peak 2453 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.423 ppm2 1.265 CV 1
ASSI { 2454}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HG2 ))
6.000 4.500 0.000 peak 2454 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.264 ppm2 1.108 CV 1
ASSI { 2455}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HG3 ))
6.000 4.500 0.000 peak 2455 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.265 ppm2 1.070 CV 1
ASSI { 2456}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 16 and name HB% )
6.000 4.500 0.000 peak 2456 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.280 ppm2 1.214 CV 1
ASSI { 2457}
( segid " " and resid 16 and name HB% )
(( segid " " and resid 16 and name HN ))
6.000 4.500 0.000 peak 2457 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.220 ppm2 7.922 CV 1
ASSI { 2458}
(( segid " " and resid 31 and name HD3 ))
(( segid " " and resid 31 and name HB2 ))
6.000 4.500 0.000 peak 2458 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.100 ppm2 1.906 CV 1
ASSI { 2459}
(( segid " " and resid 31 and name HD3 ))
(( segid " " and resid 31 and name HB3 ))
6.000 4.500 0.000 peak 2459 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.102 ppm2 1.777 CV 1
ASSI { 2460}
(( segid " " and resid 31 and name HD3 ))
(( segid " " and resid 31 and name HG3 ))
6.000 4.500 0.000 peak 2460 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.102 ppm2 1.640 CV 1
OR { 2460}
(( segid " " and resid 31 and name HD3 ))
(( segid " " and resid 31 and name HG2 ))
ASSI { 2462}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 39 and name HE21))
6.000 4.500 0.000 peak 2462 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.175 ppm2 7.138 CV 1
ASSI { 2470}
(( segid " " and resid 110 and name HB3 ))
(( segid " " and resid 18 and name HG3 ))
2.700 0.900 0.900 peak 2470 spectrum 1 weight 0.10000E+01 volume 0.16866E-01 ppm1 2.440 ppm2 0.769 CV 1
OR { 2470}
(( segid " " and resid 6 and name HE3 ))
( segid " " and resid 20 and name HD2%)
OR { 2470}
(( segid " " and resid 6 and name HE2 ))
( segid " " and resid 20 and name HD2%)
ASSI { 2486}
( segid " " and resid 42 and name HD1%)
( segid " " and resid 42 and name HD2%)
6.000 4.500 0.000 peak 2486 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.759 ppm2 0.418 CV 1
ASSI { 2487}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 67 and name HN ))
3.600 1.600 1.600 peak 2487 spectrum 1 weight 0.10000E+01 volume 0.31671E-02 ppm1 7.001 ppm2 7.969 CV 1
ASSI { 2488}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HG2 ))
6.000 4.500 0.000 peak 2488 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.433 ppm2 1.013 CV 1
OR { 2488}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HG3 ))
ASSI { 2489}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HG3 ))
6.000 4.500 0.000 peak 2489 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.196 ppm2 1.013 CV 1
OR { 2489}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HG2 ))
ASSI { 2490}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 59 and name HG3 ))
6.000 4.500 0.000 peak 2490 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.189 ppm2 1.354 CV 1
OR { 2490}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HG3 ))
ASSI { 2491}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HB3 ))
6.000 4.500 0.000 peak 2491 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.456 ppm2 3.280 CV 1
ASSI { 2492}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 97 and name HN ))
6.000 4.500 0.000 peak 2492 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.302 ppm2 8.403 CV 1
ASSI { 2493}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 97 and name HN ))
6.000 4.500 0.000 peak 2493 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.877 ppm2 8.403 CV 1
ASSI { 2494}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 97 and name HN ))
6.000 4.500 0.000 peak 2494 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.950 ppm2 8.404 CV 1
ASSI { 2496}
(( segid " " and resid 97 and name HB3 ))
( segid " " and resid 97 and name HD% )
6.000 4.500 0.000 peak 2496 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.130 ppm2 7.277 CV 1
OR { 2496}
(( segid " " and resid 97 and name HB2 ))
( segid " " and resid 97 and name HD% )
ASSI { 2497}
( segid " " and resid 97 and name HD% )
(( segid " " and resid 97 and name HN ))
6.000 4.500 0.000 peak 2497 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.270 ppm2 8.407 CV 1
ASSI { 2500}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 93 and name HN ))
6.000 4.500 0.000 peak 2500 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.279 ppm2 8.392 CV 1
ASSI { 2503}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 35 and name HN ))
3.200 1.300 1.300 peak 2503 spectrum 1 weight 0.10000E+01 volume 0.64214E-02 ppm1 7.923 ppm2 8.352 CV 1
ASSI { 2504}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 2504 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.404 ppm2 8.369 CV 1
ASSI { 2505}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HG12))
6.000 4.500 0.000 peak 2505 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.379 ppm2 1.714 CV 1
OR { 2505}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HG13))
ASSI { 2506}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 63 and name HG12))
6.000 4.500 0.000 peak 2506 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.873 ppm2 1.714 CV 1
OR { 2506}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 63 and name HG13))
ASSI { 2507}
(( segid " " and resid 63 and name HG12))
( segid " " and resid 63 and name HD1%)
6.000 4.500 0.000 peak 2507 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.713 ppm2 0.824 CV 1
OR { 2507}
(( segid " " and resid 63 and name HG13))
( segid " " and resid 63 and name HD1%)
ASSI { 2508}
(( segid " " and resid 63 and name HG13))
( segid " " and resid 63 and name HG2%)
6.000 4.500 0.000 peak 2508 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.715 ppm2 1.208 CV 1
ASSI { 2509}
(( segid " " and resid 63 and name HG12))
(( segid " " and resid 64 and name HN ))
4.100 2.100 1.900 peak 2509 spectrum 1 weight 0.10000E+01 volume 0.15178E-02 ppm1 1.714 ppm2 7.835 CV 1
OR { 2509}
(( segid " " and resid 63 and name HG13))
(( segid " " and resid 64 and name HN ))
ASSI { 2510}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 111 and name HN ))
6.000 4.500 0.000 peak 2510 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.136 ppm2 7.819 CV 1
ASSI { 2512}
( segid " " and resid 111 and name HG2%)
(( segid " " and resid 111 and name HN ))
6.000 4.500 0.000 peak 2512 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.168 ppm2 7.820 CV 1
ASSI { 2519}
(( segid " " and resid 117 and name HB3 ))
(( segid " " and resid 117 and name HN ))
6.000 4.500 0.000 peak 2519 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.707 ppm2 8.109 CV 1
ASSI { 2520}
(( segid " " and resid 117 and name HA ))
(( segid " " and resid 118 and name HN ))
6.000 4.500 0.000 peak 2520 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.683 ppm2 8.295 CV 1
ASSI { 2521}
(( segid " " and resid 117 and name HB2 ))
(( segid " " and resid 117 and name HB3 ))
6.000 4.500 0.000 peak 2521 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.810 ppm2 2.708 CV 1
ASSI { 2522}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 74 and name HN ))
6.000 4.500 0.000 peak 2522 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.887 ppm2 8.323 CV 1
ASSI { 2523}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HN ))
6.000 4.500 0.000 peak 2523 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.934 ppm2 8.324 CV 1
ASSI { 2527}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HN ))
6.000 4.500 0.000 peak 2527 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.483 ppm2 8.323 CV 1
ASSI { 2528}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HB2 ))
6.000 4.500 0.000 peak 2528 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.482 ppm2 3.933 CV 1
ASSI { 2529}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HB3 ))
6.000 4.500 0.000 peak 2529 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.482 ppm2 3.886 CV 1
ASSI { 2533}
( segid " " and resid 57 and name HD1%)
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 2533 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.163 ppm2 8.328 CV 1
OR { 2533}
( segid " " and resid 57 and name HD2%)
(( segid " " and resid 56 and name HN ))
ASSI { 2536}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 72 and name HN ))
6.000 4.500 0.000 peak 2536 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.329 ppm2 8.459 CV 1
ASSI { 2537}
(( segid " " and resid 111 and name HA ))
( segid " " and resid 111 and name HG2%)
6.000 4.500 0.000 peak 2537 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.132 ppm2 1.179 CV 1
ASSI { 2540}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 79 and name HN ))
6.000 4.500 0.000 peak 2540 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.463 ppm2 8.491 CV 1
ASSI { 2541}
(( segid " " and resid 79 and name HA2 ))
(( segid " " and resid 79 and name HN ))
6.000 4.500 0.000 peak 2541 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.008 ppm2 8.491 CV 1
OR { 2541}
(( segid " " and resid 79 and name HA1 ))
(( segid " " and resid 79 and name HN ))
ASSI { 2542}
(( segid " " and resid 57 and name HG ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 2542 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.620 ppm2 8.933 CV 1
ASSI { 2543}
(( segid " " and resid 57 and name HG ))
( segid " " and resid 57 and name HD1%)
6.000 4.500 0.000 peak 2543 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.619 ppm2 1.163 CV 1
OR { 2543}
(( segid " " and resid 57 and name HG ))
( segid " " and resid 57 and name HD2%)
ASSI { 2544}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HG ))
6.000 4.500 0.000 peak 2544 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.974 ppm2 1.624 CV 1
ASSI { 2546}
(( segid " " and resid 102 and name HG3 ))
(( segid " " and resid 102 and name HN ))
6.000 4.500 0.000 peak 2546 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.484 ppm2 7.323 CV 1
ASSI { 2548}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HG2 ))
6.000 4.500 0.000 peak 2548 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.567 ppm2 1.755 CV 1
ASSI { 2549}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HG3 ))
6.000 4.500 0.000 peak 2549 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.567 ppm2 1.484 CV 1
ASSI { 2552}
(( segid " " and resid 102 and name HG3 ))
(( segid " " and resid 103 and name HN ))
3.800 1.800 1.800 peak 2552 spectrum 1 weight 0.10000E+01 volume 0.24767E-02 ppm1 1.486 ppm2 8.951 CV 1
ASSI { 2556}
(( segid " " and resid 67 and name HA2 ))
(( segid " " and resid 66 and name HN ))
3.900 1.900 1.900 peak 2556 spectrum 1 weight 0.10000E+01 volume 0.18624E-02 ppm1 3.747 ppm2 8.105 CV 1
ASSI { 2559}
(( segid " " and resid 82 and name HA1 ))
(( segid " " and resid 82 and name HN ))
6.000 4.500 0.000 peak 2559 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.011 ppm2 8.220 CV 1
ASSI { 2560}
(( segid " " and resid 82 and name HA2 ))
(( segid " " and resid 82 and name HN ))
6.000 4.500 0.000 peak 2560 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.924 ppm2 8.220 CV 1
ASSI { 2561}
(( segid " " and resid 82 and name HA1 ))
(( segid " " and resid 83 and name HN ))
6.000 4.500 0.000 peak 2561 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.011 ppm2 8.301 CV 1
ASSI { 2562}
(( segid " " and resid 82 and name HA2 ))
(( segid " " and resid 83 and name HN ))
6.000 4.500 0.000 peak 2562 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.924 ppm2 8.302 CV 1
ASSI { 2569}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 8 and name HB3 ))
6.000 4.500 0.000 peak 2569 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.356 ppm2 2.253 CV 1
ASSI { 2573}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 7 and name HG2 ))
4.200 2.200 1.800 peak 2573 spectrum 1 weight 0.10000E+01 volume 0.13435E-02 ppm1 2.237 ppm2 1.276 CV 1
OR { 2573}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 2577}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HB2 ))
6.000 4.500 0.000 peak 2577 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.345 ppm2 3.170 CV 1
ASSI { 2578}
(( segid " " and resid 12 and name HA1 ))
(( segid " " and resid 11 and name HN ))
6.000 4.500 0.000 peak 2578 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.255 ppm2 8.088 CV 1
ASSI { 2580}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HB3 ))
6.000 4.500 0.000 peak 2580 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.433 ppm2 1.195 CV 1
ASSI { 2582}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 15 and name HD1%)
6.000 4.500 0.000 peak 2582 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.857 ppm2 0.414 CV 1
ASSI { 2583}
(( segid " " and resid 15 and name HG12))
( segid " " and resid 15 and name HD1%)
6.000 4.500 0.000 peak 2583 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.267 ppm2 0.414 CV 1
ASSI { 2584}
(( segid " " and resid 15 and name HB ))
( segid " " and resid 15 and name HD1%)
6.000 4.500 0.000 peak 2584 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.559 ppm2 0.411 CV 1
ASSI { 2587}
(( segid " " and resid 106 and name HB ))
(( segid " " and resid 21 and name HG ))
3.600 1.700 1.700 peak 2587 spectrum 1 weight 0.10000E+01 volume 0.29402E-02 ppm1 4.257 ppm2 0.859 CV 1
OR { 2587}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 15 and name HG2%)
ASSI { 2590}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 18 and name HG3 ))
4.000 2.000 2.000 peak 2590 spectrum 1 weight 0.10000E+01 volume 0.16700E-02 ppm1 2.986 ppm2 0.763 CV 1
ASSI { 2592}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HB3 ))
6.000 4.500 0.000 peak 2592 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.892 ppm2 2.682 CV 1
ASSI { 2593}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 21 and name HA ))
3.000 1.100 1.100 peak 2593 spectrum 1 weight 0.10000E+01 volume 0.99995E-02 ppm1 5.011 ppm2 5.599 CV 1
ASSI { 2594}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 23 and name HB% )
3.900 1.900 1.900 peak 2594 spectrum 1 weight 0.10000E+01 volume 0.19025E-02 ppm1 3.770 ppm2 1.026 CV 1
ASSI { 2595}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HB2 ))
6.000 4.500 0.000 peak 2595 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.936 ppm2 2.774 CV 1
ASSI { 2601}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HB3 ))
6.000 4.500 0.000 peak 2601 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.916 ppm2 3.537 CV 1
ASSI { 2604}
(( segid " " and resid 34 and name HD2 ))
(( segid " " and resid 35 and name HN ))
6.000 4.500 0.000 peak 2604 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.698 ppm2 8.355 CV 1
OR { 2604}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 35 and name HN ))
ASSI { 2605}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HB3 ))
6.000 4.500 0.000 peak 2605 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.796 ppm2 3.563 CV 1
ASSI { 2606}
(( segid " " and resid 39 and name HG2 ))
(( segid " " and resid 39 and name HG3 ))
6.000 4.500 0.000 peak 2606 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.324 ppm2 2.177 CV 1
ASSI { 2607}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 41 and name HB2 ))
3.300 1.300 1.300 peak 2607 spectrum 1 weight 0.10000E+01 volume 0.56438E-02 ppm1 2.784 ppm2 2.167 CV 1
OR { 2607}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 41 and name HB2 ))
ASSI { 2608}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 51 and name HG2%)
6.000 4.500 0.000 peak 2608 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.062 ppm2 1.095 CV 1
ASSI { 2611}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HB3 ))
6.000 4.500 0.000 peak 2611 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.418 ppm2 2.091 CV 1
ASSI { 2618}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HG3 ))
6.000 4.500 0.000 peak 2618 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.470 ppm2 1.352 CV 1
ASSI { 2619}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HG3 ))
6.000 4.500 0.000 peak 2619 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.992 ppm2 1.355 CV 1
ASSI { 2620}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HG3 ))
6.000 4.500 0.000 peak 2620 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.796 ppm2 1.354 CV 1
ASSI { 2621}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HG3 ))
6.000 4.500 0.000 peak 2621 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.607 ppm2 1.356 CV 1
ASSI { 2622}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HG2 ))
6.000 4.500 0.000 peak 2622 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.992 ppm2 1.606 CV 1
ASSI { 2623}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HG2 ))
6.000 4.500 0.000 peak 2623 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.797 ppm2 1.607 CV 1
ASSI { 2624}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HB3 ))
6.000 4.500 0.000 peak 2624 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.992 ppm2 1.797 CV 1
ASSI { 2625}
(( segid " " and resid 79 and name HA2 ))
(( segid " " and resid 80 and name HN ))
6.000 4.500 0.000 peak 2625 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.008 ppm2 8.211 CV 1
OR { 2625}
(( segid " " and resid 79 and name HA1 ))
(( segid " " and resid 80 and name HN ))
ASSI { 2626}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HB3 ))
6.000 4.500 0.000 peak 2626 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.038 ppm2 1.897 CV 1
ASSI { 2629}
(( segid " " and resid 98 and name HA2 ))
(( segid " " and resid 99 and name HN ))
6.000 4.500 0.000 peak 2629 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.875 ppm2 7.858 CV 1
ASSI { 2630}
(( segid " " and resid 98 and name HA1 ))
(( segid " " and resid 99 and name HN ))
6.000 4.500 0.000 peak 2630 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.304 ppm2 7.858 CV 1
ASSI { 2631}
(( segid " " and resid 98 and name HA1 ))
(( segid " " and resid 98 and name HA2 ))
6.000 4.500 0.000 peak 2631 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.304 ppm2 3.874 CV 1
ASSI { 2639}
( segid " " and resid 105 and name HG2%)
( segid " " and resid 105 and name HD1%)
6.000 4.500 0.000 peak 2639 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.665 ppm2 0.319 CV 1
ASSI { 2640}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 105 and name HG13))
6.000 4.500 0.000 peak 2640 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.665 ppm2 0.414 CV 1
ASSI { 2641}
(( segid " " and resid 105 and name HG13))
( segid " " and resid 105 and name HD1%)
6.000 4.500 0.000 peak 2641 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.415 ppm2 0.319 CV 1
OR { 2641}
(( segid " " and resid 105 and name HG12))
( segid " " and resid 105 and name HD1%)
ASSI { 2642}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 107 and name HB3 ))
6.000 4.500 0.000 peak 2642 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.848 ppm2 1.637 CV 1
ASSI { 2645}
(( segid " " and resid 107 and name HB3 ))
(( segid " " and resid 107 and name HG3 ))
6.000 4.500 0.000 peak 2645 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.637 ppm2 1.458 CV 1
ASSI { 2646}
(( segid " " and resid 107 and name HG2 ))
(( segid " " and resid 107 and name HG3 ))
6.000 4.500 0.000 peak 2646 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.592 ppm2 1.459 CV 1
ASSI { 2647}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 28 and name HE1 ))
3.500 1.500 1.500 peak 2647 spectrum 1 weight 0.10000E+01 volume 0.38742E-02 ppm1 0.232 ppm2 9.579 CV 1
ASSI { 2649}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 28 and name HE1 ))
3.400 1.500 1.500 peak 2649 spectrum 1 weight 0.10000E+01 volume 0.43155E-02 ppm1 -0.821 ppm2 9.576 CV 1
ASSI { 2657}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 57 and name HN ))
3.500 1.500 1.500 peak 2657 spectrum 1 weight 0.10000E+01 volume 0.37081E-02 ppm1 5.418 ppm2 9.566 CV 1
ASSI { 2660}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 28 and name HE1 ))
2.700 0.900 0.900 peak 2660 spectrum 1 weight 0.10000E+01 volume 0.17531E-01 ppm1 8.963 ppm2 9.576 CV 1
ASSI { 2662}
(( segid " " and resid 104 and name HA ))
( segid " " and resid 104 and name HD2%)
6.000 4.500 0.000 peak 2662 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.384 ppm2 0.852 CV 1
ASSI { 2664}
(( segid " " and resid 104 and name HB2 ))
( segid " " and resid 104 and name HD1%)
6.000 4.500 0.000 peak 2664 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.655 ppm2 0.904 CV 1
ASSI { 2665}
(( segid " " and resid 104 and name HB2 ))
( segid " " and resid 104 and name HD2%)
6.000 4.500 0.000 peak 2665 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.655 ppm2 0.852 CV 1
ASSI { 2667}
(( segid " " and resid 104 and name HB3 ))
( segid " " and resid 104 and name HD2%)
6.000 4.500 0.000 peak 2667 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.603 ppm2 0.852 CV 1
ASSI { 2668}
(( segid " " and resid 104 and name HB3 ))
( segid " " and resid 104 and name HD1%)
6.000 4.500 0.000 peak 2668 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.603 ppm2 0.904 CV 1
ASSI { 2676}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 108 and name HN ))
3.800 3.800 2.200 peak 2676 spectrum 1 weight 0.10000E+01 volume 0.21585E-02 ppm1 8.637 ppm2 9.152 CV 1
ASSI { 2677}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 2677 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.181 ppm2 9.134 CV 1
ASSI { 2678}
(( segid " " and resid 28 and name HZ3 ))
(( segid " " and resid 10 and name HN ))
4.700 2.700 1.300 peak 2678 spectrum 1 weight 0.10000E+01 volume 0.68075E-03 ppm1 6.893 ppm2 9.116 CV 1
ASSI { 2679}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 106 and name HN ))
3.800 1.800 1.800 peak 2679 spectrum 1 weight 0.10000E+01 volume 0.21612E-02 ppm1 2.680 ppm2 9.064 CV 1
ASSI { 2681}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 106 and name HN ))
3.200 1.300 1.300 peak 2681 spectrum 1 weight 0.10000E+01 volume 0.69375E-02 ppm1 5.594 ppm2 9.060 CV 1
OR { 2681}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 106 and name HN ))
ASSI { 2684}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 58 and name HN ))
3.700 1.700 1.700 peak 2684 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 0.404 ppm2 8.934 CV 1
ASSI { 2685}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 58 and name HN ))
4.100 2.100 1.900 peak 2685 spectrum 1 weight 0.10000E+01 volume 0.14902E-02 ppm1 0.604 ppm2 8.934 CV 1
ASSI { 2686}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 107 and name HN ))
3.900 1.900 1.900 peak 2686 spectrum 1 weight 0.10000E+01 volume 0.19551E-02 ppm1 0.679 ppm2 8.935 CV 1
ASSI { 2687}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 107 and name HN ))
4.100 2.100 1.900 peak 2687 spectrum 1 weight 0.10000E+01 volume 0.14597E-02 ppm1 0.856 ppm2 8.934 CV 1
ASSI { 2688}
( segid " " and resid 108 and name HD1%)
(( segid " " and resid 107 and name HN ))
3.600 1.600 1.600 peak 2688 spectrum 1 weight 0.10000E+01 volume 0.30938E-02 ppm1 0.957 ppm2 8.930 CV 1
OR { 2688}
( segid " " and resid 108 and name HD2%)
(( segid " " and resid 107 and name HN ))
ASSI { 2689}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 58 and name HN ))
3.300 1.300 1.300 peak 2689 spectrum 1 weight 0.10000E+01 volume 0.57753E-02 ppm1 2.533 ppm2 8.932 CV 1
ASSI { 2692}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 103 and name HN ))
3.300 1.300 1.300 peak 2692 spectrum 1 weight 0.10000E+01 volume 0.56853E-02 ppm1 5.054 ppm2 8.952 CV 1
ASSI { 2693}
( segid " " and resid 50 and name HD% )
(( segid " " and resid 59 and name HN ))
3.300 1.400 1.400 peak 2693 spectrum 1 weight 0.10000E+01 volume 0.49368E-02 ppm1 6.448 ppm2 8.879 CV 1
ASSI { 2695}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 103 and name HN ))
3.000 3.000 3.000 peak 2695 spectrum 1 weight 0.10000E+01 volume 0.92039E-02 ppm1 8.664 ppm2 8.951 CV 1
ASSI { 2697}
(( segid " " and resid 105 and name HG12))
(( segid " " and resid 49 and name HN ))
3.500 1.500 1.500 peak 2697 spectrum 1 weight 0.10000E+01 volume 0.37372E-02 ppm1 0.413 ppm2 8.667 CV 1
ASSI { 2698}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 27 and name HN ))
3.800 1.800 1.800 peak 2698 spectrum 1 weight 0.10000E+01 volume 0.24117E-02 ppm1 0.403 ppm2 8.577 CV 1
OR { 2698}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 40 and name HN ))
ASSI { 2699}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 41 and name HN ))
3.900 1.900 1.900 peak 2699 spectrum 1 weight 0.10000E+01 volume 0.19744E-02 ppm1 0.957 ppm2 8.719 CV 1
ASSI { 2700}
(( segid " " and resid 57 and name HG ))
(( segid " " and resid 62 and name HN ))
4.500 2.600 1.500 peak 2700 spectrum 1 weight 0.10000E+01 volume 0.78590E-03 ppm1 1.619 ppm2 8.833 CV 1
ASSI { 2704}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 18 and name HN ))
3.900 1.900 1.900 peak 2704 spectrum 1 weight 0.10000E+01 volume 0.18983E-02 ppm1 3.299 ppm2 8.644 CV 1
ASSI { 2706}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 9 and name HN ))
3.300 1.400 1.400 peak 2706 spectrum 1 weight 0.10000E+01 volume 0.51803E-02 ppm1 3.488 ppm2 8.746 CV 1
ASSI { 2707}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 9 and name HN ))
4.100 2.100 1.900 peak 2707 spectrum 1 weight 0.10000E+01 volume 0.15663E-02 ppm1 3.572 ppm2 8.746 CV 1
ASSI { 2708}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 41 and name HN ))
3.000 1.100 1.100 peak 2708 spectrum 1 weight 0.10000E+01 volume 0.10409E-01 ppm1 8.576 ppm2 8.722 CV 1
ASSI { 2709}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 41 and name HN ))
6.000 4.500 0.000 peak 2709 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 8.374 ppm2 8.722 CV 1
ASSI { 2710}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 49 and name HN ))
3.300 1.400 1.400 peak 2710 spectrum 1 weight 0.10000E+01 volume 0.49520E-02 ppm1 8.376 ppm2 8.668 CV 1
ASSI { 2720}
( segid " " and resid 97 and name HD% )
(( segid " " and resid 98 and name HN ))
3.300 1.300 1.300 peak 2720 spectrum 1 weight 0.10000E+01 volume 0.56646E-02 ppm1 7.268 ppm2 8.500 CV 1
ASSI { 2725}
( segid " " and resid 104 and name HD2%)
(( segid " " and resid 51 and name HN ))
4.000 2.000 2.000 peak 2725 spectrum 1 weight 0.10000E+01 volume 0.17240E-02 ppm1 0.855 ppm2 8.565 CV 1
ASSI { 2728}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HN ))
3.000 1.100 1.100 peak 2728 spectrum 1 weight 0.10000E+01 volume 0.10100E-01 ppm1 8.207 ppm2 8.500 CV 1
ASSI { 2731}
( segid " " and resid 57 and name HD1%)
(( segid " " and resid 38 and name HN ))
4.200 2.200 1.800 peak 2731 spectrum 1 weight 0.10000E+01 volume 0.12951E-02 ppm1 1.151 ppm2 8.287 CV 1
OR { 2731}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 38 and name HN ))
OR { 2731}
( segid " " and resid 57 and name HD2%)
(( segid " " and resid 38 and name HN ))
ASSI { 2732}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 118 and name HN ))
4.600 2.700 1.400 peak 2732 spectrum 1 weight 0.10000E+01 volume 0.70150E-03 ppm1 1.410 ppm2 8.295 CV 1
OR { 2732}
(( segid " " and resid 45 and name HG12))
(( segid " " and resid 83 and name HN ))
ASSI { 2733}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 105 and name HN ))
4.500 2.600 1.500 peak 2733 spectrum 1 weight 0.10000E+01 volume 0.79005E-03 ppm1 3.571 ppm2 8.386 CV 1
OR { 2733}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 105 and name HN ))
ASSI { 2736}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 105 and name HN ))
2.900 1.100 1.100 peak 2736 spectrum 1 weight 0.10000E+01 volume 0.10567E-01 ppm1 5.052 ppm2 8.390 CV 1
ASSI { 2738}
(( segid " " and resid 117 and name HN ))
(( segid " " and resid 118 and name HN ))
4.100 2.100 1.900 peak 2738 spectrum 1 weight 0.10000E+01 volume 0.15026E-02 ppm1 8.108 ppm2 8.290 CV 1
ASSI { 2740}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HN ))
6.000 4.500 0.000 peak 2740 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 8.202 ppm2 8.419 CV 1
ASSI { 2742}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HN ))
2.600 0.900 0.900 peak 2742 spectrum 1 weight 0.10000E+01 volume 0.20824E-01 ppm1 7.959 ppm2 8.102 CV 1
ASSI { 2744}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 42 and name HN ))
3.500 1.600 1.600 peak 2744 spectrum 1 weight 0.10000E+01 volume 0.34757E-02 ppm1 7.550 ppm2 7.947 CV 1
ASSI { 2748}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
4.000 2.000 2.000 peak 2748 spectrum 1 weight 0.10000E+01 volume 0.16313E-02 ppm1 6.663 ppm2 7.921 CV 1
ASSI { 2750}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 34 and name HN ))
3.300 1.400 1.400 peak 2750 spectrum 1 weight 0.10000E+01 volume 0.52979E-02 ppm1 6.978 ppm2 7.791 CV 1
ASSI { 2754}
( segid " " and resid 84 and name HG2%)
(( segid " " and resid 83 and name HN ))
4.100 2.100 1.900 peak 2754 spectrum 1 weight 0.10000E+01 volume 0.15289E-02 ppm1 0.911 ppm2 8.304 CV 1
OR { 2754}
( segid " " and resid 84 and name HG1%)
(( segid " " and resid 83 and name HN ))
ASSI { 2755}
( segid " " and resid 119 and name HG2%)
(( segid " " and resid 121 and name HN ))
4.200 2.200 1.800 peak 2755 spectrum 1 weight 0.10000E+01 volume 0.12536E-02 ppm1 0.883 ppm2 8.214 CV 1
ASSI { 2756}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 7 and name HN ))
4.100 2.100 1.900 peak 2756 spectrum 1 weight 0.10000E+01 volume 0.13905E-02 ppm1 1.004 ppm2 8.373 CV 1
OR { 2756}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 7 and name HN ))
ASSI { 2759}
(( segid " " and resid 86 and name HB ))
(( segid " " and resid 83 and name HN ))
4.500 2.500 1.500 peak 2759 spectrum 1 weight 0.10000E+01 volume 0.84816E-03 ppm1 2.043 ppm2 8.304 CV 1
OR { 2759}
(( segid " " and resid 87 and name HB ))
(( segid " " and resid 83 and name HN ))
ASSI { 2766}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 2766 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.086 ppm2 8.370 CV 1
OR { 2766}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HN ))
ASSI { 2770}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 11 and name HN ))
4.100 2.100 1.900 peak 2770 spectrum 1 weight 0.10000E+01 volume 0.13767E-02 ppm1 2.243 ppm2 8.086 CV 1
ASSI { 2775}
(( segid " " and resid 5 and name HE3 ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 2775 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.527 ppm2 7.737 CV 1
ASSI { 2780}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 111 and name HN ))
4.000 2.000 2.000 peak 2780 spectrum 1 weight 0.10000E+01 volume 0.16617E-02 ppm1 4.633 ppm2 7.816 CV 1
ASSI { 2781}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 19 and name HN ))
6.000 4.500 0.000 peak 2781 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.435 ppm2 7.871 CV 1
ASSI { 2784}
(( segid " " and resid 43 and name HA1 ))
(( segid " " and resid 46 and name HN ))
3.700 1.700 1.700 peak 2784 spectrum 1 weight 0.10000E+01 volume 0.26261E-02 ppm1 4.028 ppm2 7.641 CV 1
ASSI { 2787}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 42 and name HN ))
4.000 2.000 2.000 peak 2787 spectrum 1 weight 0.10000E+01 volume 0.17544E-02 ppm1 2.824 ppm2 7.939 CV 1
OR { 2787}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 42 and name HN ))
ASSI { 2788}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 52 and name HN ))
3.700 1.700 1.700 peak 2788 spectrum 1 weight 0.10000E+01 volume 0.28613E-02 ppm1 2.387 ppm2 7.817 CV 1
ASSI { 2789}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 2789 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.028 ppm2 7.945 CV 1
ASSI { 2797}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 34 and name HN ))
3.300 1.400 1.400 peak 2797 spectrum 1 weight 0.10000E+01 volume 0.51374E-02 ppm1 0.602 ppm2 7.795 CV 1
ASSI { 2798}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 34 and name HN ))
3.600 3.600 2.400 peak 2798 spectrum 1 weight 0.10000E+01 volume 0.31159E-02 ppm1 0.403 ppm2 7.791 CV 1
ASSI { 2802}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 5 and name HE3 ))
3.700 1.700 1.700 peak 2802 spectrum 1 weight 0.10000E+01 volume 0.25528E-02 ppm1 1.209 ppm2 7.531 CV 1
ASSI { 2805}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 28 and name HE3 ))
3.300 1.400 1.400 peak 2805 spectrum 1 weight 0.10000E+01 volume 0.50060E-02 ppm1 -0.817 ppm2 7.157 CV 1
ASSI { 2806}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 28 and name HZ2 ))
3.200 3.200 2.800 peak 2806 spectrum 1 weight 0.10000E+01 volume 0.59939E-02 ppm1 -0.818 ppm2 7.125 CV 1
ASSI { 2808}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 28 and name HZ3 ))
3.400 3.400 2.600 peak 2808 spectrum 1 weight 0.10000E+01 volume 0.47611E-02 ppm1 -0.818 ppm2 6.903 CV 1
ASSI { 2809}
(( segid " " and resid 15 and name HG13))
(( segid " " and resid 7 and name HE ))
4.100 2.100 1.900 peak 2809 spectrum 1 weight 0.10000E+01 volume 0.14099E-02 ppm1 -0.575 ppm2 7.264 CV 1
ASSI { 2810}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 28 and name HZ2 ))
4.200 2.300 1.800 peak 2810 spectrum 1 weight 0.10000E+01 volume 0.11858E-02 ppm1 -0.002 ppm2 7.125 CV 1
ASSI { 2811}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 5 and name HE3 ))
3.500 1.500 1.500 peak 2811 spectrum 1 weight 0.10000E+01 volume 0.40402E-02 ppm1 1.015 ppm2 7.528 CV 1
OR { 2811}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 5 and name HE3 ))
ASSI { 2814}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 32 and name HN ))
6.000 4.500 0.000 peak 2814 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.754 ppm2 7.604 CV 1
ASSI { 2816}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HD1 ))
2.500 0.800 0.800 peak 2816 spectrum 1 weight 0.10000E+01 volume 0.28115E-01 ppm1 5.595 ppm2 6.954 CV 1
OR { 2816}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 28 and name HD1 ))
ASSI { 2817}
( segid " " and resid 62 and name HE% )
( segid " " and resid 66 and name HD% )
3.500 1.600 1.600 peak 2817 spectrum 1 weight 0.10000E+01 volume 0.35656E-02 ppm1 6.409 ppm2 7.007 CV 1
ASSI { 2818}
( segid " " and resid 62 and name HD% )
( segid " " and resid 66 and name HD% )
3.000 1.100 1.100 peak 2818 spectrum 1 weight 0.10000E+01 volume 0.10261E-01 ppm1 6.520 ppm2 7.007 CV 1
ASSI { 2819}
( segid " " and resid 62 and name HE% )
( segid " " and resid 97 and name HD% )
3.100 1.200 1.200 peak 2819 spectrum 1 weight 0.10000E+01 volume 0.77290E-02 ppm1 6.409 ppm2 7.277 CV 1
ASSI { 2820}
( segid " " and resid 62 and name HD% )
( segid " " and resid 97 and name HD% )
4.600 2.600 1.400 peak 2820 spectrum 1 weight 0.10000E+01 volume 0.77622E-03 ppm1 6.511 ppm2 7.277 CV 1
ASSI { 2821}
( segid " " and resid 62 and name HD% )
( segid " " and resid 66 and name HE% )
4.100 2.100 1.900 peak 2821 spectrum 1 weight 0.10000E+01 volume 0.15137E-02 ppm1 6.514 ppm2 7.166 CV 1
ASSI { 2830}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 5 and name HD1 ))
3.600 1.600 1.600 peak 2830 spectrum 1 weight 0.10000E+01 volume 0.31893E-02 ppm1 4.345 ppm2 7.201 CV 1
ASSI { 2831}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 66 and name HZ ))
6.000 4.500 0.000 peak 2831 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.283 ppm2 7.095 CV 1
ASSI { 2836}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 66 and name HD% )
2.600 0.900 0.900 peak 2836 spectrum 1 weight 0.10000E+01 volume 0.21308E-01 ppm1 4.132 ppm2 7.005 CV 1
ASSI { 2837}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 5 and name HZ3 ))
3.200 1.300 1.300 peak 2837 spectrum 1 weight 0.10000E+01 volume 0.59634E-02 ppm1 4.257 ppm2 6.963 CV 1
ASSI { 2839}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 28 and name HE3 ))
2.800 1.000 1.000 peak 2839 spectrum 1 weight 0.10000E+01 volume 0.14473E-01 ppm1 4.143 ppm2 7.154 CV 1
ASSI { 2840}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 66 and name HZ ))
6.000 4.500 0.000 peak 2840 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.821 ppm2 7.096 CV 1
OR { 2840}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 66 and name HZ ))
ASSI { 2842}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 28 and name HE3 ))
3.700 1.700 1.700 peak 2842 spectrum 1 weight 0.10000E+01 volume 0.27424E-02 ppm1 3.925 ppm2 7.156 CV 1
ASSI { 2843}
(( segid " " and resid 13 and name HA2 ))
(( segid " " and resid 7 and name HE ))
3.000 3.000 3.000 peak 2843 spectrum 1 weight 0.10000E+01 volume 0.10300E-01 ppm1 3.873 ppm2 7.266 CV 1
ASSI { 2844}
(( segid " " and resid 67 and name HA1 ))
( segid " " and resid 97 and name HD% )
3.200 3.200 2.800 peak 2844 spectrum 1 weight 0.10000E+01 volume 0.67037E-02 ppm1 3.953 ppm2 7.276 CV 1
OR { 2844}
(( segid " " and resid 69 and name HB2 ))
( segid " " and resid 97 and name HD% )
ASSI { 2845}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 5 and name HD1 ))
4.000 2.000 2.000 peak 2845 spectrum 1 weight 0.10000E+01 volume 0.17724E-02 ppm1 3.676 ppm2 7.201 CV 1
OR { 2845}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 5 and name HD1 ))
ASSI { 2847}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 2847 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.829 ppm2 7.159 CV 1
OR { 2847}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 66 and name HE% )
ASSI { 2849}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 28 and name HE3 ))
3.300 1.300 1.300 peak 2849 spectrum 1 weight 0.10000E+01 volume 0.56078E-02 ppm1 3.269 ppm2 7.155 CV 1
ASSI { 2850}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 2850 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.467 ppm2 7.157 CV 1
ASSI { 2852}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 28 and name HD1 ))
4.200 2.200 1.800 peak 2852 spectrum 1 weight 0.10000E+01 volume 0.13255E-02 ppm1 2.686 ppm2 6.954 CV 1
ASSI { 2853}
(( segid " " and resid 52 and name HE2 ))
( segid " " and resid 66 and name HD% )
3.300 1.400 1.400 peak 2853 spectrum 1 weight 0.10000E+01 volume 0.52993E-02 ppm1 2.572 ppm2 7.007 CV 1
OR { 2853}
(( segid " " and resid 52 and name HE3 ))
( segid " " and resid 66 and name HD% )
ASSI { 2857}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 7 and name HE ))
3.500 3.500 2.500 peak 2857 spectrum 1 weight 0.10000E+01 volume 0.41191E-02 ppm1 2.247 ppm2 7.265 CV 1
ASSI { 2858}
( segid " " and resid 55 and name HE% )
( segid " " and resid 66 and name HE% )
3.000 1.100 1.100 peak 2858 spectrum 1 weight 0.10000E+01 volume 0.92039E-02 ppm1 2.225 ppm2 7.158 CV 1
ASSI { 2861}
( segid " " and resid 55 and name HE% )
( segid " " and resid 66 and name HD% )
4.000 2.000 2.000 peak 2861 spectrum 1 weight 0.10000E+01 volume 0.16119E-02 ppm1 2.225 ppm2 7.007 CV 1
ASSI { 2871}
( segid " " and resid 21 and name HD1%)
( segid " " and resid 22 and name HD% )
6.000 4.500 0.000 peak 2871 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.648 ppm2 7.226 CV 1
ASSI { 2872}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 66 and name HE% )
2.700 0.900 0.900 peak 2872 spectrum 1 weight 0.10000E+01 volume 0.18236E-01 ppm1 1.596 ppm2 7.160 CV 1
ASSI { 2873}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 66 and name HD% )
3.900 1.900 1.900 peak 2873 spectrum 1 weight 0.10000E+01 volume 0.19136E-02 ppm1 1.604 ppm2 7.009 CV 1
ASSI { 2874}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 5 and name HZ3 ))
3.200 1.300 1.300 peak 2874 spectrum 1 weight 0.10000E+01 volume 0.62678E-02 ppm1 1.440 ppm2 6.962 CV 1
ASSI { 2876}
( segid " " and resid 116 and name HB% )
( segid " " and resid 19 and name HE% )
4.000 2.000 2.000 peak 2876 spectrum 1 weight 0.10000E+01 volume 0.18070E-02 ppm1 1.369 ppm2 7.292 CV 1
OR { 2876}
( segid " " and resid 115 and name HB% )
( segid " " and resid 19 and name HE% )
ASSI { 2878}
( segid " " and resid 63 and name HG2%)
( segid " " and resid 97 and name HD% )
3.900 1.900 1.900 peak 2878 spectrum 1 weight 0.10000E+01 volume 0.18582E-02 ppm1 1.220 ppm2 7.278 CV 1
ASSI { 2881}
( segid " " and resid 57 and name HD2%)
( segid " " and resid 66 and name HE% )
2.200 0.600 0.600 peak 2881 spectrum 1 weight 0.10000E+01 volume 0.62111E-01 ppm1 1.172 ppm2 7.159 CV 1
ASSI { 2882}
( segid " " and resid 57 and name HD2%)
(( segid " " and resid 66 and name HZ ))
3.500 1.500 1.500 peak 2882 spectrum 1 weight 0.10000E+01 volume 0.38382E-02 ppm1 1.176 ppm2 7.099 CV 1
ASSI { 2884}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 5 and name HZ3 ))
2.900 1.100 1.100 peak 2884 spectrum 1 weight 0.10000E+01 volume 0.11360E-01 ppm1 1.210 ppm2 6.962 CV 1
ASSI { 2886}
(( segid " " and resid 52 and name HG2 ))
( segid " " and resid 66 and name HE% )
4.000 2.000 2.000 peak 2886 spectrum 1 weight 0.10000E+01 volume 0.18001E-02 ppm1 0.953 ppm2 7.156 CV 1
OR { 2886}
( segid " " and resid 108 and name HD2%)
( segid " " and resid 113 and name HD% )
OR { 2886}
( segid " " and resid 108 and name HD2%)
( segid " " and resid 19 and name HD% )
ASSI { 2888}
(( segid " " and resid 52 and name HG2 ))
( segid " " and resid 66 and name HD% )
4.400 2.400 1.600 peak 2888 spectrum 1 weight 0.10000E+01 volume 0.99898E-03 ppm1 0.948 ppm2 7.006 CV 1
ASSI { 2889}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 33 and name HN ))
3.900 1.900 1.900 peak 2889 spectrum 1 weight 0.10000E+01 volume 0.20796E-02 ppm1 0.940 ppm2 6.959 CV 1
OR { 2889}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 28 and name HD1 ))
ASSI { 2892}
( segid " " and resid 20 and name HD2%)
( segid " " and resid 22 and name HD% )
2.900 1.000 1.000 peak 2892 spectrum 1 weight 0.10000E+01 volume 0.12508E-01 ppm1 0.766 ppm2 7.226 CV 1
ASSI { 2896}
(( segid " " and resid 52 and name HG3 ))
(( segid " " and resid 66 and name HZ ))
3.600 3.600 2.400 peak 2896 spectrum 1 weight 0.10000E+01 volume 0.32073E-02 ppm1 0.487 ppm2 7.095 CV 1
ASSI { 2897}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 26 and name HN ))
4.000 2.000 2.000 peak 2897 spectrum 1 weight 0.10000E+01 volume 0.16604E-02 ppm1 0.232 ppm2 7.212 CV 1
ASSI { 2899}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 28 and name HZ2 ))
3.200 1.300 1.300 peak 2899 spectrum 1 weight 0.10000E+01 volume 0.59081E-02 ppm1 0.226 ppm2 7.125 CV 1
ASSI { 2900}
(( segid " " and resid 52 and name HG3 ))
( segid " " and resid 66 and name HD% )
3.700 1.700 1.700 peak 2900 spectrum 1 weight 0.10000E+01 volume 0.27174E-02 ppm1 0.491 ppm2 7.008 CV 1
ASSI { 2902}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 28 and name HH2 ))
6.000 4.500 0.000 peak 2902 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.600 ppm2 7.037 CV 1
ASSI { 2903}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 28 and name HH2 ))
2.500 0.800 0.800 peak 2903 spectrum 1 weight 0.10000E+01 volume 0.27119E-01 ppm1 0.782 ppm2 7.040 CV 1
ASSI { 2906}
(( segid " " and resid 21 and name HG ))
( segid " " and resid 22 and name HD% )
3.900 1.900 1.900 peak 2906 spectrum 1 weight 0.10000E+01 volume 0.19717E-02 ppm1 0.863 ppm2 7.225 CV 1
ASSI { 2908}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 66 and name HZ ))
3.400 3.400 2.600 peak 2908 spectrum 1 weight 0.10000E+01 volume 0.42131E-02 ppm1 0.694 ppm2 7.097 CV 1
ASSI { 2909}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 28 and name HZ2 ))
6.000 4.500 0.000 peak 2909 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.603 ppm2 7.123 CV 1
ASSI { 2911}
(( segid " " and resid 52 and name HD3 ))
( segid " " and resid 66 and name HD% )
4.000 2.000 2.000 peak 2911 spectrum 1 weight 0.10000E+01 volume 0.16465E-02 ppm1 0.825 ppm2 7.009 CV 1
ASSI { 2912}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 28 and name HZ3 ))
3.300 1.400 1.400 peak 2912 spectrum 1 weight 0.10000E+01 volume 0.50419E-02 ppm1 0.225 ppm2 6.903 CV 1
ASSI { 2915}
(( segid " " and resid 6 and name HG3 ))
( segid " " and resid 22 and name HE% )
3.700 1.700 1.700 peak 2915 spectrum 1 weight 0.10000E+01 volume 0.27714E-02 ppm1 0.592 ppm2 6.711 CV 1
OR { 2915}
(( segid " " and resid 6 and name HG2 ))
( segid " " and resid 22 and name HE% )
ASSI { 2916}
(( segid " " and resid 52 and name HG3 ))
( segid " " and resid 62 and name HE% )
3.400 1.400 1.400 peak 2916 spectrum 1 weight 0.10000E+01 volume 0.47749E-02 ppm1 0.482 ppm2 6.413 CV 1
ASSI { 2917}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 57 and name HA ))
3.700 1.700 1.700 peak 2917 spectrum 1 weight 0.10000E+01 volume 0.25583E-02 ppm1 0.406 ppm2 6.173 CV 1
ASSI { 2918}
(( segid " " and resid 52 and name HD3 ))
( segid " " and resid 62 and name HE% )
2.900 1.000 1.000 peak 2918 spectrum 1 weight 0.10000E+01 volume 0.12871E-01 ppm1 0.831 ppm2 6.412 CV 1
ASSI { 2919}
( segid " " and resid 63 and name HD1%)
( segid " " and resid 50 and name HD% )
3.800 1.800 1.800 peak 2919 spectrum 1 weight 0.10000E+01 volume 0.24891E-02 ppm1 0.819 ppm2 6.455 CV 1
ASSI { 2923}
( segid " " and resid 20 and name HD2%)
( segid " " and resid 22 and name HE% )
3.800 1.800 1.800 peak 2923 spectrum 1 weight 0.10000E+01 volume 0.22055E-02 ppm1 0.776 ppm2 6.710 CV 1
ASSI { 2925}
(( segid " " and resid 52 and name HD3 ))
( segid " " and resid 62 and name HD% )
6.000 4.500 0.000 peak 2925 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.830 ppm2 6.521 CV 1
ASSI { 2927}
(( segid " " and resid 52 and name HG2 ))
( segid " " and resid 62 and name HE% )
6.000 4.500 0.000 peak 2927 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.945 ppm2 6.412 CV 1
ASSI { 2928}
( segid " " and resid 57 and name HD2%)
( segid " " and resid 62 and name HD% )
2.300 0.600 0.600 peak 2928 spectrum 1 weight 0.10000E+01 volume 0.49672E-01 ppm1 1.180 ppm2 6.523 CV 1
ASSI { 2929}
( segid " " and resid 57 and name HD2%)
( segid " " and resid 62 and name HE% )
3.100 1.200 1.200 peak 2929 spectrum 1 weight 0.10000E+01 volume 0.82962E-02 ppm1 1.177 ppm2 6.413 CV 1
ASSI { 2930}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 62 and name HE% )
2.900 2.900 3.100 peak 2930 spectrum 1 weight 0.10000E+01 volume 0.11645E-01 ppm1 1.259 ppm2 6.414 CV 1
ASSI { 2931}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 62 and name HD% )
6.000 4.500 0.000 peak 2931 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.259 ppm2 6.523 CV 1
ASSI { 2934}
(( segid " " and resid 59 and name HG3 ))
( segid " " and resid 50 and name HD% )
2.900 2.900 3.100 peak 2934 spectrum 1 weight 0.10000E+01 volume 0.12093E-01 ppm1 1.355 ppm2 6.455 CV 1
ASSI { 2935}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 62 and name HE% )
3.000 1.100 1.100 peak 2935 spectrum 1 weight 0.10000E+01 volume 0.98307E-02 ppm1 1.453 ppm2 6.413 CV 1
ASSI { 2936}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 62 and name HE% )
2.700 0.900 0.900 peak 2936 spectrum 1 weight 0.10000E+01 volume 0.16866E-01 ppm1 1.594 ppm2 6.412 CV 1
ASSI { 2937}
(( segid " " and resid 102 and name HB3 ))
( segid " " and resid 50 and name HD% )
2.800 2.800 3.200 peak 2937 spectrum 1 weight 0.10000E+01 volume 0.15275E-01 ppm1 1.566 ppm2 6.455 CV 1
ASSI { 2938}
(( segid " " and resid 102 and name HG3 ))
( segid " " and resid 50 and name HD% )
6.000 4.500 0.000 peak 2938 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.488 ppm2 6.455 CV 1
ASSI { 2939}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 62 and name HD% )
2.900 2.900 3.100 peak 2939 spectrum 1 weight 0.10000E+01 volume 0.12613E-01 ppm1 1.596 ppm2 6.521 CV 1
ASSI { 2940}
(( segid " " and resid 63 and name HG12))
( segid " " and resid 62 and name HD% )
3.100 1.200 1.200 peak 2940 spectrum 1 weight 0.10000E+01 volume 0.73249E-02 ppm1 1.716 ppm2 6.522 CV 1
OR { 2940}
(( segid " " and resid 63 and name HG13))
( segid " " and resid 62 and name HD% )
ASSI { 2941}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 62 and name HD% )
3.300 1.400 1.400 peak 2941 spectrum 1 weight 0.10000E+01 volume 0.54501E-02 ppm1 1.764 ppm2 6.521 CV 1
ASSI { 2942}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 50 and name HD% )
6.000 4.500 0.000 peak 2942 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.795 ppm2 6.456 CV 1
ASSI { 2943}
(( segid " " and resid 102 and name HB2 ))
( segid " " and resid 50 and name HD% )
3.400 3.400 2.600 peak 2943 spectrum 1 weight 0.10000E+01 volume 0.46352E-02 ppm1 1.891 ppm2 6.455 CV 1
ASSI { 2944}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 50 and name HD% )
2.900 2.900 3.100 peak 2944 spectrum 1 weight 0.10000E+01 volume 0.12947E-01 ppm1 1.985 ppm2 6.455 CV 1
ASSI { 2946}
(( segid " " and resid 50 and name HB3 ))
( segid " " and resid 62 and name HE% )
3.500 1.500 1.500 peak 2946 spectrum 1 weight 0.10000E+01 volume 0.41052E-02 ppm1 2.086 ppm2 6.413 CV 1
ASSI { 2947}
(( segid " " and resid 50 and name HB3 ))
( segid " " and resid 62 and name HD% )
2.700 0.900 0.900 peak 2947 spectrum 1 weight 0.10000E+01 volume 0.16299E-01 ppm1 2.087 ppm2 6.521 CV 1
ASSI { 2949}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 62 and name HD% )
3.700 1.700 1.700 peak 2949 spectrum 1 weight 0.10000E+01 volume 0.25846E-02 ppm1 1.885 ppm2 6.523 CV 1
OR { 2949}
(( segid " " and resid 64 and name HB3 ))
( segid " " and resid 62 and name HD% )
ASSI { 2952}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 28 and name HZ3 ))
3.100 3.100 2.900 peak 2952 spectrum 1 weight 0.10000E+01 volume 0.72571E-02 ppm1 3.466 ppm2 6.903 CV 1
ASSI { 2954}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 28 and name HZ3 ))
3.300 1.300 1.300 peak 2954 spectrum 1 weight 0.10000E+01 volume 0.56494E-02 ppm1 4.148 ppm2 6.904 CV 1
ASSI { 2955}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 28 and name HZ3 ))
2.600 0.900 0.900 peak 2955 spectrum 1 weight 0.10000E+01 volume 0.21253E-01 ppm1 4.304 ppm2 6.903 CV 1
ASSI { 2960}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 39 and name HE22))
4.000 4.000 2.000 peak 2960 spectrum 1 weight 0.10000E+01 volume 0.16604E-02 ppm1 4.280 ppm2 6.691 CV 1
ASSI { 2966}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 62 and name HD% )
3.100 1.200 1.200 peak 2966 spectrum 1 weight 0.10000E+01 volume 0.80721E-02 ppm1 3.383 ppm2 6.522 CV 1
ASSI { 2967}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 62 and name HD% )
3.400 1.500 1.500 peak 2967 spectrum 1 weight 0.10000E+01 volume 0.43197E-02 ppm1 3.474 ppm2 6.521 CV 1
ASSI { 2969}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 50 and name HD% )
2.700 0.900 0.900 peak 2969 spectrum 1 weight 0.10000E+01 volume 0.19578E-01 ppm1 3.475 ppm2 6.455 CV 1
ASSI { 2970}
(( segid " " and resid 102 and name HA ))
( segid " " and resid 50 and name HD% )
2.900 1.000 1.000 peak 2970 spectrum 1 weight 0.10000E+01 volume 0.12462E-01 ppm1 3.566 ppm2 6.456 CV 1
ASSI { 2977}
(( segid " " and resid 67 and name HA1 ))
( segid " " and resid 62 and name HE% )
3.300 1.400 1.400 peak 2977 spectrum 1 weight 0.10000E+01 volume 0.53560E-02 ppm1 3.974 ppm2 6.413 CV 1
OR { 2977}
(( segid " " and resid 51 and name HB ))
( segid " " and resid 62 and name HE% )
ASSI { 2978}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 27 and name HD% )
6.000 4.500 0.000 peak 2978 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.952 ppm2 6.379 CV 1
ASSI { 2982}
(( segid " " and resid 101 and name HA ))
( segid " " and resid 50 and name HD% )
4.000 2.000 2.000 peak 2982 spectrum 1 weight 0.10000E+01 volume 0.17226E-02 ppm1 4.557 ppm2 6.456 CV 1
ASSI { 2993}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 62 and name HE% )
4.000 2.000 2.000 peak 2993 spectrum 1 weight 0.10000E+01 volume 0.16756E-02 ppm1 1.965 ppm2 6.413 CV 1
ASSI { 2994}
(( segid " " and resid 50 and name HB2 ))
( segid " " and resid 62 and name HE% )
3.200 1.300 1.300 peak 2994 spectrum 1 weight 0.10000E+01 volume 0.67632E-02 ppm1 2.430 ppm2 6.413 CV 1
OR { 2994}
(( segid " " and resid 101 and name HB3 ))
( segid " " and resid 62 and name HE% )
ASSI { 2996}
(( segid " " and resid 52 and name HE2 ))
( segid " " and resid 62 and name HD% )
6.000 4.500 0.000 peak 2996 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.581 ppm2 6.523 CV 1
OR { 2996}
(( segid " " and resid 52 and name HE3 ))
( segid " " and resid 62 and name HD% )
ASSI { 3000}
(( segid " " and resid 15 and name HB ))
( segid " " and resid 27 and name HD% )
5.700 4.100 0.300 peak 3000 spectrum 1 weight 0.10000E+01 volume 0.20063E-03 ppm1 1.570 ppm2 6.378 CV 1
ASSI { 3003}
(( segid " " and resid 59 and name HG3 ))
( segid " " and resid 50 and name HE% )
6.000 4.500 0.000 peak 3003 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.362 ppm2 6.179 CV 1
ASSI { 3004}
(( segid " " and resid 102 and name HG3 ))
( segid " " and resid 50 and name HE% )
3.900 1.900 1.900 peak 3004 spectrum 1 weight 0.10000E+01 volume 0.18776E-02 ppm1 1.467 ppm2 6.180 CV 1
ASSI { 3005}
(( segid " " and resid 102 and name HB3 ))
( segid " " and resid 50 and name HE% )
6.000 4.500 0.000 peak 3005 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.568 ppm2 6.180 CV 1
ASSI { 3006}
(( segid " " and resid 56 and name HB ))
(( segid " " and resid 57 and name HA ))
6.000 4.500 0.000 peak 3006 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.762 ppm2 6.175 CV 1
ASSI { 3008}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 50 and name HE% )
6.000 4.500 0.000 peak 3008 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.991 ppm2 6.178 CV 1
ASSI { 3010}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 50 and name HE% )
3.100 1.200 1.200 peak 3010 spectrum 1 weight 0.10000E+01 volume 0.85176E-02 ppm1 2.677 ppm2 6.180 CV 1
ASSI { 3012}
(( segid " " and resid 101 and name HB2 ))
( segid " " and resid 50 and name HE% )
3.100 1.200 1.200 peak 3012 spectrum 1 weight 0.10000E+01 volume 0.73346E-02 ppm1 3.289 ppm2 6.181 CV 1
ASSI { 3014}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 57 and name HA ))
6.000 4.500 0.000 peak 3014 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.483 ppm2 6.171 CV 1
ASSI { 3015}
(( segid " " and resid 102 and name HA ))
( segid " " and resid 50 and name HE% )
3.000 1.100 1.100 peak 3015 spectrum 1 weight 0.10000E+01 volume 0.10511E-01 ppm1 3.564 ppm2 6.180 CV 1
ASSI { 3016}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 57 and name HA ))
2.800 1.000 1.000 peak 3016 spectrum 1 weight 0.10000E+01 volume 0.13091E-01 ppm1 4.481 ppm2 6.167 CV 1
ASSI { 3018}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 28 and name HA ))
3.100 1.200 1.200 peak 3018 spectrum 1 weight 0.10000E+01 volume 0.83530E-02 ppm1 0.404 ppm2 5.672 CV 1
ASSI { 3024}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 28 and name HA ))
3.000 1.100 1.100 peak 3024 spectrum 1 weight 0.10000E+01 volume 0.94405E-02 ppm1 4.358 ppm2 5.669 CV 1
ASSI { 3027}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 51 and name HA ))
3.500 1.600 1.600 peak 3027 spectrum 1 weight 0.10000E+01 volume 0.36044E-02 ppm1 4.636 ppm2 5.425 CV 1
ASSI { 3030}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 42 and name HD2%)
3.400 1.400 1.400 peak 3030 spectrum 1 weight 0.10000E+01 volume 0.46448E-02 ppm1 5.274 ppm2 0.414 CV 1
ASSI { 3032}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name HB3 ))
3.600 1.600 1.600 peak 3032 spectrum 1 weight 0.10000E+01 volume 0.34176E-02 ppm1 5.275 ppm2 2.826 CV 1
ASSI { 3033}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name HB2 ))
3.200 1.300 1.300 peak 3033 spectrum 1 weight 0.10000E+01 volume 0.60257E-02 ppm1 5.275 ppm2 3.432 CV 1
ASSI { 3036}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 105 and name HD1%)
2.900 1.100 1.100 peak 3036 spectrum 1 weight 0.10000E+01 volume 0.10582E-01 ppm1 5.053 ppm2 0.318 CV 1
ASSI { 3039}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 21 and name HG ))
2.500 0.800 0.800 peak 3039 spectrum 1 weight 0.10000E+01 volume 0.29416E-01 ppm1 5.007 ppm2 0.864 CV 1
OR { 3039}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 15 and name HG2%)
ASSI { 3040}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 15 and name HG2%)
3.400 1.400 1.400 peak 3040 spectrum 1 weight 0.10000E+01 volume 0.45729E-02 ppm1 4.865 ppm2 0.865 CV 1
ASSI { 3046}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 18 and name HG3 ))
3.600 1.700 1.700 peak 3046 spectrum 1 weight 0.10000E+01 volume 0.29610E-02 ppm1 5.384 ppm2 0.766 CV 1
ASSI { 3049}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 105 and name HG2%)
3.300 1.300 1.300 peak 3049 spectrum 1 weight 0.10000E+01 volume 0.58624E-02 ppm1 5.597 ppm2 0.671 CV 1
ASSI { 3050}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 20 and name HD1%)
3.200 1.300 1.300 peak 3050 spectrum 1 weight 0.10000E+01 volume 0.62332E-02 ppm1 5.597 ppm2 0.988 CV 1
OR { 3050}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 20 and name HD1%)
OR { 3050}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 20 and name HD1%)
ASSI { 3051}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 23 and name HB% )
3.700 1.700 1.700 peak 3051 spectrum 1 weight 0.10000E+01 volume 0.26649E-02 ppm1 5.599 ppm2 1.023 CV 1
ASSI { 3056}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 9 and name HB% )
3.800 1.800 1.800 peak 3056 spectrum 1 weight 0.10000E+01 volume 0.23826E-02 ppm1 5.664 ppm2 0.238 CV 1
ASSI { 3057}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 105 and name HB ))
3.200 1.300 1.300 peak 3057 spectrum 1 weight 0.10000E+01 volume 0.65432E-02 ppm1 5.054 ppm2 1.419 CV 1
ASSI { 3059}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 14 and name HA ))
3.300 1.400 1.400 peak 3059 spectrum 1 weight 0.10000E+01 volume 0.53809E-02 ppm1 4.562 ppm2 4.254 CV 1
ASSI { 3060}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB3 ))
6.000 4.500 0.000 peak 3060 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.912 ppm2 3.242 CV 1
ASSI { 3061}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 109 and name HB2 ))
3.200 1.300 1.300 peak 3061 spectrum 1 weight 0.10000E+01 volume 0.68144E-02 ppm1 4.946 ppm2 1.930 CV 1
OR { 3061}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 109 and name HB3 ))
ASSI { 3064}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 9 and name HB% )
3.400 1.500 1.500 peak 3064 spectrum 1 weight 0.10000E+01 volume 0.44152E-02 ppm1 4.575 ppm2 0.240 CV 1
ASSI { 3066}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 42 and name HD2%)
2.800 1.000 1.000 peak 3066 spectrum 1 weight 0.10000E+01 volume 0.14085E-01 ppm1 4.480 ppm2 0.417 CV 1
ASSI { 3067}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 15 and name HD1%)
4.200 2.200 1.800 peak 3067 spectrum 1 weight 0.10000E+01 volume 0.13200E-02 ppm1 4.564 ppm2 0.409 CV 1
ASSI { 3068}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 56 and name HG2%)
3.500 1.500 1.500 peak 3068 spectrum 1 weight 0.10000E+01 volume 0.39337E-02 ppm1 4.480 ppm2 0.601 CV 1
ASSI { 3069}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 105 and name HG2%)
3.300 1.300 1.300 peak 3069 spectrum 1 weight 0.10000E+01 volume 0.57448E-02 ppm1 4.500 ppm2 0.669 CV 1
ASSI { 3072}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 42 and name HD1%)
6.000 4.500 0.000 peak 3072 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.478 ppm2 0.765 CV 1
ASSI { 3073}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 63 and name HD1%)
3.300 1.300 1.300 peak 3073 spectrum 1 weight 0.10000E+01 volume 0.55829E-02 ppm1 4.353 ppm2 0.826 CV 1
ASSI { 3075}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 108 and name HD1%)
3.600 1.600 1.600 peak 3075 spectrum 1 weight 0.10000E+01 volume 0.32792E-02 ppm1 4.265 ppm2 0.960 CV 1
OR { 3075}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 21 and name HD2%)
OR { 3075}
(( segid " " and resid 112 and name HA ))
( segid " " and resid 108 and name HD2%)
OR { 3075}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 108 and name HD2%)
OR { 3075}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 21 and name HD2%)
ASSI { 3076}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 51 and name HG2%)
3.600 1.600 1.600 peak 3076 spectrum 1 weight 0.10000E+01 volume 0.34508E-02 ppm1 4.637 ppm2 1.094 CV 1
OR { 3076}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 42 and name HB3 ))
OR { 3076}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 51 and name HG2%)
ASSI { 3077}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 42 and name HB2 ))
3.700 1.700 1.700 peak 3077 spectrum 1 weight 0.10000E+01 volume 0.29167E-02 ppm1 4.483 ppm2 1.160 CV 1
ASSI { 3078}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 57 and name HD1%)
3.500 1.500 1.500 peak 3078 spectrum 1 weight 0.10000E+01 volume 0.37510E-02 ppm1 4.626 ppm2 1.164 CV 1
OR { 3078}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 57 and name HD2%)
OR { 3078}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 57 and name HD1%)
OR { 3078}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 57 and name HD2%)
ASSI { 3079}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HB3 ))
3.800 1.800 1.800 peak 3079 spectrum 1 weight 0.10000E+01 volume 0.23024E-02 ppm1 4.648 ppm2 1.441 CV 1
OR { 3079}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HB2 ))
ASSI { 3080}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 105 and name HB ))
6.000 4.500 0.000 peak 3080 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.513 ppm2 1.425 CV 1
ASSI { 3081}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HG12))
6.000 4.500 0.000 peak 3081 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.636 ppm2 1.624 CV 1
OR { 3081}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HG13))
ASSI { 3082}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 102 and name HG2 ))
3.300 3.300 2.700 peak 3082 spectrum 1 weight 0.10000E+01 volume 0.50350E-02 ppm1 4.573 ppm2 1.748 CV 1
ASSI { 3086}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 64 and name HB3 ))
3.100 1.200 1.200 peak 3086 spectrum 1 weight 0.10000E+01 volume 0.72834E-02 ppm1 4.734 ppm2 1.868 CV 1
ASSI { 3092}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HB3 ))
6.000 4.500 0.000 peak 3092 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.642 ppm2 3.298 CV 1
ASSI { 3099}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 18 and name HA ))
4.000 2.000 2.000 peak 3099 spectrum 1 weight 0.10000E+01 volume 0.16078E-02 ppm1 4.278 ppm2 3.577 CV 1
OR { 3099}
(( segid " " and resid 46 and name HA1 ))
(( segid " " and resid 48 and name HB3 ))
ASSI { 3103}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB3 ))
6.000 4.500 0.000 peak 3103 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.344 ppm2 3.682 CV 1
OR { 3103}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB2 ))
ASSI { 3104}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB3 ))
6.000 4.500 0.000 peak 3104 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.282 ppm2 3.827 CV 1
OR { 3104}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB2 ))
ASSI { 3107}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 32 and name HB2 ))
3.300 3.300 2.700 peak 3107 spectrum 1 weight 0.10000E+01 volume 0.49423E-02 ppm1 3.922 ppm2 3.460 CV 1
ASSI { 3108}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 63 and name HA ))
3.800 1.800 1.800 peak 3108 spectrum 1 weight 0.10000E+01 volume 0.24878E-02 ppm1 3.975 ppm2 3.389 CV 1
ASSI { 3109}
(( segid " " and resid 67 and name HA2 ))
(( segid " " and resid 63 and name HA ))
3.000 1.100 1.100 peak 3109 spectrum 1 weight 0.10000E+01 volume 0.94875E-02 ppm1 3.746 ppm2 3.390 CV 1
ASSI { 3110}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 35 and name HB2 ))
3.800 1.800 1.800 peak 3110 spectrum 1 weight 0.10000E+01 volume 0.23134E-02 ppm1 4.146 ppm2 3.436 CV 1
ASSI { 3111}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 59 and name HA ))
3.900 1.900 1.900 peak 3111 spectrum 1 weight 0.10000E+01 volume 0.18319E-02 ppm1 4.148 ppm2 3.472 CV 1
ASSI { 3113}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 32 and name HB3 ))
3.500 1.500 1.500 peak 3113 spectrum 1 weight 0.10000E+01 volume 0.41066E-02 ppm1 3.929 ppm2 3.278 CV 1
ASSI { 3115}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 61 and name HB3 ))
3.600 1.600 1.600 peak 3115 spectrum 1 weight 0.10000E+01 volume 0.31173E-02 ppm1 3.807 ppm2 2.544 CV 1
ASSI { 3116}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 55 and name HE% )
3.400 1.400 1.400 peak 3116 spectrum 1 weight 0.10000E+01 volume 0.45369E-02 ppm1 4.280 ppm2 2.235 CV 1
ASSI { 3117}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 55 and name HE% )
3.000 1.100 1.100 peak 3117 spectrum 1 weight 0.10000E+01 volume 0.93589E-02 ppm1 3.831 ppm2 2.235 CV 1
OR { 3117}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 55 and name HE% )
ASSI { 3118}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 63 and name HG12))
3.500 1.600 1.600 peak 3118 spectrum 1 weight 0.10000E+01 volume 0.34715E-02 ppm1 3.985 ppm2 1.715 CV 1
OR { 3118}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 63 and name HG13))
ASSI { 3120}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB2 ))
6.000 4.500 0.000 peak 3120 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.757 ppm2 2.093 CV 1
ASSI { 3123}
(( segid " " and resid 36 and name HB2 ))
( segid " " and resid 57 and name HD1%)
3.300 1.300 1.300 peak 3123 spectrum 1 weight 0.10000E+01 volume 0.58735E-02 ppm1 3.874 ppm2 1.160 CV 1
OR { 3123}
(( segid " " and resid 36 and name HB3 ))
( segid " " and resid 57 and name HD1%)
ASSI { 3129}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 42 and name HB3 ))
3.800 1.800 1.800 peak 3129 spectrum 1 weight 0.10000E+01 volume 0.23785E-02 ppm1 4.237 ppm2 1.083 CV 1
ASSI { 3130}
(( segid " " and resid 67 and name HA1 ))
( segid " " and resid 63 and name HD1%)
3.800 1.800 1.800 peak 3130 spectrum 1 weight 0.10000E+01 volume 0.24615E-02 ppm1 3.976 ppm2 0.824 CV 1
ASSI { 3132}
(( segid " " and resid 67 and name HA2 ))
( segid " " and resid 63 and name HD1%)
4.100 2.100 1.900 peak 3132 spectrum 1 weight 0.10000E+01 volume 0.14182E-02 ppm1 3.748 ppm2 0.830 CV 1
ASSI { 3134}
(( segid " " and resid 43 and name HA1 ))
( segid " " and resid 105 and name HG2%)
3.100 1.200 1.200 peak 3134 spectrum 1 weight 0.10000E+01 volume 0.79005E-02 ppm1 4.026 ppm2 0.671 CV 1
ASSI { 3135}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 65 and name HD1%)
4.000 2.000 2.000 peak 3135 spectrum 1 weight 0.10000E+01 volume 0.16368E-02 ppm1 4.126 ppm2 0.699 CV 1
ASSI { 3136}
(( segid " " and resid 43 and name HA1 ))
( segid " " and resid 105 and name HD1%)
2.800 1.000 1.000 peak 3136 spectrum 1 weight 0.10000E+01 volume 0.13067E-01 ppm1 4.027 ppm2 0.319 CV 1
ASSI { 3139}
(( segid " " and resid 28 and name HB2 ))
( segid " " and resid 33 and name HD2%)
3.400 1.400 1.400 peak 3139 spectrum 1 weight 0.10000E+01 volume 0.48856E-02 ppm1 3.493 ppm2 -0.819 CV 1
ASSI { 3140}
(( segid " " and resid 28 and name HB2 ))
( segid " " and resid 33 and name HD1%)
3.600 1.600 1.600 peak 3140 spectrum 1 weight 0.10000E+01 volume 0.34646E-02 ppm1 3.493 ppm2 0.006 CV 1
ASSI { 3142}
(( segid " " and resid 26 and name HB2 ))
( segid " " and resid 9 and name HB% )
2.400 0.700 0.700 peak 3142 spectrum 1 weight 0.10000E+01 volume 0.32294E-01 ppm1 3.571 ppm2 0.239 CV 1
ASSI { 3143}
(( segid " " and resid 26 and name HB3 ))
( segid " " and resid 9 and name HB% )
2.600 0.900 0.900 peak 3143 spectrum 1 weight 0.10000E+01 volume 0.20367E-01 ppm1 3.492 ppm2 0.240 CV 1
ASSI { 3144}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 105 and name HD1%)
3.200 1.300 1.300 peak 3144 spectrum 1 weight 0.10000E+01 volume 0.63315E-02 ppm1 3.495 ppm2 0.320 CV 1
ASSI { 3146}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 105 and name HD1%)
2.900 1.000 1.000 peak 3146 spectrum 1 weight 0.10000E+01 volume 0.12172E-01 ppm1 3.369 ppm2 0.320 CV 1
ASSI { 3147}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 105 and name HG12))
2.500 0.800 0.800 peak 3147 spectrum 1 weight 0.10000E+01 volume 0.29776E-01 ppm1 3.368 ppm2 0.413 CV 1
ASSI { 3148}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 105 and name HG12))
2.600 2.600 3.400 peak 3148 spectrum 1 weight 0.10000E+01 volume 0.24974E-01 ppm1 3.499 ppm2 0.414 CV 1
ASSI { 3150}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 56 and name HG2%)
3.400 1.400 1.400 peak 3150 spectrum 1 weight 0.10000E+01 volume 0.47030E-02 ppm1 3.372 ppm2 0.603 CV 1
ASSI { 3151}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 56 and name HG2%)
3.000 1.100 1.100 peak 3151 spectrum 1 weight 0.10000E+01 volume 0.90268E-02 ppm1 3.499 ppm2 0.601 CV 1
ASSI { 3152}
(( segid " " and resid 43 and name HA2 ))
( segid " " and resid 105 and name HG2%)
3.700 1.800 1.800 peak 3152 spectrum 1 weight 0.10000E+01 volume 0.25002E-02 ppm1 3.615 ppm2 0.671 CV 1
ASSI { 3153}
(( segid " " and resid 37 and name HB3 ))
( segid " " and resid 65 and name HD1%)
3.500 3.500 2.500 peak 3153 spectrum 1 weight 0.10000E+01 volume 0.39143E-02 ppm1 3.571 ppm2 0.698 CV 1
ASSI { 3155}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 33 and name HG ))
2.900 1.000 1.000 peak 3155 spectrum 1 weight 0.10000E+01 volume 0.12763E-01 ppm1 3.494 ppm2 0.860 CV 1
OR { 3155}
(( segid " " and resid 58 and name HB2 ))
( segid " " and resid 45 and name HD1%)
OR { 3155}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 104 and name HD2%)
OR { 3155}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 21 and name HG ))
ASSI { 3156}
(( segid " " and resid 35 and name HB2 ))
( segid " " and resid 42 and name HD1%)
3.200 1.300 1.300 peak 3156 spectrum 1 weight 0.10000E+01 volume 0.61862E-02 ppm1 3.424 ppm2 0.766 CV 1
ASSI { 3157}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 65 and name HD1%)
3.700 1.700 1.700 peak 3157 spectrum 1 weight 0.10000E+01 volume 0.28198E-02 ppm1 3.111 ppm2 0.700 CV 1
ASSI { 3160}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 57 and name HD1%)
2.600 0.900 0.900 peak 3160 spectrum 1 weight 0.10000E+01 volume 0.21612E-01 ppm1 3.111 ppm2 1.162 CV 1
OR { 3160}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 57 and name HD2%)
ASSI { 3163}
(( segid " " and resid 101 and name HB2 ))
(( segid " " and resid 102 and name HG2 ))
3.600 3.600 2.400 peak 3163 spectrum 1 weight 0.10000E+01 volume 0.31685E-02 ppm1 3.301 ppm2 1.756 CV 1
ASSI { 3166}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 102 and name HG3 ))
3.600 1.600 1.600 peak 3166 spectrum 1 weight 0.10000E+01 volume 0.33442E-02 ppm1 3.663 ppm2 1.488 CV 1
ASSI { 3167}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 102 and name HB3 ))
4.300 2.300 1.700 peak 3167 spectrum 1 weight 0.10000E+01 volume 0.11678E-02 ppm1 3.650 ppm2 1.558 CV 1
ASSI { 3168}
(( segid " " and resid 37 and name HB3 ))
( segid " " and resid 57 and name HD1%)
2.800 2.800 3.200 peak 3168 spectrum 1 weight 0.10000E+01 volume 0.15414E-01 ppm1 3.567 ppm2 1.159 CV 1
ASSI { 3171}
(( segid " " and resid 101 and name HB2 ))
(( segid " " and resid 101 and name HB3 ))
6.000 4.500 0.000 peak 3171 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.283 ppm2 2.451 CV 1
ASSI { 3172}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HB2 ))
6.000 4.500 0.000 peak 3172 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.296 ppm2 2.598 CV 1
ASSI { 3173}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 21 and name HB3 ))
3.700 1.700 1.700 peak 3173 spectrum 1 weight 0.10000E+01 volume 0.27424E-02 ppm1 3.483 ppm2 1.843 CV 1
ASSI { 3175}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 62 and name HB3 ))
3.800 1.800 1.800 peak 3175 spectrum 1 weight 0.10000E+01 volume 0.22968E-02 ppm1 3.469 ppm2 2.667 CV 1
ASSI { 3185}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HB3 ))
6.000 4.500 0.000 peak 3185 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.511 ppm2 3.378 CV 1
ASSI { 3186}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HB3 ))
6.000 4.500 0.000 peak 3186 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.435 ppm2 2.827 CV 1
ASSI { 3187}
(( segid " " and resid 121 and name HB2 ))
(( segid " " and resid 121 and name HB3 ))
1.800 0.400 0.400 peak 3187 spectrum 1 weight 0.10000E+01 volume 0.23951E+00 ppm1 2.703 ppm2 2.592 CV 1
ASSI { 3189}
(( segid " " and resid 113 and name HB2 ))
(( segid " " and resid 114 and name HB3 ))
4.100 2.100 1.900 peak 3189 spectrum 1 weight 0.10000E+01 volume 0.14833E-02 ppm1 2.989 ppm2 2.428 CV 1
OR { 3189}
(( segid " " and resid 113 and name HB3 ))
(( segid " " and resid 114 and name HB3 ))
ASSI { 3190}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 39 and name HB3 ))
3.900 1.900 1.900 peak 3190 spectrum 1 weight 0.10000E+01 volume 0.19551E-02 ppm1 2.809 ppm2 2.392 CV 1
ASSI { 3191}
(( segid " " and resid 55 and name HG3 ))
( segid " " and resid 55 and name HE% )
6.000 4.500 0.000 peak 3191 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.580 ppm2 2.235 CV 1
ASSI { 3194}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 63 and name HG12))
3.900 1.900 1.900 peak 3194 spectrum 1 weight 0.10000E+01 volume 0.21031E-02 ppm1 2.728 ppm2 1.716 CV 1
OR { 3194}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 63 and name HG13))
ASSI { 3211}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 42 and name HB2 ))
4.000 2.000 2.000 peak 3211 spectrum 1 weight 0.10000E+01 volume 0.17544E-02 ppm1 2.822 ppm2 1.162 CV 1
OR { 3211}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 42 and name HB2 ))
OR { 3211}
(( segid " " and resid 35 and name HB3 ))
( segid " " and resid 57 and name HD1%)
ASSI { 3212}
(( segid " " and resid 61 and name HB3 ))
( segid " " and resid 57 and name HD1%)
2.700 0.900 0.900 peak 3212 spectrum 1 weight 0.10000E+01 volume 0.17890E-01 ppm1 2.542 ppm2 1.160 CV 1
OR { 3212}
(( segid " " and resid 61 and name HB3 ))
( segid " " and resid 57 and name HD2%)
ASSI { 3216}
(( segid " " and resid 52 and name HE2 ))
(( segid " " and resid 52 and name HG2 ))
6.000 4.500 0.000 peak 3216 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.575 ppm2 0.953 CV 1
ASSI { 3218}
(( segid " " and resid 27 and name HB3 ))
( segid " " and resid 20 and name HD1%)
2.700 0.900 0.900 peak 3218 spectrum 1 weight 0.10000E+01 volume 0.17489E-01 ppm1 2.707 ppm2 0.988 CV 1
ASSI { 3219}
(( segid " " and resid 44 and name HB3 ))
( segid " " and resid 45 and name HG2%)
3.000 1.100 1.100 peak 3219 spectrum 1 weight 0.10000E+01 volume 0.91859E-02 ppm1 2.779 ppm2 0.954 CV 1
ASSI { 3220}
(( segid " " and resid 107 and name HD3 ))
( segid " " and resid 108 and name HD1%)
3.400 1.400 1.400 peak 3220 spectrum 1 weight 0.10000E+01 volume 0.44899E-02 ppm1 2.899 ppm2 0.953 CV 1
OR { 3220}
(( segid " " and resid 107 and name HD3 ))
( segid " " and resid 108 and name HD2%)
OR { 3220}
(( segid " " and resid 107 and name HD2 ))
( segid " " and resid 21 and name HD2%)
OR { 3220}
(( segid " " and resid 107 and name HD2 ))
( segid " " and resid 108 and name HD1%)
OR { 3220}
(( segid " " and resid 107 and name HD2 ))
( segid " " and resid 108 and name HD2%)
OR { 3220}
(( segid " " and resid 107 and name HD3 ))
( segid " " and resid 21 and name HD2%)
ASSI { 3221}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 14 and name HG2 ))
4.600 2.600 1.400 peak 3221 spectrum 1 weight 0.10000E+01 volume 0.76791E-03 ppm1 2.963 ppm2 1.015 CV 1
OR { 3221}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 14 and name HG3 ))
ASSI { 3226}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 15 and name HG2%)
2.900 1.100 1.100 peak 3226 spectrum 1 weight 0.10000E+01 volume 0.10769E-01 ppm1 2.582 ppm2 0.858 CV 1
ASSI { 3227}
(( segid " " and resid 61 and name HB3 ))
( segid " " and resid 65 and name HD1%)
3.300 1.400 1.400 peak 3227 spectrum 1 weight 0.10000E+01 volume 0.55041E-02 ppm1 2.533 ppm2 0.699 CV 1
ASSI { 3228}
(( segid " " and resid 62 and name HB2 ))
( segid " " and resid 63 and name HD1%)
3.800 1.800 1.800 peak 3228 spectrum 1 weight 0.10000E+01 volume 0.24850E-02 ppm1 2.707 ppm2 0.827 CV 1
OR { 3228}
(( segid " " and resid 120 and name HB2 ))
( segid " " and resid 119 and name HD1%)
OR { 3228}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 52 and name HD3 ))
ASSI { 3231}
(( segid " " and resid 27 and name HB3 ))
( segid " " and resid 20 and name HD2%)
3.500 1.500 1.500 peak 3231 spectrum 1 weight 0.10000E+01 volume 0.39613E-02 ppm1 2.707 ppm2 0.769 CV 1
OR { 3231}
(( segid " " and resid 27 and name HB2 ))
( segid " " and resid 20 and name HD2%)
ASSI { 3232}
(( segid " " and resid 27 and name HB2 ))
( segid " " and resid 15 and name HD1%)
2.400 0.700 0.700 peak 3232 spectrum 1 weight 0.10000E+01 volume 0.37496E-01 ppm1 2.711 ppm2 0.411 CV 1
OR { 3232}
(( segid " " and resid 27 and name HB3 ))
( segid " " and resid 15 and name HD1%)
ASSI { 3235}
(( segid " " and resid 28 and name HB3 ))
( segid " " and resid 33 and name HD1%)
3.500 1.600 1.600 peak 3235 spectrum 1 weight 0.10000E+01 volume 0.36140E-02 ppm1 2.573 ppm2 0.005 CV 1
ASSI { 3237}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 15 and name HG13))
3.800 1.800 1.800 peak 3237 spectrum 1 weight 0.10000E+01 volume 0.24532E-02 ppm1 2.253 ppm2 -0.569 CV 1
ASSI { 3239}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 33 and name HD1%)
3.400 1.500 1.500 peak 3239 spectrum 1 weight 0.10000E+01 volume 0.41371E-02 ppm1 1.840 ppm2 0.006 CV 1
ASSI { 3240}
(( segid " " and resid 56 and name HB ))
( segid " " and resid 42 and name HD2%)
3.000 3.000 3.000 peak 3240 spectrum 1 weight 0.10000E+01 volume 0.89590E-02 ppm1 1.749 ppm2 0.415 CV 1
OR { 3240}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 105 and name HG13))
OR { 3240}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 42 and name HD2%)
ASSI { 3241}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 15 and name HD1%)
3.100 1.200 1.200 peak 3241 spectrum 1 weight 0.10000E+01 volume 0.78604E-02 ppm1 2.075 ppm2 0.414 CV 1
ASSI { 3242}
(( segid " " and resid 8 and name HB3 ))
( segid " " and resid 15 and name HD1%)
2.900 1.000 1.000 peak 3242 spectrum 1 weight 0.10000E+01 volume 0.11963E-01 ppm1 2.252 ppm2 0.411 CV 1
ASSI { 3243}
( segid " " and resid 55 and name HE% )
( segid " " and resid 65 and name HD2%)
3.400 1.400 1.400 peak 3243 spectrum 1 weight 0.10000E+01 volume 0.47182E-02 ppm1 2.227 ppm2 0.625 CV 1
ASSI { 3244}
( segid " " and resid 55 and name HE% )
( segid " " and resid 65 and name HD1%)
2.800 2.800 3.200 peak 3244 spectrum 1 weight 0.10000E+01 volume 0.14583E-01 ppm1 2.227 ppm2 0.699 CV 1
ASSI { 3245}
(( segid " " and resid 64 and name HB2 ))
( segid " " and resid 65 and name HD1%)
6.000 4.500 0.000 peak 3245 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.945 ppm2 0.698 CV 1
OR { 3245}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 65 and name HD1%)
ASSI { 3246}
(( segid " " and resid 64 and name HB2 ))
( segid " " and resid 65 and name HD2%)
4.900 3.000 1.100 peak 3246 spectrum 1 weight 0.10000E+01 volume 0.49811E-03 ppm1 1.935 ppm2 0.626 CV 1
ASSI { 3247}
(( segid " " and resid 107 and name HB2 ))
( segid " " and resid 105 and name HG2%)
3.000 3.000 3.000 peak 3247 spectrum 1 weight 0.10000E+01 volume 0.88608E-02 ppm1 1.846 ppm2 0.672 CV 1
ASSI { 3248}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 18 and name HG3 ))
4.000 2.000 2.000 peak 3248 spectrum 1 weight 0.10000E+01 volume 0.16368E-02 ppm1 1.939 ppm2 0.766 CV 1
OR { 3248}
(( segid " " and resid 109 and name HB2 ))
(( segid " " and resid 18 and name HG3 ))
OR { 3248}
(( segid " " and resid 109 and name HB2 ))
( segid " " and resid 20 and name HD2%)
ASSI { 3251}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 15 and name HG2%)
3.300 1.300 1.300 peak 3251 spectrum 1 weight 0.10000E+01 volume 0.55290E-02 ppm1 2.078 ppm2 0.859 CV 1
ASSI { 3252}
(( segid " " and resid 86 and name HB ))
( segid " " and resid 86 and name HG1%)
6.000 4.500 0.000 peak 3252 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.028 ppm2 0.910 CV 1
OR { 3252}
(( segid " " and resid 86 and name HB ))
( segid " " and resid 86 and name HG2%)
ASSI { 3253}
(( segid " " and resid 24 and name HB3 ))
( segid " " and resid 23 and name HB% )
3.500 1.600 1.600 peak 3253 spectrum 1 weight 0.10000E+01 volume 0.34895E-02 ppm1 2.280 ppm2 1.029 CV 1
ASSI { 3255}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 34 and name HG3 ))
4.100 2.100 1.900 peak 3255 spectrum 1 weight 0.10000E+01 volume 0.14307E-02 ppm1 2.167 ppm2 1.065 CV 1
ASSI { 3256}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 23 and name HB% )
4.500 2.600 1.500 peak 3256 spectrum 1 weight 0.10000E+01 volume 0.78313E-03 ppm1 1.846 ppm2 1.027 CV 1
ASSI { 3257}
(( segid " " and resid 24 and name HB2 ))
( segid " " and resid 23 and name HB% )
3.700 1.700 1.700 peak 3257 spectrum 1 weight 0.10000E+01 volume 0.27133E-02 ppm1 2.083 ppm2 1.026 CV 1
ASSI { 3258}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 20 and name HD1%)
6.000 4.500 0.000 peak 3258 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.783 ppm2 0.990 CV 1
ASSI { 3261}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 31 and name HG2 ))
6.000 4.500 0.000 peak 3261 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.383 ppm2 1.631 CV 1
OR { 3261}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 31 and name HG3 ))
ASSI { 3262}
(( segid " " and resid 96 and name HG2 ))
(( segid " " and resid 96 and name HB3 ))
6.000 4.500 0.000 peak 3262 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.171 ppm2 1.878 CV 1
ASSI { 3263}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HG ))
6.000 4.500 0.000 peak 3263 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.074 ppm2 1.665 CV 1
ASSI { 3264}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HB3 ))
6.000 4.500 0.000 peak 3264 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.081 ppm2 1.787 CV 1
ASSI { 3266}
(( segid " " and resid 50 and name HB3 ))
( segid " " and resid 57 and name HD2%)
6.000 4.500 0.000 peak 3266 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.083 ppm2 1.173 CV 1
ASSI { 3271}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 34 and name HB3 ))
4.500 2.500 1.500 peak 3271 spectrum 1 weight 0.10000E+01 volume 0.83571E-03 ppm1 2.382 ppm2 1.264 CV 1
ASSI { 3273}
( segid " " and resid 55 and name HE% )
( segid " " and resid 57 and name HD1%)
2.800 1.000 1.000 peak 3273 spectrum 1 weight 0.10000E+01 volume 0.14099E-01 ppm1 2.226 ppm2 1.168 CV 1
OR { 3273}
( segid " " and resid 55 and name HE% )
( segid " " and resid 57 and name HD2%)
ASSI { 3276}
(( segid " " and resid 96 and name HG2 ))
(( segid " " and resid 96 and name HB2 ))
6.000 4.500 0.000 peak 3276 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.173 ppm2 1.951 CV 1
ASSI { 3279}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 107 and name HG3 ))
6.000 4.500 0.000 peak 3279 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.848 ppm2 1.458 CV 1
ASSI { 3280}
(( segid " " and resid 42 and name HG ))
( segid " " and resid 33 and name HD1%)
2.900 1.100 1.100 peak 3280 spectrum 1 weight 0.10000E+01 volume 0.11437E-01 ppm1 1.414 ppm2 0.003 CV 1
OR { 3280}
(( segid " " and resid 105 and name HB ))
( segid " " and resid 33 and name HD1%)
ASSI { 3281}
( segid " " and resid 21 and name HD1%)
( segid " " and resid 33 and name HD1%)
3.600 1.600 1.600 peak 3281 spectrum 1 weight 0.10000E+01 volume 0.30357E-02 ppm1 1.641 ppm2 0.003 CV 1
ASSI { 3283}
( segid " " and resid 23 and name HB% )
( segid " " and resid 33 and name HD1%)
2.500 0.800 0.800 peak 3283 spectrum 1 weight 0.10000E+01 volume 0.28946E-01 ppm1 1.017 ppm2 0.003 CV 1
ASSI { 3285}
( segid " " and resid 56 and name HD1%)
( segid " " and resid 33 and name HD1%)
6.000 4.500 0.000 peak 3285 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.793 ppm2 0.006 CV 1
ASSI { 3286}
( segid " " and resid 105 and name HG2%)
( segid " " and resid 33 and name HD1%)
2.600 2.600 3.400 peak 3286 spectrum 1 weight 0.10000E+01 volume 0.24974E-01 ppm1 0.664 ppm2 0.005 CV 1
ASSI { 3290}
( segid " " and resid 105 and name HD1%)
( segid " " and resid 33 and name HD1%)
2.400 2.400 3.600 peak 3290 spectrum 1 weight 0.10000E+01 volume 0.32654E-01 ppm1 0.312 ppm2 0.005 CV 1
ASSI { 3293}
(( segid " " and resid 105 and name HG13))
( segid " " and resid 33 and name HD2%)
3.600 1.600 1.600 peak 3293 spectrum 1 weight 0.10000E+01 volume 0.30371E-02 ppm1 0.320 ppm2 -0.814 CV 1
OR { 3293}
(( segid " " and resid 105 and name HG12))
( segid " " and resid 33 and name HD2%)
ASSI { 3298}
( segid " " and resid 23 and name HB% )
( segid " " and resid 33 and name HD2%)
3.000 1.200 1.200 peak 3298 spectrum 1 weight 0.10000E+01 volume 0.87321E-02 ppm1 1.021 ppm2 -0.814 CV 1
ASSI { 3300}
(( segid " " and resid 42 and name HG ))
( segid " " and resid 33 and name HD2%)
3.600 1.600 1.600 peak 3300 spectrum 1 weight 0.10000E+01 volume 0.30675E-02 ppm1 1.416 ppm2 -0.812 CV 1
OR { 3300}
(( segid " " and resid 105 and name HB ))
( segid " " and resid 33 and name HD2%)
ASSI { 3302}
(( segid " " and resid 34 and name HD2 ))
( segid " " and resid 33 and name HD2%)
3.100 3.100 2.900 peak 3302 spectrum 1 weight 0.10000E+01 volume 0.78230E-02 ppm1 1.708 ppm2 -0.814 CV 1
OR { 3302}
(( segid " " and resid 34 and name HD3 ))
( segid " " and resid 33 and name HD2%)
ASSI { 3305}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HB3 ))
6.000 4.500 0.000 peak 3305 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.906 ppm2 1.780 CV 1
ASSI { 3306}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HG3 ))
6.000 4.500 0.000 peak 3306 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.900 ppm2 1.640 CV 1
OR { 3306}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HG2 ))
ASSI { 3312}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 3312 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.747 ppm2 7.158 CV 1
ASSI { 3313}
(( segid " " and resid 33 and name HG ))
(( segid " " and resid 33 and name HB3 ))
6.000 4.500 0.000 peak 3313 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.862 ppm2 0.510 CV 1
ASSI { 3314}
(( segid " " and resid 59 and name HG3 ))
(( segid " " and resid 60 and name HN ))
6.000 4.500 0.000 peak 3314 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.354 ppm2 8.348 CV 1
ASSI { 3317}
(( segid " " and resid 41 and name HG2 ))
(( segid " " and resid 41 and name HB3 ))
6.000 4.500 0.000 peak 3317 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.488 ppm2 2.029 CV 1
ASSI { 3318}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 41 and name HB3 ))
6.000 4.500 0.000 peak 3318 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.284 ppm2 2.029 CV 1
ASSI { 3319}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HB3 ))
6.000 4.500 0.000 peak 3319 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.167 ppm2 2.029 CV 1
ASSI { 3330}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 28 and name HE1 ))
4.100 2.100 1.900 peak 3330 spectrum 1 weight 0.10000E+01 volume 0.15635E-02 ppm1 7.195 ppm2 9.577 CV 1
ASSI { 3339}
( segid " " and resid 63 and name HD1%)
(( segid " " and resid 67 and name HN ))
6.000 4.500 0.000 peak 3339 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.825 ppm2 7.967 CV 1
ASSI { 3342}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HE1 ))
6.000 4.500 0.000 peak 3342 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.488 ppm2 9.576 CV 1
ASSI { 3343}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 5 and name HD1 ))
3.900 1.900 1.900 peak 3343 spectrum 1 weight 0.10000E+01 volume 0.18513E-02 ppm1 1.448 ppm2 7.207 CV 1
OR { 3343}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 5 and name HD1 ))
OR { 3343}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 5 and name HD1 ))
OR { 3343}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 5 and name HD1 ))
ASSI { 3348}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 61 and name HN ))
3.000 1.100 1.100 peak 3348 spectrum 1 weight 0.10000E+01 volume 0.99068E-02 ppm1 8.938 ppm2 9.119 CV 1
ASSI { 3358}
(( segid " " and resid 55 and name HG3 ))
(( segid " " and resid 65 and name HG ))
6.000 4.500 0.000 peak 3358 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.568 ppm2 1.463 CV 1
OR { 3358}
(( segid " " and resid 52 and name HE2 ))
(( segid " " and resid 65 and name HG ))
OR { 3358}
(( segid " " and resid 52 and name HE3 ))
(( segid " " and resid 65 and name HG ))
ASSI { 3360}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 21 and name HB3 ))
3.400 1.400 1.400 peak 3360 spectrum 1 weight 0.10000E+01 volume 0.49008E-02 ppm1 2.566 ppm2 1.851 CV 1
ASSI { 3363}
( segid " " and resid 56 and name HG2%)
( segid " " and resid 42 and name HD2%)
2.800 1.000 1.000 peak 3363 spectrum 1 weight 0.10000E+01 volume 0.14514E-01 ppm1 0.601 ppm2 0.417 CV 1
OR { 3363}
(( segid " " and resid 6 and name HG3 ))
( segid " " and resid 15 and name HD1%)
ASSI { 3364}
( segid " " and resid 42 and name HD1%)
( segid " " and resid 105 and name HD1%)
3.500 1.600 1.600 peak 3364 spectrum 1 weight 0.10000E+01 volume 0.36362E-02 ppm1 0.770 ppm2 0.320 CV 1
ASSI { 3366}
(( segid " " and resid 33 and name HG ))
( segid " " and resid 105 and name HD1%)
3.400 1.400 1.400 peak 3366 spectrum 1 weight 0.10000E+01 volume 0.48607E-02 ppm1 0.851 ppm2 0.320 CV 1
OR { 3366}
(( segid " " and resid 21 and name HG ))
( segid " " and resid 105 and name HD1%)
OR { 3366}
( segid " " and resid 45 and name HD1%)
( segid " " and resid 105 and name HD1%)
ASSI { 3367}
( segid " " and resid 21 and name HD2%)
( segid " " and resid 105 and name HD1%)
3.600 1.600 1.600 peak 3367 spectrum 1 weight 0.10000E+01 volume 0.32252E-02 ppm1 0.934 ppm2 0.320 CV 1
ASSI { 3368}
( segid " " and resid 23 and name HB% )
( segid " " and resid 105 and name HD1%)
3.400 1.500 1.500 peak 3368 spectrum 1 weight 0.10000E+01 volume 0.41454E-02 ppm1 1.018 ppm2 0.322 CV 1
ASSI { 3369}
(( segid " " and resid 42 and name HB3 ))
( segid " " and resid 105 and name HD1%)
3.400 1.400 1.400 peak 3369 spectrum 1 weight 0.10000E+01 volume 0.47362E-02 ppm1 1.092 ppm2 0.317 CV 1
ASSI { 3373}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 15 and name HD1%)
2.600 2.600 3.400 peak 3373 spectrum 1 weight 0.10000E+01 volume 0.24421E-01 ppm1 0.987 ppm2 0.415 CV 1
ASSI { 3375}
(( segid " " and resid 42 and name HB3 ))
( segid " " and resid 42 and name HD2%)
6.000 4.500 0.000 peak 3375 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.090 ppm2 0.416 CV 1
ASSI { 3376}
(( segid " " and resid 6 and name HD2 ))
( segid " " and resid 15 and name HD1%)
3.400 1.400 1.400 peak 3376 spectrum 1 weight 0.10000E+01 volume 0.46822E-02 ppm1 1.196 ppm2 0.415 CV 1
OR { 3376}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 15 and name HD1%)
OR { 3376}
(( segid " " and resid 45 and name HG13))
( segid " " and resid 42 and name HD2%)
OR { 3376}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 105 and name HG13))
OR { 3376}
(( segid " " and resid 14 and name HB3 ))
( segid " " and resid 15 and name HD1%)
ASSI { 3386}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 3386 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.592 ppm2 0.492 CV 1
ASSI { 3390}
(( segid " " and resid 33 and name HG ))
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 3390 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.845 ppm2 7.160 CV 1
OR { 3390}
(( segid " " and resid 52 and name HD3 ))
( segid " " and resid 66 and name HE% )
ASSI { 3391}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 19 and name HD% )
2.700 0.900 0.900 peak 3391 spectrum 1 weight 0.10000E+01 volume 0.18776E-01 ppm1 5.387 ppm2 7.157 CV 1
ASSI { 3393}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 3393 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.858 ppm2 7.116 CV 1
ASSI { 3394}
(( segid " " and resid 50 and name HB3 ))
( segid " " and resid 50 and name HD% )
6.000 4.500 0.000 peak 3394 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.089 ppm2 6.454 CV 1
ASSI { 3395}
(( segid " " and resid 50 and name HB3 ))
( segid " " and resid 50 and name HE% )
6.000 4.500 0.000 peak 3395 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.090 ppm2 6.180 CV 1
ASSI { 3396}
(( segid " " and resid 50 and name HB2 ))
( segid " " and resid 50 and name HD% )
6.000 4.500 0.000 peak 3396 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.413 ppm2 6.455 CV 1
ASSI { 3397}
(( segid " " and resid 50 and name HB2 ))
( segid " " and resid 50 and name HE% )
6.000 4.500 0.000 peak 3397 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.411 ppm2 6.180 CV 1
ASSI { 3398}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 50 and name HD% )
6.000 4.500 0.000 peak 3398 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.060 ppm2 6.456 CV 1
ASSI { 3399}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 50 and name HE% )
6.000 4.500 0.000 peak 3399 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.063 ppm2 6.181 CV 1
ASSI { 3400}
( segid " " and resid 50 and name HE% )
( segid " " and resid 50 and name HD% )
6.000 4.500 0.000 peak 3400 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.176 ppm2 6.456 CV 1
ASSI { 3406}
(( segid " " and resid 109 and name HG2 ))
( segid " " and resid 19 and name HD% )
6.000 4.500 0.000 peak 3406 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.005 ppm2 7.160 CV 1
OR { 3406}
(( segid " " and resid 109 and name HG3 ))
( segid " " and resid 19 and name HD% )
ASSI { 3407}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 19 and name HD% )
2.900 2.900 3.100 peak 3407 spectrum 1 weight 0.10000E+01 volume 0.11115E-01 ppm1 3.572 ppm2 7.151 CV 1
ASSI { 3408}
( segid " " and resid 19 and name HD% )
(( segid " " and resid 20 and name HN ))
3.400 1.500 1.500 peak 3408 spectrum 1 weight 0.10000E+01 volume 0.43543E-02 ppm1 7.146 ppm2 9.282 CV 1
ASSI { 3409}
( segid " " and resid 19 and name HD% )
(( segid " " and resid 110 and name HN ))
3.700 1.700 1.700 peak 3409 spectrum 1 weight 0.10000E+01 volume 0.26759E-02 ppm1 7.147 ppm2 8.812 CV 1
ASSI { 3412}
(( segid " " and resid 109 and name HA ))
( segid " " and resid 19 and name HD% )
3.200 1.300 1.300 peak 3412 spectrum 1 weight 0.10000E+01 volume 0.63937E-02 ppm1 4.434 ppm2 7.158 CV 1
ASSI { 3414}
(( segid " " and resid 18 and name HG2 ))
( segid " " and resid 19 and name HE% )
3.900 1.900 1.900 peak 3414 spectrum 1 weight 0.10000E+01 volume 0.19814E-02 ppm1 1.059 ppm2 7.297 CV 1
ASSI { 3415}
(( segid " " and resid 18 and name HG2 ))
( segid " " and resid 19 and name HD% )
3.500 1.500 1.500 peak 3415 spectrum 1 weight 0.10000E+01 volume 0.38728E-02 ppm1 1.061 ppm2 7.158 CV 1
ASSI { 3416}
(( segid " " and resid 18 and name HG3 ))
( segid " " and resid 19 and name HE% )
3.600 1.600 1.600 peak 3416 spectrum 1 weight 0.10000E+01 volume 0.33525E-02 ppm1 0.763 ppm2 7.298 CV 1
ASSI { 3417}
(( segid " " and resid 18 and name HG3 ))
( segid " " and resid 19 and name HD% )
3.200 1.300 1.300 peak 3417 spectrum 1 weight 0.10000E+01 volume 0.60852E-02 ppm1 0.765 ppm2 7.158 CV 1
ASSI { 3418}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 19 and name HN ))
3.900 1.900 1.900 peak 3418 spectrum 1 weight 0.10000E+01 volume 0.18541E-02 ppm1 1.260 ppm2 7.879 CV 1
ASSI { 3420}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 19 and name HA ))
3.200 1.300 1.300 peak 3420 spectrum 1 weight 0.10000E+01 volume 0.61143E-02 ppm1 4.437 ppm2 5.388 CV 1
ASSI { 3423}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 19 and name HE% )
3.800 1.800 1.800 peak 3423 spectrum 1 weight 0.10000E+01 volume 0.22664E-02 ppm1 1.428 ppm2 7.298 CV 1
ASSI { 3424}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 19 and name HD% )
3.000 1.200 1.200 peak 3424 spectrum 1 weight 0.10000E+01 volume 0.87169E-02 ppm1 1.428 ppm2 7.159 CV 1
ASSI { 3426}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 110 and name HN ))
2.700 2.700 3.300 peak 3426 spectrum 1 weight 0.10000E+01 volume 0.16742E-01 ppm1 5.385 ppm2 8.810 CV 1
ASSI { 3430}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HN ))
2.500 0.800 0.800 peak 3430 spectrum 1 weight 0.10000E+01 volume 0.30426E-01 ppm1 7.116 ppm2 7.641 CV 1
ASSI { 3431}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 51 and name HN ))
2.400 0.700 0.700 peak 3431 spectrum 1 weight 0.10000E+01 volume 0.37801E-01 ppm1 5.060 ppm2 8.569 CV 1
ASSI { 3432}
(( segid " " and resid 39 and name HE22))
(( segid " " and resid 39 and name HE21))
6.000 4.500 0.000 peak 3432 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.689 ppm2 7.139 CV 1
ASSI { 3433}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HN ))
6.000 4.500 0.000 peak 3433 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.597 ppm2 6.672 CV 1
ASSI { 3434}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 20 and name HD2%)
6.000 4.500 0.000 peak 3434 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.077 ppm2 0.768 CV 1
ASSI { 3435}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HN ))
6.000 4.500 0.000 peak 3435 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.867 ppm2 9.278 CV 1
ASSI { 3436}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 22 and name HE% )
6.000 4.500 0.000 peak 3436 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.596 ppm2 6.709 CV 1
ASSI { 3437}
( segid " " and resid 22 and name HE% )
( segid " " and resid 22 and name HD% )
6.000 4.500 0.000 peak 3437 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.708 ppm2 7.226 CV 1
ASSI { 3438}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HN ))
6.000 4.500 0.000 peak 3438 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.597 ppm2 8.581 CV 1
ASSI { 3439}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 27 and name HD% )
6.000 4.500 0.000 peak 3439 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.597 ppm2 6.378 CV 1
ASSI { 3441}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HD3 ))
6.000 4.500 0.000 peak 3441 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.253 ppm2 3.099 CV 1
ASSI { 3442}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 33 and name HN ))
6.000 4.500 0.000 peak 3442 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 -0.819 ppm2 6.966 CV 1
ASSI { 3443}
(( segid " " and resid 33 and name HB3 ))
( segid " " and resid 33 and name HD2%)
6.000 4.500 0.000 peak 3443 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.516 ppm2 -0.815 CV 1
ASSI { 3444}
(( segid " " and resid 33 and name HG ))
( segid " " and resid 33 and name HD1%)
6.000 4.500 0.000 peak 3444 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.861 ppm2 0.006 CV 1
ASSI { 3445}
(( segid " " and resid 33 and name HB3 ))
( segid " " and resid 33 and name HD1%)
6.000 4.500 0.000 peak 3445 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.512 ppm2 0.006 CV 1
ASSI { 3448}
( segid " " and resid 57 and name HD1%)
(( segid " " and resid 57 and name HA ))
6.000 4.500 0.000 peak 3448 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.160 ppm2 6.170 CV 1
ASSI { 3449}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 62 and name HD% )
6.000 4.500 0.000 peak 3449 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.131 ppm2 6.524 CV 1
ASSI { 3450}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 62 and name HE% )
6.000 4.500 0.000 peak 3450 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.129 ppm2 6.415 CV 1
ASSI { 3451}
(( segid " " and resid 97 and name HA ))
( segid " " and resid 97 and name HD% )
6.000 4.500 0.000 peak 3451 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.636 ppm2 7.278 CV 1
ASSI { 3452}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 107 and name HN ))
6.000 4.500 0.000 peak 3452 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.015 ppm2 8.930 CV 1
ASSI { 3453}
(( segid " " and resid 110 and name HB2 ))
(( segid " " and resid 110 and name HD22))
6.000 4.500 0.000 peak 3453 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.187 ppm2 6.508 CV 1
ASSI { 3454}
(( segid " " and resid 112 and name HG2 ))
(( segid " " and resid 112 and name HE21))
6.000 4.500 0.000 peak 3454 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.023 ppm2 7.043 CV 1
OR { 3454}
(( segid " " and resid 112 and name HG3 ))
(( segid " " and resid 112 and name HE21))
ASSI { 3455}
(( segid " " and resid 112 and name HG2 ))
(( segid " " and resid 112 and name HE22))
6.000 4.500 0.000 peak 3455 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.022 ppm2 6.568 CV 1
OR { 3455}
(( segid " " and resid 112 and name HG3 ))
(( segid " " and resid 112 and name HE22))
ASSI { 3456}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 28 and name HH2 ))
4.000 2.000 2.000 peak 3456 spectrum 1 weight 0.10000E+01 volume 0.16022E-02 ppm1 4.306 ppm2 7.043 CV 1
ASSI { 3460}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HN ))
6.000 4.500 0.000 peak 3460 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.680 ppm2 9.359 CV 1
ASSI { 3463}
(( segid " " and resid 15 and name HG13))
(( segid " " and resid 15 and name HN ))
6.000 4.500 0.000 peak 3463 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 -0.573 ppm2 8.543 CV 1
ASSI { 3464}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HN ))
2.300 0.700 0.700 peak 3464 spectrum 1 weight 0.10000E+01 volume 0.46186E-01 ppm1 5.598 ppm2 8.967 CV 1
ASSI { 3465}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 22 and name HN ))
2.900 1.100 1.100 peak 3465 spectrum 1 weight 0.10000E+01 volume 0.11598E-01 ppm1 9.058 ppm2 9.359 CV 1
ASSI { 3467}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HN ))
2.300 0.600 0.600 peak 3467 spectrum 1 weight 0.10000E+01 volume 0.52938E-01 ppm1 5.385 ppm2 9.282 CV 1
ASSI { 3471}
(( segid " " and resid 5 and name HD1 ))
(( segid " " and resid 6 and name HN ))
4.100 2.100 1.900 peak 3471 spectrum 1 weight 0.10000E+01 volume 0.14473E-02 ppm1 7.207 ppm2 9.208 CV 1
ASSI { 3472}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HN ))
2.700 0.900 0.900 peak 3472 spectrum 1 weight 0.10000E+01 volume 0.16770E-01 ppm1 4.635 ppm2 9.208 CV 1
ASSI { 3473}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HB3 ))
6.000 4.500 0.000 peak 3473 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.556 ppm2 1.453 CV 1
ASSI { 3474}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HG2 ))
6.000 4.500 0.000 peak 3474 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.556 ppm2 1.278 CV 1
OR { 3474}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 3475}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HG3 ))
6.000 4.500 0.000 peak 3475 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.455 ppm2 1.278 CV 1
OR { 3475}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HG2 ))
ASSI { 3480}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 7 and name HG2 ))
6.000 4.500 0.000 peak 3480 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.352 ppm2 1.279 CV 1
OR { 3480}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 7 and name HG3 ))
ASSI { 3484}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 3484 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.226 ppm2 7.157 CV 1
ASSI { 3485}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 86 and name HG1%)
6.000 4.500 0.000 peak 3485 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.279 ppm2 0.913 CV 1
OR { 3485}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 86 and name HG2%)
OR { 3485}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 84 and name HG1%)
ASSI { 3487}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 3487 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.844 ppm2 9.129 CV 1
ASSI { 3488}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 28 and name HN ))
3.800 1.800 1.800 peak 3488 spectrum 1 weight 0.10000E+01 volume 0.21612E-02 ppm1 8.614 ppm2 9.139 CV 1
ASSI { 3490}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HD1 ))
6.000 4.500 0.000 peak 3490 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.660 ppm2 6.955 CV 1
ASSI { 3491}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 29 and name HN ))
3.800 1.800 1.800 peak 3491 spectrum 1 weight 0.10000E+01 volume 0.23245E-02 ppm1 8.739 ppm2 9.243 CV 1
ASSI { 3492}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HG2 ))
6.000 4.500 0.000 peak 3492 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.778 ppm2 1.638 CV 1
OR { 3492}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HG3 ))
ASSI { 3493}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 33 and name HN ))
6.000 4.500 0.000 peak 3493 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.469 ppm2 6.959 CV 1
ASSI { 3495}
(( segid " " and resid 34 and name HE2 ))
(( segid " " and resid 34 and name HB2 ))
6.000 4.500 0.000 peak 3495 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.075 ppm2 1.425 CV 1
OR { 3495}
(( segid " " and resid 34 and name HE3 ))
(( segid " " and resid 34 and name HB2 ))
ASSI { 3496}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB2 ))
6.000 4.500 0.000 peak 3496 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.912 ppm2 3.265 CV 1
ASSI { 3498}
(( segid " " and resid 42 and name HB2 ))
( segid " " and resid 42 and name HD2%)
6.000 4.500 0.000 peak 3498 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.158 ppm2 0.416 CV 1
ASSI { 3499}
(( segid " " and resid 42 and name HG ))
( segid " " and resid 42 and name HD2%)
6.000 4.500 0.000 peak 3499 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.424 ppm2 0.409 CV 1
ASSI { 3500}
(( segid " " and resid 42 and name HG ))
( segid " " and resid 42 and name HD1%)
6.000 4.500 0.000 peak 3500 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.422 ppm2 0.762 CV 1
ASSI { 3501}
(( segid " " and resid 45 and name HG12))
(( segid " " and resid 45 and name HG13))
6.000 4.500 0.000 peak 3501 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.406 ppm2 1.216 CV 1
ASSI { 3502}
(( segid " " and resid 45 and name HG12))
( segid " " and resid 45 and name HG2%)
6.000 4.500 0.000 peak 3502 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.406 ppm2 0.956 CV 1
ASSI { 3503}
(( segid " " and resid 45 and name HG13))
( segid " " and resid 45 and name HD1%)
6.000 4.500 0.000 peak 3503 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.209 ppm2 0.861 CV 1
ASSI { 3504}
(( segid " " and resid 45 and name HG13))
( segid " " and resid 45 and name HG2%)
6.000 4.500 0.000 peak 3504 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.214 ppm2 0.955 CV 1
ASSI { 3505}
(( segid " " and resid 45 and name HG12))
( segid " " and resid 45 and name HD1%)
6.000 4.500 0.000 peak 3505 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.409 ppm2 0.860 CV 1
ASSI { 3507}
( segid " " and resid 62 and name HD% )
(( segid " " and resid 63 and name HN ))
3.200 1.300 1.300 peak 3507 spectrum 1 weight 0.10000E+01 volume 0.62734E-02 ppm1 6.513 ppm2 8.415 CV 1
ASSI { 3508}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 3508 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.733 ppm2 9.117 CV 1
ASSI { 3509}
(( segid " " and resid 84 and name HB ))
( segid " " and resid 84 and name HG2%)
6.000 4.500 0.000 peak 3509 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.071 ppm2 0.912 CV 1
OR { 3509}
(( segid " " and resid 84 and name HB ))
( segid " " and resid 84 and name HG1%)
ASSI { 3511}
(( segid " " and resid 96 and name HG3 ))
(( segid " " and resid 97 and name HN ))
6.000 4.500 0.000 peak 3511 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.102 ppm2 8.404 CV 1
ASSI { 3512}
(( segid " " and resid 96 and name HG3 ))
(( segid " " and resid 96 and name HB3 ))
6.000 4.500 0.000 peak 3512 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.108 ppm2 1.878 CV 1
ASSI { 3513}
(( segid " " and resid 100 and name HG2 ))
(( segid " " and resid 100 and name HB2 ))
6.000 4.500 0.000 peak 3513 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.310 ppm2 2.048 CV 1
OR { 3513}
(( segid " " and resid 100 and name HG3 ))
(( segid " " and resid 100 and name HB3 ))
OR { 3513}
(( segid " " and resid 100 and name HG2 ))
(( segid " " and resid 100 and name HB3 ))
ASSI { 3514}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HG2 ))
6.000 4.500 0.000 peak 3514 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.906 ppm2 1.756 CV 1
ASSI { 3515}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HB3 ))
6.000 4.500 0.000 peak 3515 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.906 ppm2 1.559 CV 1
ASSI { 3516}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HG3 ))
6.000 4.500 0.000 peak 3516 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.906 ppm2 1.486 CV 1
ASSI { 3517}
(( segid " " and resid 102 and name HG2 ))
(( segid " " and resid 102 and name HG3 ))
6.000 4.500 0.000 peak 3517 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.754 ppm2 1.486 CV 1
ASSI { 3518}
(( segid " " and resid 102 and name HG2 ))
(( segid " " and resid 102 and name HB3 ))
6.000 4.500 0.000 peak 3518 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.754 ppm2 1.559 CV 1
ASSI { 3519}
(( segid " " and resid 108 and name HB3 ))
( segid " " and resid 108 and name HD1%)
6.000 4.500 0.000 peak 3519 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.619 ppm2 0.959 CV 1
OR { 3519}
(( segid " " and resid 108 and name HB2 ))
( segid " " and resid 108 and name HD2%)
OR { 3519}
(( segid " " and resid 108 and name HB3 ))
( segid " " and resid 108 and name HD2%)
ASSI { 3520}
(( segid " " and resid 108 and name HG ))
( segid " " and resid 108 and name HD1%)
6.000 4.500 0.000 peak 3520 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.654 ppm2 0.959 CV 1
OR { 3520}
(( segid " " and resid 108 and name HG ))
( segid " " and resid 108 and name HD2%)
ASSI { 3521}
(( segid " " and resid 112 and name HG3 ))
(( segid " " and resid 112 and name HB3 ))
6.000 4.500 0.000 peak 3521 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.024 ppm2 1.775 CV 1
OR { 3521}
(( segid " " and resid 112 and name HG2 ))
(( segid " " and resid 112 and name HB2 ))
OR { 3521}
(( segid " " and resid 112 and name HG3 ))
(( segid " " and resid 112 and name HB2 ))
ASSI { 3522}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 28 and name HH2 ))
6.000 4.500 0.000 peak 3522 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.226 ppm2 7.040 CV 1
ASSI { 3523}
(( segid " " and resid 113 and name HB3 ))
( segid " " and resid 113 and name HD% )
6.000 4.500 0.000 peak 3523 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.005 ppm2 7.151 CV 1
OR { 3523}
(( segid " " and resid 113 and name HB2 ))
( segid " " and resid 113 and name HD% )
ASSI { 3524}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
2.500 0.800 0.800 peak 3524 spectrum 1 weight 0.10000E+01 volume 0.26400E-01 ppm1 8.280 ppm2 8.928 CV 1
ASSI { 3526}
(( segid " " and resid 24 and name HG2 ))
( segid " " and resid 51 and name HG2%)
2.800 0.900 0.900 peak 3526 spectrum 1 weight 0.10000E+01 volume 0.15843E-01 ppm1 2.446 ppm2 1.094 CV 1
OR { 3526}
(( segid " " and resid 24 and name HG3 ))
( segid " " and resid 51 and name HG2%)
ASSI { 3528}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 46 and name HN ))
3.500 1.500 1.500 peak 3528 spectrum 1 weight 0.10000E+01 volume 0.38977E-02 ppm1 0.950 ppm2 7.640 CV 1
ASSI { 3534}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 11 and name HN ))
3.400 1.500 1.500 peak 3534 spectrum 1 weight 0.10000E+01 volume 0.41412E-02 ppm1 3.921 ppm2 8.087 CV 1
ASSI { 3535}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 27 and name HA ))
4.200 2.200 1.800 peak 3535 spectrum 1 weight 0.10000E+01 volume 0.12619E-02 ppm1 2.585 ppm2 5.603 CV 1
OR { 3535}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 22 and name HA ))
OR { 3535}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 21 and name HA ))
ASSI { 3537}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 37 and name HN ))
3.500 1.600 1.600 peak 3537 spectrum 1 weight 0.10000E+01 volume 0.34743E-02 ppm1 3.426 ppm2 8.934 CV 1
OR { 3537}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 58 and name HN ))
ASSI { 3539}
( segid " " and resid 108 and name HD1%)
(( segid " " and resid 106 and name HN ))
6.000 4.500 0.000 peak 3539 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.972 ppm2 9.063 CV 1
OR { 3539}
( segid " " and resid 20 and name HD1%)
(( segid " " and resid 106 and name HN ))
OR { 3539}
( segid " " and resid 108 and name HD2%)
(( segid " " and resid 106 and name HN ))
ASSI { 3540}
(( segid " " and resid 109 and name HA ))
( segid " " and resid 19 and name HE% )
3.900 1.900 1.900 peak 3540 spectrum 1 weight 0.10000E+01 volume 0.18541E-02 ppm1 4.434 ppm2 7.299 CV 1
ASSI { 3541}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 19 and name HN ))
3.400 1.400 1.400 peak 3541 spectrum 1 weight 0.10000E+01 volume 0.45577E-02 ppm1 2.599 ppm2 7.877 CV 1
ASSI { 3542}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 19 and name HN ))
4.300 2.300 1.700 peak 3542 spectrum 1 weight 0.10000E+01 volume 0.11111E-02 ppm1 4.633 ppm2 7.879 CV 1
ASSI { 3544}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 28 and name HE1 ))
3.200 1.300 1.300 peak 3544 spectrum 1 weight 0.10000E+01 volume 0.60299E-02 ppm1 2.281 ppm2 9.577 CV 1
ASSI { 3545}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 49 and name HN ))
6.000 4.500 0.000 peak 3545 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.413 ppm2 8.665 CV 1
ASSI { 3546}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 3546 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.403 ppm2 8.538 CV 1
ASSI { 3548}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 22 and name HN ))
3.200 1.300 1.300 peak 3548 spectrum 1 weight 0.10000E+01 volume 0.59787E-02 ppm1 5.012 ppm2 9.357 CV 1
ASSI { 3553}
( segid " " and resid 27 and name HD% )
( segid " " and resid 22 and name HD% )
3.300 1.400 1.400 peak 3553 spectrum 1 weight 0.10000E+01 volume 0.50074E-02 ppm1 6.358 ppm2 7.224 CV 1
ASSI { 3555}
( segid " " and resid 27 and name HE% )
( segid " " and resid 22 and name HE% )
3.100 1.200 1.200 peak 3555 spectrum 1 weight 0.10000E+01 volume 0.75781E-02 ppm1 6.358 ppm2 6.709 CV 1
ASSI { 3556}
( segid " " and resid 27 and name HD% )
( segid " " and resid 22 and name HE% )
3.300 1.400 1.400 peak 3556 spectrum 1 weight 0.10000E+01 volume 0.54501E-02 ppm1 6.380 ppm2 6.709 CV 1
ASSI { 3560}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 27 and name HD% )
3.300 1.400 1.400 peak 3560 spectrum 1 weight 0.10000E+01 volume 0.54681E-02 ppm1 4.575 ppm2 6.379 CV 1
ASSI { 3569}
( segid " " and resid 63 and name HD1%)
(( segid " " and resid 60 and name HN ))
6.000 4.500 0.000 peak 3569 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.819 ppm2 8.348 CV 1
ASSI { 3571}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 34 and name HB3 ))
3.200 1.300 1.300 peak 3571 spectrum 1 weight 0.10000E+01 volume 0.65584E-02 ppm1 4.151 ppm2 1.266 CV 1
ASSI { 3573}
(( segid " " and resid 54 and name HA1 ))
( segid " " and resid 51 and name HG2%)
4.300 2.300 1.700 peak 3573 spectrum 1 weight 0.10000E+01 volume 0.11761E-02 ppm1 4.149 ppm2 1.094 CV 1
ASSI { 3575}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 28 and name HZ2 ))
3.000 1.100 1.100 peak 3575 spectrum 1 weight 0.10000E+01 volume 0.10338E-01 ppm1 0.782 ppm2 7.125 CV 1
ASSI { 3576}
(( segid " " and resid 52 and name HD3 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 3576 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.829 ppm2 7.815 CV 1
ASSI { 3577}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG2 ))
6.000 4.500 0.000 peak 3577 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.282 ppm2 0.949 CV 1
ASSI { 3578}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 3578 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.283 ppm2 0.492 CV 1
ASSI { 3579}
(( segid " " and resid 52 and name HE3 ))
(( segid " " and resid 52 and name HD2 ))
6.000 4.500 0.000 peak 3579 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.580 ppm2 1.451 CV 1
OR { 3579}
(( segid " " and resid 52 and name HE2 ))
(( segid " " and resid 52 and name HD2 ))
ASSI { 3580}
(( segid " " and resid 52 and name HE2 ))
(( segid " " and resid 52 and name HG2 ))
6.000 4.500 0.000 peak 3580 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.577 ppm2 0.945 CV 1
ASSI { 3581}
(( segid " " and resid 52 and name HE3 ))
(( segid " " and resid 52 and name HD3 ))
6.000 4.500 0.000 peak 3581 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.580 ppm2 0.830 CV 1
OR { 3581}
(( segid " " and resid 52 and name HE2 ))
(( segid " " and resid 52 and name HD3 ))
ASSI { 3582}
(( segid " " and resid 52 and name HE2 ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 3582 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.578 ppm2 0.492 CV 1
OR { 3582}
(( segid " " and resid 52 and name HE3 ))
(( segid " " and resid 52 and name HG3 ))
ASSI { 3583}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HG2 ))
6.000 4.500 0.000 peak 3583 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.451 ppm2 0.945 CV 1
ASSI { 3584}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HD3 ))
6.000 4.500 0.000 peak 3584 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.451 ppm2 0.830 CV 1
ASSI { 3585}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 3585 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.451 ppm2 0.492 CV 1
ASSI { 3586}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 3586 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.948 ppm2 0.492 CV 1
ASSI { 3587}
(( segid " " and resid 52 and name HD3 ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 3587 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.831 ppm2 0.492 CV 1
ASSI { 3588}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 3588 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.264 ppm2 7.817 CV 1
ASSI { 3589}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB2 ))
6.000 4.500 0.000 peak 3589 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.282 ppm2 1.590 CV 1
ASSI { 3590}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB3 ))
6.000 4.500 0.000 peak 3590 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.283 ppm2 1.265 CV 1
ASSI { 3593}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 22 and name HN ))
3.100 1.200 1.200 peak 3593 spectrum 1 weight 0.10000E+01 volume 0.72571E-02 ppm1 1.638 ppm2 9.358 CV 1
ASSI { 3594}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HN ))
6.000 4.500 0.000 peak 3594 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.389 ppm2 8.112 CV 1
ASSI { 3595}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 3595 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.387 ppm2 8.328 CV 1
ASSI { 3596}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HB3 ))
6.000 4.500 0.000 peak 3596 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.387 ppm2 1.917 CV 1
ASSI { 3597}
(( segid " " and resid 55 and name HG2 ))
(( segid " " and resid 55 and name HB2 ))
6.000 4.500 0.000 peak 3597 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.635 ppm2 2.393 CV 1
ASSI { 3598}
(( segid " " and resid 55 and name HG3 ))
(( segid " " and resid 55 and name HB2 ))
6.000 4.500 0.000 peak 3598 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.579 ppm2 2.394 CV 1
ASSI { 3599}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB2 ))
6.000 4.500 0.000 peak 3599 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.633 ppm2 2.394 CV 1
ASSI { 3600}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 27 and name HN ))
6.000 4.500 0.000 peak 3600 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.575 ppm2 8.579 CV 1
ASSI { 3603}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 55 and name HN ))
4.300 2.300 1.700 peak 3603 spectrum 1 weight 0.10000E+01 volume 0.11221E-02 ppm1 7.820 ppm2 8.105 CV 1
ASSI { 3604}
( segid " " and resid 62 and name HD% )
(( segid " " and resid 62 and name HN ))
6.000 4.500 0.000 peak 3604 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.513 ppm2 8.833 CV 1
ASSI { 3605}
( segid " " and resid 50 and name HD% )
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 3605 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.448 ppm2 8.844 CV 1
ASSI { 3606}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HN ))
2.600 0.800 0.800 peak 3606 spectrum 1 weight 0.10000E+01 volume 0.23024E-01 ppm1 8.103 ppm2 7.866 CV 1
ASSI { 3609}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HN ))
6.000 4.500 0.000 peak 3609 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.999 ppm2 9.241 CV 1
ASSI { 3610}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 20 and name HN ))
6.000 4.500 0.000 peak 3610 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.011 ppm2 9.273 CV 1
ASSI { 3612}
(( segid " " and resid 109 and name HB3 ))
( segid " " and resid 19 and name HD% )
3.400 1.400 1.400 peak 3612 spectrum 1 weight 0.10000E+01 volume 0.44650E-02 ppm1 1.924 ppm2 7.161 CV 1
OR { 3612}
(( segid " " and resid 109 and name HB2 ))
( segid " " and resid 19 and name HD% )
ASSI { 3613}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 32 and name HN ))
2.900 1.100 1.100 peak 3613 spectrum 1 weight 0.10000E+01 volume 0.11533E-01 ppm1 3.923 ppm2 7.610 CV 1
ASSI { 3615}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HN ))
6.000 4.500 0.000 peak 3615 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.263 ppm2 8.286 CV 1
ASSI { 3616}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 38 and name HN ))
6.000 4.500 0.000 peak 3616 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.242 ppm2 8.286 CV 1
ASSI { 3617}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 38 and name HN ))
3.500 1.500 1.500 peak 3617 spectrum 1 weight 0.10000E+01 volume 0.36583E-02 ppm1 4.154 ppm2 8.288 CV 1
ASSI { 3618}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 110 and name HN ))
4.300 2.400 1.700 peak 3618 spectrum 1 weight 0.10000E+01 volume 0.10433E-02 ppm1 3.568 ppm2 8.810 CV 1
ASSI { 3619}
(( segid " " and resid 28 and name HH2 ))
(( segid " " and resid 28 and name HE1 ))
6.000 4.500 0.000 peak 3619 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.037 ppm2 9.576 CV 1
ASSI { 3620}
(( segid " " and resid 28 and name HE3 ))
(( segid " " and resid 28 and name HN ))
6.000 4.500 0.000 peak 3620 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.144 ppm2 9.137 CV 1
ASSI { 3621}
(( segid " " and resid 28 and name HH2 ))
(( segid " " and resid 28 and name HZ3 ))
6.000 4.500 0.000 peak 3621 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.040 ppm2 6.903 CV 1
ASSI { 3622}
(( segid " " and resid 28 and name HH2 ))
(( segid " " and resid 28 and name HZ2 ))
6.000 4.500 0.000 peak 3622 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.040 ppm2 7.125 CV 1
ASSI { 3623}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 28 and name HH2 ))
6.000 4.500 0.000 peak 3623 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 -0.818 ppm2 7.040 CV 1
ASSI { 3624}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 28 and name HD1 ))
6.000 4.500 0.000 peak 3624 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 -0.819 ppm2 6.954 CV 1
ASSI { 3627}
(( segid " " and resid 107 and name HD2 ))
( segid " " and resid 22 and name HD% )
6.000 4.500 0.000 peak 3627 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.908 ppm2 7.224 CV 1
OR { 3627}
(( segid " " and resid 107 and name HD3 ))
( segid " " and resid 22 and name HD% )
ASSI { 3630}
(( segid " " and resid 27 and name HB3 ))
( segid " " and resid 22 and name HE% )
6.000 4.500 0.000 peak 3630 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.705 ppm2 6.710 CV 1
OR { 3630}
(( segid " " and resid 27 and name HB2 ))
( segid " " and resid 22 and name HE% )
ASSI { 3631}
(( segid " " and resid 27 and name HB3 ))
( segid " " and resid 22 and name HD% )
6.000 4.500 0.000 peak 3631 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.706 ppm2 7.224 CV 1
ASSI { 3634}
(( segid " " and resid 6 and name HG3 ))
( segid " " and resid 22 and name HD% )
3.500 1.500 1.500 peak 3634 spectrum 1 weight 0.10000E+01 volume 0.39586E-02 ppm1 0.592 ppm2 7.225 CV 1
OR { 3634}
(( segid " " and resid 6 and name HG2 ))
( segid " " and resid 22 and name HD% )
ASSI { 3636}
( segid " " and resid 20 and name HD1%)
( segid " " and resid 22 and name HD% )
6.000 4.500 0.000 peak 3636 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.973 ppm2 7.225 CV 1
ASSI { 3638}
(( segid " " and resid 24 and name HG3 ))
(( segid " " and resid 26 and name HN ))
4.100 2.100 1.900 peak 3638 spectrum 1 weight 0.10000E+01 volume 0.14819E-02 ppm1 2.433 ppm2 7.204 CV 1
OR { 3638}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 26 and name HN ))
OR { 3638}
(( segid " " and resid 114 and name HB3 ))
( segid " " and resid 113 and name HE% )
ASSI { 3640}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 22 and name HD% )
6.000 4.500 0.000 peak 3640 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.580 ppm2 7.226 CV 1
ASSI { 3643}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 56 and name HN ))
4.200 2.200 1.800 peak 3643 spectrum 1 weight 0.10000E+01 volume 0.12439E-02 ppm1 3.823 ppm2 8.332 CV 1
OR { 3643}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 56 and name HN ))
ASSI { 3650}
( segid " " and resid 63 and name HD1%)
( segid " " and resid 62 and name HD% )
6.000 4.500 0.000 peak 3650 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.812 ppm2 6.521 CV 1
ASSI { 3651}
(( segid " " and resid 50 and name HB2 ))
( segid " " and resid 62 and name HD% )
3.600 1.600 1.600 peak 3651 spectrum 1 weight 0.10000E+01 volume 0.34383E-02 ppm1 2.414 ppm2 6.518 CV 1
ASSI { 3652}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 46 and name HN ))
6.000 4.500 0.000 peak 3652 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.509 ppm2 7.644 CV 1
ASSI { 3653}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 46 and name HN ))
6.000 4.500 0.000 peak 3653 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.519 ppm2 7.644 CV 1
ASSI { 3654}
( segid " " and resid 108 and name HD2%)
(( segid " " and resid 113 and name HN ))
6.000 4.500 0.000 peak 3654 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.960 ppm2 7.548 CV 1
OR { 3654}
( segid " " and resid 108 and name HD1%)
(( segid " " and resid 113 and name HN ))
ASSI { 3655}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 44 and name HN ))
6.000 4.500 0.000 peak 3655 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.950 ppm2 7.561 CV 1
ASSI { 3656}
(( segid " " and resid 45 and name HG13))
(( segid " " and resid 44 and name HN ))
4.000 2.000 2.000 peak 3656 spectrum 1 weight 0.10000E+01 volume 0.17946E-02 ppm1 1.215 ppm2 7.561 CV 1
ASSI { 3657}
(( segid " " and resid 45 and name HG12))
(( segid " " and resid 44 and name HN ))
6.000 4.500 0.000 peak 3657 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.400 ppm2 7.559 CV 1
ASSI { 3658}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 23 and name HN ))
4.100 2.200 1.900 peak 3658 spectrum 1 weight 0.10000E+01 volume 0.13629E-02 ppm1 2.683 ppm2 8.968 CV 1
ASSI { 3659}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 23 and name HN ))
4.500 2.500 1.500 peak 3659 spectrum 1 weight 0.10000E+01 volume 0.85647E-03 ppm1 2.711 ppm2 8.960 CV 1
OR { 3659}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 23 and name HN ))
ASSI { 3660}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 23 and name HN ))
4.100 2.100 1.900 peak 3660 spectrum 1 weight 0.10000E+01 volume 0.14583E-02 ppm1 2.894 ppm2 8.968 CV 1
ASSI { 3661}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 22 and name HN ))
3.700 1.700 1.700 peak 3661 spectrum 1 weight 0.10000E+01 volume 0.25874E-02 ppm1 8.944 ppm2 9.353 CV 1
ASSI { 3662}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 17 and name HN ))
2.800 1.000 1.000 peak 3662 spectrum 1 weight 0.10000E+01 volume 0.14556E-01 ppm1 0.857 ppm2 6.673 CV 1
ASSI { 3664}
(( segid " " and resid 101 and name HB3 ))
(( segid " " and resid 101 and name HN ))
6.000 4.500 0.000 peak 3664 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.447 ppm2 8.219 CV 1
ASSI { 3665}
(( segid " " and resid 121 and name HB2 ))
(( segid " " and resid 121 and name HN ))
6.000 4.500 0.000 peak 3665 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.702 ppm2 8.214 CV 1
ASSI { 3668}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 28 and name HN ))
3.200 1.300 1.300 peak 3668 spectrum 1 weight 0.10000E+01 volume 0.61129E-02 ppm1 0.400 ppm2 9.134 CV 1
ASSI { 3670}
(( segid " " and resid 100 and name HG3 ))
(( segid " " and resid 101 and name HN ))
6.000 4.500 0.000 peak 3670 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.309 ppm2 8.219 CV 1
OR { 3670}
(( segid " " and resid 100 and name HG2 ))
(( segid " " and resid 101 and name HN ))
ASSI { 3671}
(( segid " " and resid 80 and name HB3 ))
(( segid " " and resid 80 and name HN ))
6.000 4.500 0.000 peak 3671 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.759 ppm2 8.209 CV 1
OR { 3671}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HN ))
ASSI { 3672}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HN ))
6.000 4.500 0.000 peak 3672 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.558 ppm2 8.211 CV 1
ASSI { 3673}
(( segid " " and resid 101 and name HB3 ))
(( segid " " and resid 51 and name HN ))
6.000 4.500 0.000 peak 3673 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.441 ppm2 8.571 CV 1
ASSI { 3675}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HN ))
4.200 2.200 1.800 peak 3675 spectrum 1 weight 0.10000E+01 volume 0.12508E-02 ppm1 8.363 ppm2 9.209 CV 1
ASSI { 3678}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 12 and name HN ))
4.600 2.700 1.400 peak 3678 spectrum 1 weight 0.10000E+01 volume 0.69873E-03 ppm1 2.244 ppm2 8.137 CV 1
ASSI { 3680}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HN ))
6.000 4.500 0.000 peak 3680 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.084 ppm2 9.279 CV 1
ASSI { 3681}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 20 and name HN ))
3.900 1.900 1.900 peak 3681 spectrum 1 weight 0.10000E+01 volume 0.18831E-02 ppm1 7.874 ppm2 9.280 CV 1
ASSI { 3682}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 28 and name HD1 ))
6.000 4.500 0.000 peak 3682 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 -0.005 ppm2 6.956 CV 1
ASSI { 3684}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 105 and name HD1%)
3.000 3.000 3.000 peak 3684 spectrum 1 weight 0.10000E+01 volume 0.90268E-02 ppm1 4.505 ppm2 0.318 CV 1
ASSI { 3686}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 25 and name HN ))
6.000 4.500 0.000 peak 3686 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.381 ppm2 8.491 CV 1
ASSI { 3687}
(( segid " " and resid 55 and name HG2 ))
( segid " " and resid 55 and name HE% )
6.000 4.500 0.000 peak 3687 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.636 ppm2 2.235 CV 1
ASSI { 3692}
( segid " " and resid 106 and name HG2%)
( segid " " and resid 108 and name HD1%)
6.000 4.500 0.000 peak 3692 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.300 ppm2 0.960 CV 1
OR { 3692}
( segid " " and resid 106 and name HG2%)
( segid " " and resid 108 and name HD2%)
ASSI { 3694}
(( segid " " and resid 21 and name HG ))
( segid " " and resid 105 and name HG2%)
2.700 0.900 0.900 peak 3694 spectrum 1 weight 0.10000E+01 volume 0.17157E-01 ppm1 0.860 ppm2 0.672 CV 1
ASSI { 3695}
( segid " " and resid 23 and name HB% )
( segid " " and resid 105 and name HG2%)
3.400 1.500 1.500 peak 3695 spectrum 1 weight 0.10000E+01 volume 0.43916E-02 ppm1 1.007 ppm2 0.672 CV 1
ASSI { 3696}
(( segid " " and resid 107 and name HB3 ))
( segid " " and resid 105 and name HG2%)
6.000 4.500 0.000 peak 3696 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.638 ppm2 0.673 CV 1
ASSI { 3699}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 9 and name HB% )
3.000 1.100 1.100 peak 3699 spectrum 1 weight 0.10000E+01 volume 0.90863E-02 ppm1 4.361 ppm2 0.239 CV 1
ASSI { 3702}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 105 and name HD1%)
3.600 1.700 1.700 peak 3702 spectrum 1 weight 0.10000E+01 volume 0.29610E-02 ppm1 4.636 ppm2 0.323 CV 1
ASSI { 3703}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 3703 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.264 ppm2 0.492 CV 1
ASSI { 3704}
(( segid " " and resid 27 and name HB3 ))
( segid " " and resid 15 and name HG2%)
4.400 2.400 1.600 peak 3704 spectrum 1 weight 0.10000E+01 volume 0.96301E-03 ppm1 2.707 ppm2 0.864 CV 1
OR { 3704}
(( segid " " and resid 27 and name HB2 ))
( segid " " and resid 15 and name HG2%)
ASSI { 3707}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 27 and name HD% )
6.000 4.500 0.000 peak 3707 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.267 ppm2 6.378 CV 1
OR { 3707}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 27 and name HD% )
OR { 3707}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 27 and name HD% )
ASSI { 3708}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 29 and name HN ))
4.500 2.600 1.500 peak 3708 spectrum 1 weight 0.10000E+01 volume 0.79974E-03 ppm1 0.858 ppm2 9.237 CV 1
ASSI { 3709}
(( segid " " and resid 56 and name HG13))
( segid " " and resid 56 and name HD1%)
6.000 4.500 0.000 peak 3709 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.616 ppm2 0.788 CV 1
OR { 3709}
(( segid " " and resid 56 and name HG12))
( segid " " and resid 56 and name HD1%)
ASSI { 3710}
(( segid " " and resid 56 and name HG13))
( segid " " and resid 56 and name HG2%)
6.000 4.500 0.000 peak 3710 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.616 ppm2 0.601 CV 1
OR { 3710}
(( segid " " and resid 56 and name HG12))
( segid " " and resid 56 and name HG2%)
ASSI { 3711}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 3711 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.637 ppm2 8.631 CV 1
ASSI { 3712}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HA ))
6.000 4.500 0.000 peak 3712 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.637 ppm2 5.598 CV 1
ASSI { 3713}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HG ))
6.000 4.500 0.000 peak 3713 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.849 ppm2 0.858 CV 1
ASSI { 3715}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HB2 ))
6.000 4.500 0.000 peak 3715 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.638 ppm2 1.195 CV 1
ASSI { 3716}
( segid " " and resid 21 and name HD1%)
( segid " " and resid 21 and name HD2%)
6.000 4.500 0.000 peak 3716 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.636 ppm2 0.950 CV 1
ASSI { 3717}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HG ))
6.000 4.500 0.000 peak 3717 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.640 ppm2 0.858 CV 1
ASSI { 3718}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HG ))
6.000 4.500 0.000 peak 3718 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.196 ppm2 0.858 CV 1
ASSI { 3719}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 21 and name HD2%)
6.000 4.500 0.000 peak 3719 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.196 ppm2 0.950 CV 1
ASSI { 3721}
(( segid " " and resid 108 and name HB3 ))
( segid " " and resid 22 and name HE% )
3.300 1.400 1.400 peak 3721 spectrum 1 weight 0.10000E+01 volume 0.52080E-02 ppm1 1.637 ppm2 6.710 CV 1
OR { 3721}
(( segid " " and resid 108 and name HB2 ))
( segid " " and resid 22 and name HE% )
OR { 3721}
(( segid " " and resid 108 and name HG ))
( segid " " and resid 22 and name HE% )
ASSI { 3722}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 66 and name HN ))
3.700 1.700 1.700 peak 3722 spectrum 1 weight 0.10000E+01 volume 0.26012E-02 ppm1 0.696 ppm2 8.101 CV 1
ASSI { 3726}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 28 and name HE1 ))
3.900 1.900 1.900 peak 3726 spectrum 1 weight 0.10000E+01 volume 0.19952E-02 ppm1 -0.003 ppm2 9.578 CV 1
ASSI { 3727}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 43 and name HN ))
3.900 1.900 1.900 peak 3727 spectrum 1 weight 0.10000E+01 volume 0.19661E-02 ppm1 -0.001 ppm2 9.801 CV 1
ASSI { 3728}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 57 and name HN ))
4.100 2.100 1.900 peak 3728 spectrum 1 weight 0.10000E+01 volume 0.14279E-02 ppm1 0.405 ppm2 9.571 CV 1
ASSI { 3733}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 43 and name HN ))
3.900 1.900 1.900 peak 3733 spectrum 1 weight 0.10000E+01 volume 0.20312E-02 ppm1 1.157 ppm2 9.801 CV 1
ASSI { 3737}
( segid " " and resid 106 and name HG2%)
( segid " " and resid 27 and name HE% )
6.000 4.500 0.000 peak 3737 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.303 ppm2 6.369 CV 1
ASSI { 3738}
( segid " " and resid 106 and name HG2%)
( segid " " and resid 27 and name HD% )
6.000 4.500 0.000 peak 3738 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.303 ppm2 6.378 CV 1
ASSI { 3739}
(( segid " " and resid 27 and name HB2 ))
( segid " " and resid 27 and name HE% )
6.000 4.500 0.000 peak 3739 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.702 ppm2 6.369 CV 1
OR { 3739}
(( segid " " and resid 27 and name HB3 ))
( segid " " and resid 27 and name HE% )
ASSI { 3740}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 27 and name HE% )
6.000 4.500 0.000 peak 3740 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.679 ppm2 6.369 CV 1
ASSI { 3741}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 27 and name HE% )
6.000 4.500 0.000 peak 3741 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.899 ppm2 6.369 CV 1
ASSI { 3743}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 27 and name HD% )
6.000 4.500 0.000 peak 3743 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.899 ppm2 6.378 CV 1
ASSI { 3744}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 27 and name HD% )
6.000 4.500 0.000 peak 3744 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.267 ppm2 6.369 CV 1
OR { 3744}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 27 and name HD% )
OR { 3744}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 27 and name HE% )
OR { 3744}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 27 and name HD% )
ASSI { 3745}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 27 and name HE% )
6.000 4.500 0.000 peak 3745 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.597 ppm2 6.369 CV 1
ASSI { 3746}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 50 and name HE% )
6.000 4.500 0.000 peak 3746 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.474 ppm2 6.179 CV 1
ASSI { 3749}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 42 and name HN ))
4.300 2.300 1.700 peak 3749 spectrum 1 weight 0.10000E+01 volume 0.11138E-02 ppm1 -0.005 ppm2 7.949 CV 1
ASSI { 3750}
(( segid " " and resid 55 and name HG3 ))
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 3750 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.579 ppm2 8.329 CV 1
ASSI { 3751}
(( segid " " and resid 55 and name HG2 ))
(( segid " " and resid 56 and name HN ))
6.000 4.500 0.000 peak 3751 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.635 ppm2 8.329 CV 1
ASSI { 3752}
( segid " " and resid 9 and name HB% )
( segid " " and resid 33 and name HD2%)
3.900 3.900 2.100 peak 3752 spectrum 1 weight 0.10000E+01 volume 0.18776E-02 ppm1 0.235 ppm2 -0.814 CV 1
ASSI { 3754}
(( segid " " and resid 12 and name HA1 ))
(( segid " " and resid 13 and name HN ))
3.800 1.800 1.800 peak 3754 spectrum 1 weight 0.10000E+01 volume 0.24891E-02 ppm1 4.257 ppm2 9.187 CV 1
ASSI { 3755}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 5 and name HE3 ))
3.200 1.300 1.300 peak 3755 spectrum 1 weight 0.10000E+01 volume 0.61419E-02 ppm1 1.439 ppm2 7.529 CV 1
ASSI { 3756}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 5 and name HE3 ))
6.000 4.500 0.000 peak 3756 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.253 ppm2 7.529 CV 1
ASSI { 3762}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 21 and name HA ))
6.000 4.500 0.000 peak 3762 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.959 ppm2 5.603 CV 1
ASSI { 3765}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 40 and name HN ))
3.600 1.600 1.600 peak 3765 spectrum 1 weight 0.10000E+01 volume 0.33636E-02 ppm1 8.282 ppm2 8.581 CV 1
ASSI { 3772}
( segid " " and resid 50 and name HE% )
( segid " " and resid 62 and name HD% )
2.900 1.000 1.000 peak 3772 spectrum 1 weight 0.10000E+01 volume 0.11974E-01 ppm1 6.178 ppm2 6.523 CV 1
ASSI { 3774}
(( segid " " and resid 24 and name HB2 ))
( segid " " and resid 51 and name HG2%)
6.000 4.500 0.000 peak 3774 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.079 ppm2 1.095 CV 1
ASSI { 3775}
(( segid " " and resid 50 and name HB3 ))
( segid " " and resid 51 and name HG2%)
6.000 4.500 0.000 peak 3775 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.086 ppm2 1.095 CV 1
ASSI { 3776}
(( segid " " and resid 52 and name HD2 ))
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 3776 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.452 ppm2 7.161 CV 1
ASSI { 3777}
(( segid " " and resid 13 and name HA2 ))
(( segid " " and resid 14 and name HN ))
6.000 4.500 0.000 peak 3777 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.874 ppm2 8.546 CV 1
ASSI { 3778}
(( segid " " and resid 13 and name HA1 ))
(( segid " " and resid 14 and name HN ))
6.000 4.500 0.000 peak 3778 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.331 ppm2 8.545 CV 1
ASSI { 3779}
(( segid " " and resid 24 and name HG3 ))
( segid " " and resid 104 and name HD1%)
2.900 1.100 1.100 peak 3779 spectrum 1 weight 0.10000E+01 volume 0.10769E-01 ppm1 2.450 ppm2 0.889 CV 1
OR { 3779}
(( segid " " and resid 24 and name HG2 ))
( segid " " and resid 104 and name HD1%)
ASSI { 3780}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 15 and name HG2%)
6.000 4.500 0.000 peak 3780 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.784 ppm2 0.859 CV 1
ASSI { 3782}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 65 and name HD1%)
6.000 4.500 0.000 peak 3782 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.795 ppm2 0.700 CV 1
ASSI { 3786}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 17 and name HN ))
6.000 4.500 0.000 peak 3786 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.906 ppm2 6.675 CV 1
ASSI { 3787}
(( segid " " and resid 18 and name HG2 ))
(( segid " " and resid 18 and name HG3 ))
6.000 4.500 0.000 peak 3787 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.066 ppm2 0.764 CV 1
ASSI { 3789}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 7 and name HE ))
3.800 1.800 1.800 peak 3789 spectrum 1 weight 0.10000E+01 volume 0.22650E-02 ppm1 3.367 ppm2 7.269 CV 1
ASSI { 3791}
(( segid " " and resid 15 and name HG12))
(( segid " " and resid 7 and name HE ))
4.500 2.600 1.500 peak 3791 spectrum 1 weight 0.10000E+01 volume 0.79974E-03 ppm1 1.260 ppm2 7.267 CV 1
ASSI { 3792}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 3792 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.662 ppm2 7.150 CV 1
ASSI { 3794}
(( segid " " and resid 28 and name HB3 ))
( segid " " and resid 21 and name HD1%)
4.100 2.100 1.900 peak 3794 spectrum 1 weight 0.10000E+01 volume 0.14929E-02 ppm1 2.569 ppm2 1.637 CV 1
ASSI { 3795}
(( segid " " and resid 52 and name HB3 ))
( segid " " and resid 66 and name HE% )
6.000 4.500 0.000 peak 3795 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.264 ppm2 7.161 CV 1
ASSI { 3796}
(( segid " " and resid 18 and name HB3 ))
( segid " " and resid 19 and name HD% )
6.000 4.500 0.000 peak 3796 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.261 ppm2 7.157 CV 1
ASSI { 3797}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HB3 ))
6.000 4.500 0.000 peak 3797 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.590 ppm2 1.267 CV 1
ASSI { 3798}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HD2 ))
6.000 4.500 0.000 peak 3798 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.592 ppm2 1.452 CV 1
ASSI { 3799}
(( segid " " and resid 107 and name HG2 ))
( segid " " and resid 105 and name HG2%)
6.000 4.500 0.000 peak 3799 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.595 ppm2 0.673 CV 1
ASSI { 3800}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 28 and name HZ3 ))
2.800 1.000 1.000 peak 3800 spectrum 1 weight 0.10000E+01 volume 0.15607E-01 ppm1 3.919 ppm2 6.902 CV 1
ASSI { 3802}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 5 and name HZ3 ))
6.000 4.500 0.000 peak 3802 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.015 ppm2 6.955 CV 1
OR { 3802}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 5 and name HZ3 ))
ASSI { 3803}
( segid " " and resid 23 and name HB% )
(( segid " " and resid 28 and name HD1 ))
6.000 4.500 0.000 peak 3803 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.020 ppm2 6.955 CV 1
ASSI { 3804}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 29 and name HN ))
6.000 4.500 0.000 peak 3804 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.459 ppm2 9.242 CV 1
ASSI { 3805}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 3805 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.305 ppm2 7.154 CV 1
ASSI { 3806}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 28 and name HE3 ))
6.000 4.500 0.000 peak 3806 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.603 ppm2 7.158 CV 1
ASSI { 3807}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 50 and name HD% )
3.800 1.800 1.800 peak 3807 spectrum 1 weight 0.10000E+01 volume 0.24850E-02 ppm1 1.770 ppm2 6.456 CV 1
OR { 3807}
(( segid " " and resid 102 and name HG2 ))
( segid " " and resid 50 and name HD% )
ASSI { 3808}
(( segid " " and resid 59 and name HG2 ))
( segid " " and resid 50 and name HE% )
6.000 4.500 0.000 peak 3808 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.603 ppm2 6.180 CV 1
ASSI { 3811}
( segid " " and resid 105 and name HD1%)
(( segid " " and resid 43 and name HN ))
3.900 1.900 1.900 peak 3811 spectrum 1 weight 0.10000E+01 volume 0.18734E-02 ppm1 0.311 ppm2 9.801 CV 1
ASSI { 3813}
(( segid " " and resid 108 and name HN ))
(( segid " " and resid 22 and name HN ))
4.700 2.700 1.300 peak 3813 spectrum 1 weight 0.10000E+01 volume 0.67383E-03 ppm1 9.144 ppm2 9.354 CV 1
ASSI { 3814}
(( segid " " and resid 110 and name HN ))
(( segid " " and resid 20 and name HN ))
3.700 3.700 2.300 peak 3814 spectrum 1 weight 0.10000E+01 volume 0.29084E-02 ppm1 8.805 ppm2 9.281 CV 1
ASSI { 3815}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 58 and name HN ))
4.400 2.400 1.600 peak 3815 spectrum 1 weight 0.10000E+01 volume 0.92288E-03 ppm1 8.348 ppm2 8.934 CV 1
OR { 3815}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 37 and name HN ))
ASSI { 3816}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 28 and name HN ))
5.000 3.200 1.000 peak 3816 spectrum 1 weight 0.10000E+01 volume 0.43308E-03 ppm1 8.544 ppm2 9.126 CV 1
OR { 3816}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 28 and name HN ))
ASSI { 3817}
(( segid " " and resid 7 and name HE ))
(( segid " " and resid 13 and name HN ))
5.100 3.200 0.900 peak 3817 spectrum 1 weight 0.10000E+01 volume 0.39987E-03 ppm1 7.257 ppm2 9.186 CV 1
ASSI { 3820}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 22 and name HN ))
6.000 4.500 0.000 peak 3820 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.384 ppm2 9.361 CV 1
ASSI { 3821}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 23 and name HN ))
5.200 3.400 0.800 peak 3821 spectrum 1 weight 0.10000E+01 volume 0.34176E-03 ppm1 6.359 ppm2 8.968 CV 1
ASSI { 3822}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 23 and name HN ))
6.000 4.500 0.000 peak 3822 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.385 ppm2 8.967 CV 1
ASSI { 3824}
(( segid " " and resid 102 and name HG2 ))
(( segid " " and resid 103 and name HN ))
4.000 2.000 2.000 peak 3824 spectrum 1 weight 0.10000E+01 volume 0.15856E-02 ppm1 1.744 ppm2 8.951 CV 1
ASSI { 3827}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 3827 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.176 ppm2 8.844 CV 1
ASSI { 3828}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 27 and name HN ))
3.000 3.000 3.000 peak 3828 spectrum 1 weight 0.10000E+01 volume 0.93755E-02 ppm1 7.218 ppm2 8.582 CV 1
ASSI { 3831}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 32 and name HN ))
4.700 2.800 1.300 peak 3831 spectrum 1 weight 0.10000E+01 volume 0.62817E-03 ppm1 3.519 ppm2 7.606 CV 1
ASSI { 3833}
(( segid " " and resid 34 and name HE3 ))
(( segid " " and resid 28 and name HH2 ))
5.400 3.700 0.600 peak 3833 spectrum 1 weight 0.10000E+01 volume 0.27396E-03 ppm1 3.089 ppm2 7.037 CV 1
OR { 3833}
(( segid " " and resid 34 and name HE2 ))
(( segid " " and resid 28 and name HH2 ))
ASSI { 3834}
(( segid " " and resid 18 and name HD3 ))
(( segid " " and resid 19 and name HZ ))
3.700 1.700 1.700 peak 3834 spectrum 1 weight 0.10000E+01 volume 0.28434E-02 ppm1 2.822 ppm2 7.247 CV 1
OR { 3834}
(( segid " " and resid 18 and name HD2 ))
(( segid " " and resid 19 and name HZ ))
ASSI { 3836}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 19 and name HZ ))
4.900 3.100 1.100 peak 3836 spectrum 1 weight 0.10000E+01 volume 0.47735E-03 ppm1 1.923 ppm2 7.247 CV 1
OR { 3836}
(( segid " " and resid 109 and name HB2 ))
(( segid " " and resid 19 and name HZ ))
ASSI { 3837}
(( segid " " and resid 109 and name HG2 ))
( segid " " and resid 19 and name HE% )
4.400 2.400 1.600 peak 3837 spectrum 1 weight 0.10000E+01 volume 0.10239E-02 ppm1 2.010 ppm2 7.299 CV 1
OR { 3837}
(( segid " " and resid 109 and name HG3 ))
( segid " " and resid 19 and name HE% )
ASSI { 3838}
(( segid " " and resid 109 and name HB3 ))
( segid " " and resid 19 and name HE% )
4.400 2.500 1.600 peak 3838 spectrum 1 weight 0.10000E+01 volume 0.91735E-03 ppm1 1.916 ppm2 7.299 CV 1
OR { 3838}
(( segid " " and resid 109 and name HB2 ))
( segid " " and resid 19 and name HE% )
ASSI { 3840}
(( segid " " and resid 65 and name HB2 ))
( segid " " and resid 66 and name HD% )
3.000 1.100 1.100 peak 3840 spectrum 1 weight 0.10000E+01 volume 0.92205E-02 ppm1 1.290 ppm2 7.006 CV 1
ASSI { 3841}
( segid " " and resid 63 and name HD1%)
( segid " " and resid 97 and name HD% )
3.100 1.200 1.200 peak 3841 spectrum 1 weight 0.10000E+01 volume 0.80071E-02 ppm1 0.818 ppm2 7.277 CV 1
ASSI { 3842}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 28 and name HZ3 ))
3.400 1.400 1.400 peak 3842 spectrum 1 weight 0.10000E+01 volume 0.48814E-02 ppm1 0.782 ppm2 6.901 CV 1
ASSI { 3843}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 28 and name HD1 ))
4.000 2.000 2.000 peak 3843 spectrum 1 weight 0.10000E+01 volume 0.15787E-02 ppm1 0.405 ppm2 6.956 CV 1
OR { 3843}
(( segid " " and resid 105 and name HG13))
(( segid " " and resid 28 and name HD1 ))
OR { 3843}
(( segid " " and resid 105 and name HG12))
(( segid " " and resid 28 and name HD1 ))
OR { 3843}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 33 and name HN ))
ASSI { 3844}
(( segid " " and resid 21 and name HG ))
( segid " " and resid 22 and name HE% )
5.000 3.100 1.000 peak 3844 spectrum 1 weight 0.10000E+01 volume 0.44691E-03 ppm1 0.856 ppm2 6.710 CV 1
OR { 3844}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 22 and name HE% )
ASSI { 3845}
(( segid " " and resid 6 and name HE2 ))
( segid " " and resid 22 and name HE% )
2.900 2.900 3.100 peak 3845 spectrum 1 weight 0.10000E+01 volume 0.11364E-01 ppm1 2.448 ppm2 6.709 CV 1
OR { 3845}
(( segid " " and resid 6 and name HE3 ))
( segid " " and resid 22 and name HE% )
ASSI { 3846}
(( segid " " and resid 52 and name HE2 ))
( segid " " and resid 62 and name HE% )
4.300 2.300 1.700 peak 3846 spectrum 1 weight 0.10000E+01 volume 0.11304E-02 ppm1 2.578 ppm2 6.413 CV 1
OR { 3846}
(( segid " " and resid 52 and name HE3 ))
( segid " " and resid 62 and name HE% )
ASSI { 3848}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 22 and name HE% )
3.600 1.600 1.600 peak 3848 spectrum 1 weight 0.10000E+01 volume 0.33761E-02 ppm1 2.909 ppm2 6.710 CV 1
OR { 3848}
(( segid " " and resid 107 and name HD2 ))
( segid " " and resid 22 and name HE% )
ASSI { 3849}
(( segid " " and resid 59 and name HD2 ))
( segid " " and resid 50 and name HD% )
3.100 1.200 1.200 peak 3849 spectrum 1 weight 0.10000E+01 volume 0.77123E-02 ppm1 3.186 ppm2 6.455 CV 1
OR { 3849}
(( segid " " and resid 59 and name HD3 ))
( segid " " and resid 50 and name HD% )
ASSI { 3850}
(( segid " " and resid 101 and name HB2 ))
( segid " " and resid 62 and name HE% )
3.600 3.600 2.400 peak 3850 spectrum 1 weight 0.10000E+01 volume 0.31187E-02 ppm1 3.289 ppm2 6.412 CV 1
ASSI { 3851}
(( segid " " and resid 67 and name HA1 ))
( segid " " and resid 62 and name HD% )
4.200 2.200 1.800 peak 3851 spectrum 1 weight 0.10000E+01 volume 0.11996E-02 ppm1 3.975 ppm2 6.522 CV 1
ASSI { 3856}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 34 and name HA ))
3.700 1.700 1.700 peak 3856 spectrum 1 weight 0.10000E+01 volume 0.25403E-02 ppm1 4.229 ppm2 5.282 CV 1
OR { 3856}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 34 and name HA ))
ASSI { 3857}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 27 and name HA ))
4.300 2.300 1.700 peak 3857 spectrum 1 weight 0.10000E+01 volume 0.10806E-02 ppm1 3.491 ppm2 5.604 CV 1
OR { 3857}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 22 and name HA ))
OR { 3857}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 27 and name HA ))
OR { 3857}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 21 and name HA ))
ASSI { 3859}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 42 and name HA ))
4.900 2.900 1.100 peak 3859 spectrum 1 weight 0.10000E+01 volume 0.53270E-03 ppm1 4.483 ppm2 3.791 CV 1
OR { 3859}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 37 and name HB2 ))
ASSI { 3860}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HA ))
5.300 3.600 0.700 peak 3860 spectrum 1 weight 0.10000E+01 volume 0.29748E-03 ppm1 4.461 ppm2 3.766 CV 1
ASSI { 3862}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 34 and name HE2 ))
5.000 3.100 1.000 peak 3862 spectrum 1 weight 0.10000E+01 volume 0.46075E-03 ppm1 3.877 ppm2 3.065 CV 1
OR { 3862}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 34 and name HE3 ))
OR { 3862}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 34 and name HE2 ))
OR { 3862}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 34 and name HE3 ))
ASSI { 3864}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 7 and name HD2 ))
4.500 2.500 1.500 peak 3864 spectrum 1 weight 0.10000E+01 volume 0.87030E-03 ppm1 3.349 ppm2 3.071 CV 1
OR { 3864}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 7 and name HD3 ))
ASSI { 3865}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 7 and name HD2 ))
5.400 3.600 0.600 peak 3865 spectrum 1 weight 0.10000E+01 volume 0.29333E-03 ppm1 4.586 ppm2 3.082 CV 1
OR { 3865}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 7 and name HD3 ))
OR { 3865}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 34 and name HE2 ))
ASSI { 3866}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HB2 ))
4.800 2.900 1.200 peak 3866 spectrum 1 weight 0.10000E+01 volume 0.55345E-03 ppm1 5.613 ppm2 3.488 CV 1
OR { 3866}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 28 and name HB2 ))
OR { 3866}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 26 and name HB3 ))
ASSI { 3868}
(( segid " " and resid 106 and name HB ))
(( segid " " and resid 22 and name HB2 ))
4.900 2.900 1.100 peak 3868 spectrum 1 weight 0.10000E+01 volume 0.53270E-03 ppm1 4.256 ppm2 2.905 CV 1
ASSI { 3869}
(( segid " " and resid 106 and name HB ))
(( segid " " and resid 22 and name HB3 ))
4.000 2.000 2.000 peak 3869 spectrum 1 weight 0.10000E+01 volume 0.17268E-02 ppm1 4.262 ppm2 2.677 CV 1
ASSI { 3874}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 99 and name HB2 ))
4.700 2.700 1.300 peak 3874 spectrum 1 weight 0.10000E+01 volume 0.67106E-03 ppm1 3.169 ppm2 2.790 CV 1
OR { 3874}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 99 and name HB2 ))
ASSI { 3875}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 80 and name HB2 ))
4.700 2.700 1.300 peak 3875 spectrum 1 weight 0.10000E+01 volume 0.66829E-03 ppm1 3.169 ppm2 2.766 CV 1
OR { 3875}
(( segid " " and resid 59 and name HD3 ))
(( segid " " and resid 80 and name HB3 ))
OR { 3875}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 80 and name HB2 ))
ASSI { 3876}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 57 and name HB3 ))
4.800 2.900 1.200 peak 3876 spectrum 1 weight 0.10000E+01 volume 0.56867E-03 ppm1 2.429 ppm2 1.975 CV 1
ASSI { 3877}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 96 and name HB3 ))
4.400 2.400 1.600 peak 3877 spectrum 1 weight 0.10000E+01 volume 0.95055E-03 ppm1 4.329 ppm2 1.882 CV 1
ASSI { 3880}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 104 and name HB2 ))
3.200 3.200 2.800 peak 3880 spectrum 1 weight 0.10000E+01 volume 0.65210E-02 ppm1 4.001 ppm2 1.648 CV 1
OR { 3880}
(( segid " " and resid 30 and name HB3 ))
( segid " " and resid 21 and name HD1%)
ASSI { 3881}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 102 and name HG2 ))
5.400 3.700 0.600 peak 3881 spectrum 1 weight 0.10000E+01 volume 0.27673E-03 ppm1 3.665 ppm2 1.759 CV 1
ASSI { 3886}
(( segid " " and resid 107 and name HD3 ))
(( segid " " and resid 112 and name HB3 ))
5.300 3.600 0.700 peak 3886 spectrum 1 weight 0.10000E+01 volume 0.30301E-03 ppm1 2.910 ppm2 1.771 CV 1
OR { 3886}
(( segid " " and resid 107 and name HD3 ))
(( segid " " and resid 112 and name HB2 ))
OR { 3886}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 112 and name HB3 ))
ASSI { 3891}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 106 and name HG2%)
6.000 4.500 0.000 peak 3891 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.903 ppm2 1.311 CV 1
ASSI { 3892}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 105 and name HB ))
4.800 2.800 1.200 peak 3892 spectrum 1 weight 0.10000E+01 volume 0.60326E-03 ppm1 3.368 ppm2 1.407 CV 1
ASSI { 3895}
(( segid " " and resid 6 and name HD2 ))
( segid " " and resid 20 and name HD2%)
3.800 1.800 1.800 peak 3895 spectrum 1 weight 0.10000E+01 volume 0.24878E-02 ppm1 1.200 ppm2 0.767 CV 1
OR { 3895}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 20 and name HD2%)
OR { 3895}
( segid " " and resid 47 and name HG2%)
( segid " " and resid 42 and name HD1%)
OR { 3895}
( segid " " and resid 16 and name HB% )
( segid " " and resid 20 and name HD2%)
ASSI { 3896}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 45 and name HG13))
4.700 2.800 1.300 peak 3896 spectrum 1 weight 0.10000E+01 volume 0.63647E-03 ppm1 2.024 ppm2 1.210 CV 1
OR { 3896}
(( segid " " and resid 89 and name HB2 ))
( segid " " and resid 91 and name HG2%)
ASSI { 3900}
(( segid " " and resid 24 and name HB3 ))
( segid " " and resid 51 and name HG2%)
3.500 1.600 1.600 peak 3900 spectrum 1 weight 0.10000E+01 volume 0.36196E-02 ppm1 2.283 ppm2 1.095 CV 1
OR { 3900}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 42 and name HB3 ))
ASSI { 3901}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 20 and name HD1%)
4.700 2.800 1.300 peak 3901 spectrum 1 weight 0.10000E+01 volume 0.61848E-03 ppm1 2.580 ppm2 0.985 CV 1
OR { 3901}
(( segid " " and resid 28 and name HB3 ))
( segid " " and resid 20 and name HD1%)
ASSI { 3902}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 6 and name HD2 ))
3.900 1.900 1.900 peak 3902 spectrum 1 weight 0.10000E+01 volume 0.18790E-02 ppm1 2.700 ppm2 1.188 CV 1
OR { 3902}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 6 and name HD2 ))
OR { 3902}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 21 and name HB2 ))
OR { 3902}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 21 and name HB2 ))
ASSI { 3903}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 57 and name HD2%)
4.700 2.800 1.300 peak 3903 spectrum 1 weight 0.10000E+01 volume 0.64062E-03 ppm1 2.657 ppm2 1.173 CV 1
OR { 3903}
(( segid " " and resid 62 and name HB3 ))
( segid " " and resid 57 and name HD1%)
ASSI { 3907}
(( segid " " and resid 59 and name HD3 ))
( segid " " and resid 63 and name HD1%)
3.400 1.500 1.500 peak 3907 spectrum 1 weight 0.10000E+01 volume 0.42934E-02 ppm1 3.189 ppm2 0.823 CV 1
OR { 3907}
(( segid " " and resid 59 and name HD2 ))
( segid " " and resid 63 and name HD1%)
ASSI { 3908}
(( segid " " and resid 110 and name HB2 ))
(( segid " " and resid 18 and name HG3 ))
3.200 1.300 1.300 peak 3908 spectrum 1 weight 0.10000E+01 volume 0.60506E-02 ppm1 3.190 ppm2 0.769 CV 1
ASSI { 3909}
(( segid " " and resid 58 and name HB3 ))
( segid " " and resid 45 and name HD1%)
3.700 1.700 1.700 peak 3909 spectrum 1 weight 0.10000E+01 volume 0.26344E-02 ppm1 2.821 ppm2 0.860 CV 1
OR { 3909}
(( segid " " and resid 35 and name HB3 ))
( segid " " and resid 45 and name HD1%)
ASSI { 3910}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 21 and name HG ))
5.200 3.400 0.800 peak 3910 spectrum 1 weight 0.10000E+01 volume 0.35836E-03 ppm1 2.902 ppm2 0.864 CV 1
OR { 3910}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 21 and name HG ))
OR { 3910}
(( segid " " and resid 107 and name HD3 ))
(( segid " " and resid 21 and name HG ))
ASSI { 3911}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 52 and name HG2 ))
3.500 1.500 1.500 peak 3911 spectrum 1 weight 0.10000E+01 volume 0.40983E-02 ppm1 4.002 ppm2 0.947 CV 1
OR { 3911}
(( segid " " and resid 30 and name HB3 ))
( segid " " and resid 21 and name HD2%)
ASSI { 3912}
(( segid " " and resid 30 and name HB3 ))
( segid " " and resid 15 and name HG2%)
3.800 3.800 2.200 peak 3912 spectrum 1 weight 0.10000E+01 volume 0.22235E-02 ppm1 4.001 ppm2 0.864 CV 1
OR { 3912}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 21 and name HG ))
ASSI { 3914}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 45 and name HD1%)
4.700 2.700 1.300 peak 3914 spectrum 1 weight 0.10000E+01 volume 0.66691E-03 ppm1 3.798 ppm2 0.858 CV 1
ASSI { 3915}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 23 and name HB% )
2.900 1.100 1.100 peak 3915 spectrum 1 weight 0.10000E+01 volume 0.11048E-01 ppm1 4.354 ppm2 1.025 CV 1
ASSI { 3916}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 15 and name HD1%)
4.600 2.600 1.400 peak 3916 spectrum 1 weight 0.10000E+01 volume 0.75823E-03 ppm1 5.601 ppm2 0.409 CV 1
OR { 3916}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 15 and name HD1%)
OR { 3916}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 15 and name HD1%)
ASSI { 3919}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 42 and name HD1%)
5.100 3.200 0.900 peak 3919 spectrum 1 weight 0.10000E+01 volume 0.41094E-03 ppm1 4.235 ppm2 0.766 CV 1
OR { 3919}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 20 and name HD2%)
OR { 3919}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 42 and name HD1%)
OR { 3919}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 20 and name HD2%)
ASSI { 3920}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 15 and name HD1%)
3.500 1.500 1.500 peak 3920 spectrum 1 weight 0.10000E+01 volume 0.37427E-02 ppm1 4.244 ppm2 0.414 CV 1
OR { 3920}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 42 and name HD2%)
ASSI { 3921}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 42 and name HD2%)
5.100 3.200 0.900 peak 3921 spectrum 1 weight 0.10000E+01 volume 0.40955E-03 ppm1 4.155 ppm2 0.414 CV 1
OR { 3921}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 42 and name HD2%)
OR { 3921}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 105 and name HG13))
ASSI { 3922}
(( segid " " and resid 46 and name HA1 ))
( segid " " and resid 105 and name HD1%)
5.100 3.200 0.900 peak 3922 spectrum 1 weight 0.10000E+01 volume 0.40540E-03 ppm1 4.289 ppm2 0.317 CV 1
OR { 3922}
(( segid " " and resid 106 and name HB ))
( segid " " and resid 105 and name HD1%)
ASSI { 3923}
(( segid " " and resid 43 and name HA2 ))
( segid " " and resid 105 and name HD1%)
3.500 1.500 1.500 peak 3923 spectrum 1 weight 0.10000E+01 volume 0.38036E-02 ppm1 3.608 ppm2 0.317 CV 1
ASSI { 3924}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 42 and name HD1%)
3.200 1.300 1.300 peak 3924 spectrum 1 weight 0.10000E+01 volume 0.67175E-02 ppm1 3.492 ppm2 0.766 CV 1
OR { 3924}
(( segid " " and resid 58 and name HB2 ))
( segid " " and resid 42 and name HD1%)
ASSI { 3928}
( segid " " and resid 56 and name HD1%)
( segid " " and resid 33 and name HD2%)
4.400 2.400 1.600 peak 3928 spectrum 1 weight 0.10000E+01 volume 0.96301E-03 ppm1 0.786 ppm2 -0.815 CV 1
ASSI { 3929}
( segid " " and resid 104 and name HD2%)
( segid " " and resid 33 and name HD2%)
6.000 4.500 0.000 peak 3929 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.835 ppm2 -0.815 CV 1
ASSI { 3930}
(( segid " " and resid 34 and name HE3 ))
(( segid " " and resid 34 and name HD2 ))
6.000 4.500 0.000 peak 3930 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.078 ppm2 1.698 CV 1
OR { 3930}
(( segid " " and resid 34 and name HE2 ))
(( segid " " and resid 34 and name HD3 ))
OR { 3930}
(( segid " " and resid 34 and name HE3 ))
(( segid " " and resid 34 and name HD3 ))
OR { 3930}
(( segid " " and resid 34 and name HE2 ))
(( segid " " and resid 34 and name HD2 ))
ASSI { 3931}
(( segid " " and resid 34 and name HE2 ))
(( segid " " and resid 34 and name HB3 ))
6.000 4.500 0.000 peak 3931 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.077 ppm2 1.266 CV 1
OR { 3931}
(( segid " " and resid 34 and name HE3 ))
(( segid " " and resid 34 and name HB3 ))
ASSI { 3932}
(( segid " " and resid 34 and name HE2 ))
(( segid " " and resid 34 and name HG2 ))
6.000 4.500 0.000 peak 3932 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.071 ppm2 1.110 CV 1
OR { 3932}
(( segid " " and resid 34 and name HE3 ))
(( segid " " and resid 34 and name HG2 ))
ASSI { 3933}
(( segid " " and resid 34 and name HE2 ))
(( segid " " and resid 34 and name HG3 ))
6.000 4.500 0.000 peak 3933 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.071 ppm2 1.070 CV 1
OR { 3933}
(( segid " " and resid 34 and name HE3 ))
(( segid " " and resid 34 and name HG3 ))
ASSI { 3934}
(( segid " " and resid 64 and name HG3 ))
(( segid " " and resid 64 and name HN ))
6.000 4.500 0.000 peak 3934 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.390 ppm2 7.834 CV 1
ASSI { 3935}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 64 and name HN ))
6.000 4.500 0.000 peak 3935 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.066 ppm2 7.835 CV 1
OR { 3935}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 64 and name HN ))
ASSI { 3936}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 64 and name HG3 ))
6.000 4.500 0.000 peak 3936 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.868 ppm2 1.388 CV 1
ASSI { 3937}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HG3 ))
6.000 4.500 0.000 peak 3937 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.946 ppm2 1.388 CV 1
ASSI { 3938}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 64 and name HG3 ))
6.000 4.500 0.000 peak 3938 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.572 ppm2 1.388 CV 1
ASSI { 3939}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HG3 ))
6.000 4.500 0.000 peak 3939 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.897 ppm2 1.395 CV 1
ASSI { 3940}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 64 and name HB2 ))
6.000 4.500 0.000 peak 3940 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.064 ppm2 1.950 CV 1
OR { 3940}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 64 and name HB2 ))
ASSI { 3941}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 64 and name HG2 ))
6.000 4.500 0.000 peak 3941 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.065 ppm2 1.576 CV 1
OR { 3941}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 64 and name HG2 ))
ASSI { 3942}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 64 and name HG3 ))
6.000 4.500 0.000 peak 3942 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.065 ppm2 1.388 CV 1
OR { 3942}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 64 and name HG3 ))
ASSI { 3943}
(( segid " " and resid 64 and name HD3 ))
(( segid " " and resid 64 and name HB3 ))
6.000 4.500 0.000 peak 3943 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.066 ppm2 1.875 CV 1
OR { 3943}
(( segid " " and resid 64 and name HD2 ))
(( segid " " and resid 64 and name HB3 ))
ASSI { 3944}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 43 and name HN ))
4.500 2.500 1.500 peak 3944 spectrum 1 weight 0.10000E+01 volume 0.84540E-03 ppm1 0.936 ppm2 9.802 CV 1
OR { 3944}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 43 and name HN ))
ASSI { 3945}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 36 and name HN ))
4.000 2.100 2.000 peak 3945 spectrum 1 weight 0.10000E+01 volume 0.15746E-02 ppm1 8.325 ppm2 10.176 CV 1
ASSI { 3946}
(( segid " " and resid 6 and name HE2 ))
( segid " " and resid 22 and name HD% )
4.800 2.900 1.200 peak 3946 spectrum 1 weight 0.10000E+01 volume 0.56314E-03 ppm1 2.446 ppm2 7.223 CV 1
OR { 3946}
(( segid " " and resid 6 and name HE3 ))
( segid " " and resid 22 and name HD% )
ASSI { 3947}
( segid " " and resid 15 and name HD1%)
( segid " " and resid 22 and name HD% )
3.500 3.500 2.500 peak 3947 spectrum 1 weight 0.10000E+01 volume 0.39516E-02 ppm1 0.403 ppm2 7.223 CV 1
OR { 3947}
(( segid " " and resid 105 and name HG13))
( segid " " and resid 22 and name HD% )
ASSI { 3948}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 62 and name HD% )
3.600 1.600 1.600 peak 3948 spectrum 1 weight 0.10000E+01 volume 0.32211E-02 ppm1 1.968 ppm2 6.521 CV 1
OR { 3948}
(( segid " " and resid 57 and name HB3 ))
( segid " " and resid 62 and name HD% )
ASSI { 3949}
( segid " " and resid 55 and name HE% )
(( segid " " and resid 66 and name HZ ))
4.300 2.300 1.700 peak 3949 spectrum 1 weight 0.10000E+01 volume 0.11373E-02 ppm1 2.227 ppm2 7.095 CV 1
ASSI { 3952}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 106 and name HN ))
4.900 3.000 1.100 peak 3952 spectrum 1 weight 0.10000E+01 volume 0.52855E-03 ppm1 2.889 ppm2 9.064 CV 1
ASSI { 3955}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 51 and name HN ))
5.800 4.200 0.200 peak 3955 spectrum 1 weight 0.10000E+01 volume 0.18679E-03 ppm1 6.170 ppm2 8.567 CV 1
ASSI { 3959}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 100 and name HN ))
4.700 2.800 1.300 peak 3959 spectrum 1 weight 0.10000E+01 volume 0.61710E-03 ppm1 4.558 ppm2 8.890 CV 1
ASSI { 3960}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 27 and name HN ))
3.600 1.600 1.600 peak 3960 spectrum 1 weight 0.10000E+01 volume 0.30661E-02 ppm1 0.227 ppm2 8.580 CV 1
ASSI { 3961}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 9 and name HN ))
3.300 1.400 1.400 peak 3961 spectrum 1 weight 0.10000E+01 volume 0.54169E-02 ppm1 0.404 ppm2 8.745 CV 1
ASSI { 3962}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 3962 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.193 ppm2 8.368 CV 1
ASSI { 3963}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 44 and name HN ))
5.600 4.000 0.400 peak 3963 spectrum 1 weight 0.10000E+01 volume 0.22000E-03 ppm1 2.163 ppm2 7.562 CV 1
OR { 3963}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 44 and name HN ))
ASSI { 3964}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 28 and name HE3 ))
3.200 1.200 1.200 peak 3964 spectrum 1 weight 0.10000E+01 volume 0.70911E-02 ppm1 0.501 ppm2 7.156 CV 1
OR { 3964}
(( segid " " and resid 52 and name HG3 ))
( segid " " and resid 66 and name HE% )
ASSI { 3965}
( segid " " and resid 19 and name HD% )
(( segid " " and resid 19 and name HZ ))
6.000 4.500 0.000 peak 3965 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.146 ppm2 7.249 CV 1
ASSI { 3968}
( segid " " and resid 66 and name HD% )
(( segid " " and resid 66 and name HZ ))
6.000 4.500 0.000 peak 3968 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.001 ppm2 7.095 CV 1
ASSI { 3971}
( segid " " and resid 108 and name HD1%)
( segid " " and resid 22 and name HE% )
3.400 1.400 1.400 peak 3971 spectrum 1 weight 0.10000E+01 volume 0.45466E-02 ppm1 0.949 ppm2 6.710 CV 1
OR { 3971}
( segid " " and resid 108 and name HD2%)
( segid " " and resid 22 and name HE% )
ASSI { 3972}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 28 and name HD1 ))
4.400 2.400 1.600 peak 3972 spectrum 1 weight 0.10000E+01 volume 0.99345E-03 ppm1 1.849 ppm2 6.954 CV 1
ASSI { 3973}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 33 and name HD1%)
4.000 2.000 2.000 peak 3973 spectrum 1 weight 0.10000E+01 volume 0.17600E-02 ppm1 1.188 ppm2 0.005 CV 1
ASSI { 3976}
( segid " " and resid 57 and name HD2%)
( segid " " and resid 65 and name HD1%)
2.800 1.000 1.000 peak 3976 spectrum 1 weight 0.10000E+01 volume 0.13919E-01 ppm1 1.162 ppm2 0.699 CV 1
OR { 3976}
( segid " " and resid 57 and name HD1%)
( segid " " and resid 65 and name HD1%)
ASSI { 3977}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 42 and name HD2%)
3.400 1.400 1.400 peak 3977 spectrum 1 weight 0.10000E+01 volume 0.45950E-02 ppm1 4.639 ppm2 0.416 CV 1
ASSI { 3978}
(( segid " " and resid 106 and name HA ))
( segid " " and resid 105 and name HG2%)
4.500 2.600 1.500 peak 3978 spectrum 1 weight 0.10000E+01 volume 0.81081E-03 ppm1 4.639 ppm2 0.672 CV 1
ASSI { 3981}
(( segid " " and resid 58 and name HB3 ))
( segid " " and resid 42 and name HD2%)
3.700 1.700 1.700 peak 3981 spectrum 1 weight 0.10000E+01 volume 0.26192E-02 ppm1 2.820 ppm2 0.415 CV 1
ASSI { 3982}
(( segid " " and resid 51 and name HB ))
( segid " " and resid 50 and name HD% )
3.700 3.700 2.300 peak 3982 spectrum 1 weight 0.10000E+01 volume 0.28281E-02 ppm1 3.991 ppm2 6.453 CV 1
ASSI { 3983}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 57 and name HA ))
4.000 2.000 2.000 peak 3983 spectrum 1 weight 0.10000E+01 volume 0.17157E-02 ppm1 2.812 ppm2 6.171 CV 1
OR { 3983}
(( segid " " and resid 99 and name HB2 ))
( segid " " and resid 50 and name HE% )
OR { 3983}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 57 and name HA ))
ASSI { 3984}
( segid " " and resid 57 and name HD2%)
( segid " " and resid 66 and name HD% )
3.000 1.100 1.100 peak 3984 spectrum 1 weight 0.10000E+01 volume 0.93118E-02 ppm1 1.168 ppm2 7.007 CV 1
ASSI { 3986}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 49 and name HB3 ))
4.700 2.700 1.300 peak 3986 spectrum 1 weight 0.10000E+01 volume 0.67106E-03 ppm1 4.354 ppm2 3.376 CV 1
ASSI { 3987}
(( segid " " and resid 24 and name HG2 ))
( segid " " and resid 23 and name HB% )
3.100 1.200 1.200 peak 3987 spectrum 1 weight 0.10000E+01 volume 0.74951E-02 ppm1 2.429 ppm2 1.028 CV 1
OR { 3987}
(( segid " " and resid 24 and name HG3 ))
( segid " " and resid 23 and name HB% )
ASSI { 3988}
(( segid " " and resid 6 and name HE2 ))
( segid " " and resid 20 and name HD1%)
3.300 1.400 1.400 peak 3988 spectrum 1 weight 0.10000E+01 volume 0.49811E-02 ppm1 2.429 ppm2 0.988 CV 1
OR { 3988}
(( segid " " and resid 6 and name HE3 ))
( segid " " and resid 20 and name HD1%)
ASSI { 3989}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 27 and name HD% )
4.300 2.400 1.700 peak 3989 spectrum 1 weight 0.10000E+01 volume 0.10267E-02 ppm1 4.465 ppm2 6.377 CV 1
ASSI { 3990}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 108 and name HN ))
3.600 1.700 1.700 peak 3990 spectrum 1 weight 0.10000E+01 volume 0.29610E-02 ppm1 0.858 ppm2 9.152 CV 1
ASSI { 3991}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 108 and name HN ))
4.900 3.000 1.100 peak 3991 spectrum 1 weight 0.10000E+01 volume 0.48565E-03 ppm1 0.757 ppm2 9.151 CV 1
ASSI { 3992}
( segid " " and resid 20 and name HD2%)
(( segid " " and resid 28 and name HN ))
5.100 3.200 0.900 peak 3992 spectrum 1 weight 0.10000E+01 volume 0.39849E-03 ppm1 0.758 ppm2 9.133 CV 1
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