NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
476564 |
2kos   |
16528 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 1}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 66 and name HD2%)
2.800 1.000 1.000 peak 1 spectrum 1 weight 0.10000E+01 volume 0.29724E-02 ppm1 4.098 ppm2 0.604 CV 1
OR { 1}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 76 and name HD1%)
OR { 1}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 40 and name H8% )
ASSI { 3}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 66 and name HB2 ))
3.700 1.700 1.700 peak 3 spectrum 1 weight 0.10000E+01 volume 0.17531E-02 ppm1 4.094 ppm2 0.930 CV 1
OR { 3}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 76 and name HG12))
OR { 3}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 40 and name H7A ))
ASSI { 16}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 32 and name HZ ))
3.100 1.200 1.200 peak 16 spectrum 1 weight 0.10000E+01 volume 0.18535E-02 ppm1 1.602 ppm2 6.863 CV 1
OR { 16}
( segid " " and resid 72 and name HB% )
( segid " " and resid 75 and name HD% )
ASSI { 22}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HB1 ))
2.700 0.900 0.900 peak 22 spectrum 1 weight 0.10000E+01 volume 0.40671E-02 ppm1 4.319 ppm2 2.640 CV 1
OR { 22}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 25 and name HB1 ))
ASSI { 31}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 17 and name HN ))
3.400 1.500 1.500 peak 31 spectrum 1 weight 0.10000E+01 volume 0.30553E-03 ppm1 0.819 ppm2 8.357 CV 1
OR { 31}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 42 and name HN ))
OR { 31}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 29 and name HN ))
ASSI { 34}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HG2%)
2.600 0.800 0.800 peak 34 spectrum 1 weight 0.10000E+01 volume 0.37053E-02 ppm1 4.309 ppm2 0.994 CV 1
OR { 34}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 41 and name HD2%)
ASSI { 35}
( segid " " and resid 72 and name HB% )
( segid " " and resid 11 and name HD1%)
2.700 0.900 0.900 peak 35 spectrum 1 weight 0.10000E+01 volume 0.34080E-02 ppm1 1.600 ppm2 0.850 CV 1
OR { 35}
( segid " " and resid 72 and name HB% )
( segid " " and resid 11 and name HD2%)
OR { 35}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 58 and name HG12))
ASSI { 40}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 26 and name HG2%)
2.800 1.000 1.000 peak 40 spectrum 1 weight 0.10000E+01 volume 0.41306E-02 ppm1 4.045 ppm2 0.921 CV 1
OR { 40}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 8 and name HG1%)
OR { 40}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 11 and name HD2%)
ASSI { 42}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 26 and name HB ))
3.600 1.600 1.600 peak 42 spectrum 1 weight 0.10000E+01 volume 0.18688E-02 ppm1 4.046 ppm2 2.324 CV 1
OR { 42}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HG2 ))
OR { 42}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HB1 ))
OR { 42}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 36 and name HB1 ))
OR { 42}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 43 and name HG1 ))
ASSI { 54}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 26 and name HB ))
2.800 1.000 1.000 peak 54 spectrum 1 weight 0.10000E+01 volume 0.37703E-02 ppm1 1.676 ppm2 2.324 CV 1
OR { 54}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 13 and name HG2 ))
OR { 54}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 13 and name HB1 ))
ASSI { 56}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 23 and name HB ))
3.700 1.700 1.700 peak 56 spectrum 1 weight 0.10000E+01 volume 0.14013E-02 ppm1 1.666 ppm2 2.014 CV 1
OR { 56}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 11 and name HG ))
OR { 56}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 8 and name HB ))
OR { 56}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 14 and name HG11))
OR { 56}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 30 and name HB1 ))
ASSI { 57}
( segid " " and resid 12 and name HB% )
( segid " " and resid 26 and name HG2%)
2.500 0.800 0.800 peak 57 spectrum 1 weight 0.10000E+01 volume 0.46256E-02 ppm1 1.674 ppm2 0.952 CV 1
OR { 57}
( segid " " and resid 12 and name HB% )
( segid " " and resid 23 and name HG1%)
OR { 57}
( segid " " and resid 12 and name HB% )
( segid " " and resid 15 and name HG1%)
ASSI { 58}
( segid " " and resid 12 and name HB% )
( segid " " and resid 26 and name HG1%)
3.100 1.200 1.200 peak 58 spectrum 1 weight 0.10000E+01 volume 0.24738E-02 ppm1 1.680 ppm2 0.732 CV 1
OR { 58}
( segid " " and resid 12 and name HB% )
( segid " " and resid 36 and name HD2%)
ASSI { 63}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 80 and name HE22))
3.700 1.700 1.700 peak 63 spectrum 1 weight 0.10000E+01 volume 0.99373E-03 ppm1 1.560 ppm2 7.689 CV 1
OR { 63}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 6 and name HN ))
ASSI { 68}
( segid " " and resid 2 and name HB% )
( segid " " and resid 7 and name HD1%)
2.600 0.800 0.800 peak 68 spectrum 1 weight 0.10000E+01 volume 0.30599E-02 ppm1 1.563 ppm2 0.526 CV 1
OR { 68}
( segid " " and resid 2 and name HB% )
( segid " " and resid 76 and name HG2%)
OR { 68}
( segid " " and resid 2 and name HB% )
( segid " " and resid 7 and name HG2%)
ASSI { 78}
( segid " " and resid 1 and name HB% )
(( segid " " and resid 80 and name HG2 ))
3.400 1.400 1.400 peak 78 spectrum 1 weight 0.10000E+01 volume 0.15690E-02 ppm1 1.511 ppm2 2.563 CV 1
OR { 78}
( segid " " and resid 1 and name HB% )
(( segid " " and resid 55 and name HB2 ))
ASSI { 108}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 7 and name HN ))
3.500 1.500 1.500 peak 108 spectrum 1 weight 0.10000E+01 volume 0.11494E-02 ppm1 3.690 ppm2 8.403 CV 1
OR { 108}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 8 and name HN ))
ASSI { 110}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 77 and name HD2%)
3.000 1.200 1.200 peak 110 spectrum 1 weight 0.10000E+01 volume 0.21814E-02 ppm1 3.696 ppm2 0.811 CV 1
OR { 110}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 77 and name HD1%)
OR { 110}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 28 and name HD1%)
OR { 110}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 11 and name HD1%)
ASSI { 117}
(( segid " " and resid 4 and name HG2 ))
( segid " " and resid 73 and name HG2%)
3.400 1.400 1.400 peak 117 spectrum 1 weight 0.10000E+01 volume 0.10106E-02 ppm1 2.211 ppm2 1.076 CV 1
OR { 117}
(( segid " " and resid 4 and name HG1 ))
( segid " " and resid 73 and name HG2%)
OR { 117}
(( segid " " and resid 4 and name HG1 ))
( segid " " and resid 8 and name HG2%)
OR { 117}
(( segid " " and resid 4 and name HG2 ))
( segid " " and resid 8 and name HG2%)
ASSI { 118}
(( segid " " and resid 4 and name HG2 ))
( segid " " and resid 73 and name HG2%)
3.600 1.600 1.600 peak 118 spectrum 1 weight 0.10000E+01 volume 0.91470E-03 ppm1 2.159 ppm2 1.083 CV 1
OR { 118}
(( segid " " and resid 4 and name HG2 ))
( segid " " and resid 8 and name HG2%)
ASSI { 124}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB1 ))
2.400 0.700 0.700 peak 124 spectrum 1 weight 0.10000E+01 volume 0.66009E-02 ppm1 3.930 ppm2 2.299 CV 1
OR { 124}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HG2 ))
OR { 124}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HG2 ))
ASSI { 126}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB2 ))
2.400 0.700 0.700 peak 126 spectrum 1 weight 0.10000E+01 volume 0.53180E-02 ppm1 3.923 ppm2 1.985 CV 1
OR { 126}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 8 and name HB ))
ASSI { 141}
(( segid " " and resid 43 and name HB1 ))
( segid " " and resid 43 and name HE% )
2.700 0.900 0.900 peak 141 spectrum 1 weight 0.10000E+01 volume 0.15956E-02 ppm1 2.111 ppm2 1.550 CV 1
OR { 141}
(( segid " " and resid 6 and name HB2 ))
( segid " " and resid 2 and name HB% )
ASSI { 149}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 77 and name HN ))
4.500 2.500 1.500 peak 149 spectrum 1 weight 0.10000E+01 volume 0.62997E-03 ppm1 0.555 ppm2 8.520 CV 1
OR { 149}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 76 and name HN ))
OR { 149}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 3 and name HN ))
ASSI { 152}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 73 and name HB ))
4.200 2.200 1.800 peak 152 spectrum 1 weight 0.10000E+01 volume 0.48786E-03 ppm1 0.552 ppm2 4.173 CV 1
OR { 152}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 6 and name HA ))
ASSI { 154}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 73 and name HA ))
2.600 0.800 0.800 peak 154 spectrum 1 weight 0.10000E+01 volume 0.36715E-02 ppm1 0.551 ppm2 3.675 CV 1
OR { 154}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 4 and name HA ))
ASSI { 156}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 11 and name HB1 ))
5.000 3.100 1.000 peak 156 spectrum 1 weight 0.10000E+01 volume 0.32864E-03 ppm1 0.544 ppm2 2.139 CV 1
OR { 156}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 4 and name HG2 ))
OR { 156}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 4 and name HB1 ))
ASSI { 157}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 11 and name HG ))
3.300 1.300 1.300 peak 157 spectrum 1 weight 0.10000E+01 volume 0.13465E-02 ppm1 0.553 ppm2 1.984 CV 1
OR { 157}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 76 and name HG11))
OR { 157}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 8 and name HB ))
ASSI { 162}
( segid " " and resid 7 and name HG2%)
( segid " " and resid 11 and name HD1%)
3.200 1.300 1.300 peak 162 spectrum 1 weight 0.10000E+01 volume 0.14250E-02 ppm1 0.549 ppm2 0.853 CV 1
OR { 162}
( segid " " and resid 7 and name HG2%)
( segid " " and resid 11 and name HD2%)
OR { 162}
( segid " " and resid 7 and name HG2%)
( segid " " and resid 8 and name HG1%)
OR { 162}
( segid " " and resid 7 and name HG2%)
( segid " " and resid 77 and name HD2%)
ASSI { 173}
(( segid " " and resid 7 and name HB ))
(( segid " " and resid 4 and name HA ))
2.700 0.900 0.900 peak 173 spectrum 1 weight 0.10000E+01 volume 0.13378E-02 ppm1 1.782 ppm2 3.683 CV 1
OR { 173}
(( segid " " and resid 76 and name HB ))
(( segid " " and resid 73 and name HA ))
ASSI { 177}
(( segid " " and resid 7 and name HB ))
( segid " " and resid 73 and name HG2%)
3.300 1.300 1.300 peak 177 spectrum 1 weight 0.10000E+01 volume 0.12004E-02 ppm1 1.782 ppm2 1.084 CV 1
OR { 177}
(( segid " " and resid 7 and name HB ))
( segid " " and resid 8 and name HG2%)
ASSI { 181}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 4 and name HA ))
3.800 1.800 1.800 peak 181 spectrum 1 weight 0.10000E+01 volume 0.20459E-02 ppm1 0.524 ppm2 3.692 CV 1
OR { 181}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 73 and name HA ))
ASSI { 186}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 3 and name HN ))
3.600 1.600 1.600 peak 186 spectrum 1 weight 0.10000E+01 volume 0.16062E-02 ppm1 0.526 ppm2 8.517 CV 1
OR { 186}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 77 and name HN ))
OR { 186}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 76 and name HN ))
ASSI { 204}
( segid " " and resid 8 and name HG1%)
(( segid " " and resid 9 and name HN ))
3.200 1.300 1.300 peak 204 spectrum 1 weight 0.10000E+01 volume 0.19371E-02 ppm1 0.888 ppm2 7.728 CV 1
OR { 204}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 25 and name HN ))
ASSI { 209}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 4 and name HA ))
3.300 1.400 1.400 peak 209 spectrum 1 weight 0.10000E+01 volume 0.17393E-02 ppm1 1.033 ppm2 3.683 CV 1
OR { 209}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 73 and name HA ))
ASSI { 210}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 5 and name HA ))
3.400 1.400 1.400 peak 210 spectrum 1 weight 0.10000E+01 volume 0.14898E-02 ppm1 1.036 ppm2 3.921 CV 1
OR { 210}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 7 and name HA ))
ASSI { 219}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 73 and name HB ))
4.100 2.100 1.900 peak 219 spectrum 1 weight 0.10000E+01 volume 0.79570E-03 ppm1 1.034 ppm2 4.169 CV 1
OR { 219}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 6 and name HA ))
ASSI { 230}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 30 and name HB2 ))
3.700 1.700 1.700 peak 230 spectrum 1 weight 0.10000E+01 volume 0.12357E-02 ppm1 1.035 ppm2 1.366 CV 1
OR { 230}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 27 and name HG2 ))
OR { 230}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 30 and name HG2 ))
OR { 230}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 3 and name HG2%)
OR { 230}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 27 and name HG1 ))
ASSI { 236}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 10 and name HN ))
3.500 1.500 1.500 peak 236 spectrum 1 weight 0.10000E+01 volume 0.10788E-02 ppm1 4.217 ppm2 8.394 CV 1
OR { 236}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 8 and name HN ))
ASSI { 260}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 73 and name HA ))
3.500 1.600 1.600 peak 260 spectrum 1 weight 0.10000E+01 volume 0.13066E-02 ppm1 0.844 ppm2 3.665 CV 1
OR { 260}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 4 and name HA ))
ASSI { 267}
(( segid " " and resid 11 and name HA ))
( segid " " and resid 14 and name HD1%)
2.700 0.900 0.900 peak 267 spectrum 1 weight 0.10000E+01 volume 0.21276E-02 ppm1 4.245 ppm2 0.735 CV 1
OR { 267}
(( segid " " and resid 11 and name HA ))
( segid " " and resid 26 and name HG1%)
ASSI { 282}
( segid " " and resid 11 and name HD2%)
( segid " " and resid 76 and name HD1%)
2.300 0.600 0.600 peak 282 spectrum 1 weight 0.10000E+01 volume 0.63630E-02 ppm1 0.881 ppm2 0.605 CV 1
OR { 282}
( segid " " and resid 11 and name HD2%)
( segid " " and resid 40 and name H8% )
OR { 282}
( segid " " and resid 11 and name HD2%)
( segid " " and resid 58 and name HD1%)
ASSI { 285}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 16 and name HN ))
3.400 1.400 1.400 peak 285 spectrum 1 weight 0.10000E+01 volume 0.15946E-02 ppm1 3.935 ppm2 8.692 CV 1
OR { 285}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 16 and name HN ))
ASSI { 286}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 77 and name HN ))
3.100 1.200 1.200 peak 286 spectrum 1 weight 0.10000E+01 volume 0.19565E-02 ppm1 3.929 ppm2 8.506 CV 1
OR { 286}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 76 and name HN ))
OR { 286}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 19 and name HN ))
ASSI { 287}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 16 and name HB2 ))
3.000 1.100 1.100 peak 287 spectrum 1 weight 0.10000E+01 volume 0.25731E-02 ppm1 3.932 ppm2 2.739 CV 1
OR { 287}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 321}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 49 and name HA ))
4.400 2.400 1.600 peak 321 spectrum 1 weight 0.10000E+01 volume 0.11519E-02 ppm1 1.047 ppm2 4.249 CV 1
OR { 321}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 11 and name HA ))
ASSI { 322}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 11 and name HA ))
2.700 0.900 0.900 peak 322 spectrum 1 weight 0.10000E+01 volume 0.23096E-02 ppm1 0.729 ppm2 4.247 CV 1
OR { 322}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 49 and name HA ))
ASSI { 327}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 53 and name HD2 ))
3.700 1.700 1.700 peak 327 spectrum 1 weight 0.10000E+01 volume 0.67579E-03 ppm1 0.732 ppm2 2.699 CV 1
OR { 327}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 16 and name HB2 ))
ASSI { 330}
( segid " " and resid 14 and name HD1%)
( segid " " and resid 50 and name HB% )
2.900 1.000 1.000 peak 330 spectrum 1 weight 0.10000E+01 volume 0.46064E-02 ppm1 0.729 ppm2 1.508 CV 1
OR { 330}
( segid " " and resid 14 and name HD1%)
( segid " " and resid 49 and name HB% )
OR { 330}
( segid " " and resid 18 and name HD1%)
( segid " " and resid 49 and name HB% )
OR { 330}
( segid " " and resid 18 and name HD1%)
( segid " " and resid 19 and name HB% )
ASSI { 341}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 32 and name HZ ))
4.000 2.000 2.000 peak 341 spectrum 1 weight 0.10000E+01 volume 0.86083E-03 ppm1 1.168 ppm2 6.858 CV 1
OR { 341}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 16 and name HD21))
ASSI { 343}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 43 and name HA ))
3.800 1.800 1.800 peak 343 spectrum 1 weight 0.10000E+01 volume 0.85853E-03 ppm1 1.163 ppm2 3.925 CV 1
OR { 343}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 13 and name HA ))
OR { 343}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 42 and name HB1 ))
OR { 343}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 18 and name HA ))
OR { 343}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 50 and name HA ))
OR { 343}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 20 and name HA2 ))
ASSI { 349}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HB ))
2.200 0.600 0.600 peak 349 spectrum 1 weight 0.10000E+01 volume 0.57757E-02 ppm1 1.165 ppm2 2.241 CV 1
OR { 349}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 46 and name HB ))
ASSI { 350}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 14 and name HB ))
3.100 1.200 1.200 peak 350 spectrum 1 weight 0.10000E+01 volume 0.14531E-02 ppm1 1.165 ppm2 2.100 CV 1
OR { 350}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 11 and name HB1 ))
ASSI { 351}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 18 and name HB ))
3.500 1.600 1.600 peak 351 spectrum 1 weight 0.10000E+01 volume 0.21282E-02 ppm1 1.164 ppm2 1.596 CV 1
OR { 351}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 18 and name HG11))
OR { 351}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 21 and name HB ))
ASSI { 352}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 19 and name HB% )
3.600 1.600 1.600 peak 352 spectrum 1 weight 0.10000E+01 volume 0.21863E-02 ppm1 1.164 ppm2 1.503 CV 1
OR { 352}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 50 and name HB% )
OR { 352}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 36 and name HG ))
OR { 352}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 43 and name HE% )
OR { 352}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 49 and name HB% )
ASSI { 353}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 46 and name HG1%)
2.500 0.800 0.800 peak 353 spectrum 1 weight 0.10000E+01 volume 0.36302E-02 ppm1 1.166 ppm2 0.696 CV 1
OR { 353}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 14 and name HD1%)
ASSI { 356}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 19 and name HB% )
3.900 1.900 1.900 peak 356 spectrum 1 weight 0.10000E+01 volume 0.10949E-02 ppm1 3.594 ppm2 1.545 CV 1
OR { 356}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 49 and name HB% )
ASSI { 359}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 22 and name HA ))
3.800 1.800 1.800 peak 359 spectrum 1 weight 0.10000E+01 volume 0.10531E-02 ppm1 3.597 ppm2 4.304 CV 1
OR { 359}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 41 and name HA ))
OR { 359}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 42 and name HA ))
ASSI { 360}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HA ))
3.700 1.800 1.800 peak 360 spectrum 1 weight 0.10000E+01 volume 0.16069E-02 ppm1 3.596 ppm2 3.918 CV 1
OR { 360}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 43 and name HA ))
ASSI { 389}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 43 and name HA ))
3.600 1.600 1.600 peak 389 spectrum 1 weight 0.10000E+01 volume 0.12060E-02 ppm1 3.424 ppm2 3.929 CV 1
OR { 389}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 50 and name HA ))
OR { 389}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 48 and name HA ))
ASSI { 390}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 43 and name HA ))
2.700 0.900 0.900 peak 390 spectrum 1 weight 0.10000E+01 volume 0.24167E-02 ppm1 2.274 ppm2 3.949 CV 1
OR { 390}
(( segid " " and resid 46 and name HB ))
(( segid " " and resid 43 and name HA ))
ASSI { 392}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 43 and name HA ))
2.700 0.900 0.900 peak 392 spectrum 1 weight 0.10000E+01 volume 0.41820E-02 ppm1 0.976 ppm2 3.945 CV 1
OR { 392}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 43 and name HA ))
OR { 392}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 42 and name HB1 ))
OR { 392}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 20 and name HA2 ))
OR { 392}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 50 and name HA ))
OR { 392}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 38 and name HA ))
OR { 392}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 18 and name HA ))
ASSI { 397}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 43 and name HA ))
3.200 1.300 1.300 peak 397 spectrum 1 weight 0.10000E+01 volume 0.12367E-02 ppm1 0.667 ppm2 3.945 CV 1
OR { 397}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 50 and name HA ))
ASSI { 399}
( segid " " and resid 46 and name HG1%)
( segid " " and resid 50 and name HB% )
2.900 1.000 1.000 peak 399 spectrum 1 weight 0.10000E+01 volume 0.33097E-02 ppm1 0.672 ppm2 1.518 CV 1
OR { 399}
( segid " " and resid 46 and name HG1%)
( segid " " and resid 49 and name HB% )
OR { 399}
( segid " " and resid 46 and name HG1%)
( segid " " and resid 43 and name HE% )
ASSI { 412}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 50 and name HN ))
3.300 1.400 1.400 peak 412 spectrum 1 weight 0.10000E+01 volume 0.86485E-03 ppm1 3.293 ppm2 8.812 CV 1
OR { 412}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 51 and name HN ))
ASSI { 414}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 51 and name HG1 ))
3.000 3.000 3.000 peak 414 spectrum 1 weight 0.10000E+01 volume 0.18422E-02 ppm1 0.855 ppm2 2.826 CV 1
OR { 414}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 40 and name H43A))
OR { 414}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 40 and name H43A))
ASSI { 416}
( segid " " and resid 63 and name HG1%)
( segid " " and resid 43 and name HE% )
2.800 1.000 1.000 peak 416 spectrum 1 weight 0.10000E+01 volume 0.30165E-02 ppm1 0.859 ppm2 1.543 CV 1
OR { 416}
( segid " " and resid 47 and name HG1%)
( segid " " and resid 43 and name HE% )
ASSI { 417}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 64 and name HD2 ))
3.500 1.500 1.500 peak 417 spectrum 1 weight 0.10000E+01 volume 0.24596E-02 ppm1 0.858 ppm2 1.676 CV 1
OR { 417}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 64 and name HD1 ))
OR { 417}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 58 and name HB ))
OR { 417}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 58 and name HB ))
ASSI { 418}
( segid " " and resid 63 and name HG1%)
( segid " " and resid 58 and name HG2%)
3.600 1.600 1.600 peak 418 spectrum 1 weight 0.10000E+01 volume 0.15290E-02 ppm1 0.854 ppm2 0.344 CV 1
OR { 418}
( segid " " and resid 47 and name HG1%)
( segid " " and resid 58 and name HG2%)
ASSI { 428}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 47 and name HG1%)
3.600 1.600 1.600 peak 428 spectrum 1 weight 0.10000E+01 volume 0.77418E-03 ppm1 3.921 ppm2 0.864 CV 1
OR { 428}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 47 and name HG2%)
OR { 428}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 63 and name HG2%)
ASSI { 430}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 49 and name HN ))
3.300 1.400 1.400 peak 430 spectrum 1 weight 0.10000E+01 volume 0.23554E-02 ppm1 1.104 ppm2 7.928 CV 1
OR { 430}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 47 and name HN ))
ASSI { 431}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 40 and name H36A))
3.100 1.200 1.200 peak 431 spectrum 1 weight 0.10000E+01 volume 0.23457E-02 ppm1 1.106 ppm2 8.043 CV 1
OR { 431}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 46 and name HN ))
ASSI { 433}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 51 and name HB1 ))
3.800 1.800 1.800 peak 433 spectrum 1 weight 0.10000E+01 volume 0.17117E-02 ppm1 3.928 ppm2 2.460 CV 1
OR { 433}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 52 and name HG1 ))
ASSI { 448}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 52 and name HB1 ))
3.600 1.600 1.600 peak 448 spectrum 1 weight 0.10000E+01 volume 0.18594E-02 ppm1 4.232 ppm2 2.118 CV 1
OR { 448}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 51 and name HB2 ))
OR { 448}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 11 and name HB1 ))
OR { 448}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 14 and name HB ))
ASSI { 449}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 8 and name HB ))
3.600 1.600 1.600 peak 449 spectrum 1 weight 0.10000E+01 volume 0.16348E-02 ppm1 4.226 ppm2 2.028 CV 1
OR { 449}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 52 and name HB2 ))
OR { 449}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 11 and name HG ))
ASSI { 464}
( segid " " and resid 50 and name HB% )
( segid " " and resid 14 and name HD1%)
2.800 1.000 1.000 peak 464 spectrum 1 weight 0.10000E+01 volume 0.30048E-02 ppm1 1.481 ppm2 0.730 CV 1
OR { 464}
( segid " " and resid 9 and name HB% )
( segid " " and resid 26 and name HG1%)
OR { 464}
( segid " " and resid 9 and name HB% )
( segid " " and resid 14 and name HD1%)
ASSI { 465}
( segid " " and resid 50 and name HB% )
( segid " " and resid 40 and name H8% )
2.400 0.700 0.700 peak 465 spectrum 1 weight 0.10000E+01 volume 0.59726E-02 ppm1 1.484 ppm2 0.611 CV 1
OR { 465}
( segid " " and resid 50 and name HB% )
( segid " " and resid 58 and name HD1%)
OR { 465}
( segid " " and resid 50 and name HB% )
( segid " " and resid 76 and name HD1%)
OR { 465}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 53 and name HG2 ))
ASSI { 466}
( segid " " and resid 50 and name HB% )
( segid " " and resid 11 and name HD2%)
3.000 1.100 1.100 peak 466 spectrum 1 weight 0.10000E+01 volume 0.29074E-02 ppm1 1.483 ppm2 0.882 CV 1
OR { 466}
( segid " " and resid 50 and name HB% )
( segid " " and resid 47 and name HG2%)
OR { 466}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 40 and name H7B ))
OR { 466}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 40 and name H7A ))
OR { 466}
( segid " " and resid 9 and name HB% )
( segid " " and resid 8 and name HG1%)
OR { 466}
( segid " " and resid 50 and name HB% )
( segid " " and resid 56 and name HG1%)
OR { 466}
( segid " " and resid 50 and name HB% )
( segid " " and resid 47 and name HG1%)
OR { 466}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 53 and name HG1 ))
OR { 466}
( segid " " and resid 50 and name HB% )
( segid " " and resid 11 and name HD1%)
OR { 466}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 58 and name HG12))
ASSI { 468}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 53 and name HB2 ))
2.600 0.800 0.800 peak 468 spectrum 1 weight 0.10000E+01 volume 0.19434E-02 ppm1 3.940 ppm2 1.067 CV 1
OR { 468}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 14 and name HG12))
ASSI { 469}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 53 and name HG1 ))
3.600 1.600 1.600 peak 469 spectrum 1 weight 0.10000E+01 volume 0.13145E-02 ppm1 3.943 ppm2 0.865 CV 1
OR { 469}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 11 and name HD2%)
OR { 469}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 47 and name HG2%)
OR { 469}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 40 and name H7B ))
OR { 469}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 40 and name H7A ))
OR { 469}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 11 and name HD1%)
ASSI { 479}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 56 and name HG1%)
2.800 1.000 1.000 peak 479 spectrum 1 weight 0.10000E+01 volume 0.29061E-02 ppm1 4.175 ppm2 0.936 CV 1
OR { 479}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 56 and name HG2%)
OR { 479}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 47 and name HG2%)
ASSI { 511}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 56 and name HN ))
4.600 2.700 1.400 peak 511 spectrum 1 weight 0.10000E+01 volume 0.29542E-03 ppm1 3.431 ppm2 7.829 CV 1
OR { 511}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 55 and name HN ))
ASSI { 514}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HD22))
3.400 1.400 1.400 peak 514 spectrum 1 weight 0.10000E+01 volume 0.23426E-02 ppm1 2.722 ppm2 7.734 CV 1
OR { 514}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 66 and name HN ))
ASSI { 515}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 54 and name HD% )
2.700 0.900 0.900 peak 515 spectrum 1 weight 0.10000E+01 volume 0.17762E-02 ppm1 2.732 ppm2 7.466 CV 1
OR { 515}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 30 and name HN ))
ASSI { 517}
(( segid " " and resid 54 and name HB1 ))
( segid " " and resid 56 and name HG1%)
3.700 1.700 1.700 peak 517 spectrum 1 weight 0.10000E+01 volume 0.65745E-03 ppm1 3.436 ppm2 0.926 CV 1
OR { 517}
(( segid " " and resid 54 and name HB1 ))
( segid " " and resid 56 and name HG2%)
OR { 517}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 76 and name HG12))
ASSI { 518}
(( segid " " and resid 54 and name HB1 ))
( segid " " and resid 76 and name HG2%)
3.000 1.100 1.100 peak 518 spectrum 1 weight 0.10000E+01 volume 0.13030E-02 ppm1 3.422 ppm2 0.526 CV 1
OR { 518}
(( segid " " and resid 54 and name HB1 ))
( segid " " and resid 7 and name HD1%)
OR { 518}
(( segid " " and resid 54 and name HB1 ))
( segid " " and resid 7 and name HG2%)
ASSI { 520}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 56 and name HG1%)
3.000 1.100 1.100 peak 520 spectrum 1 weight 0.10000E+01 volume 0.14710E-02 ppm1 2.739 ppm2 0.936 CV 1
OR { 520}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 56 and name HG2%)
OR { 520}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 66 and name HB2 ))
ASSI { 529}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 62 and name HB2 ))
3.900 1.900 1.900 peak 529 spectrum 1 weight 0.10000E+01 volume 0.59550E-03 ppm1 3.228 ppm2 2.444 CV 1
OR { 529}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 40 and name H2A ))
OR { 529}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 62 and name HB1 ))
OR { 529}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 40 and name H2B ))
ASSI { 530}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 66 and name HB1 ))
4.100 2.100 1.900 peak 530 spectrum 1 weight 0.10000E+01 volume 0.84366E-03 ppm1 3.227 ppm2 2.199 CV 1
OR { 530}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 47 and name HB ))
ASSI { 532}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 66 and name HG ))
2.900 1.000 1.000 peak 532 spectrum 1 weight 0.10000E+01 volume 0.23160E-02 ppm1 3.226 ppm2 1.798 CV 1
OR { 532}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HB2 ))
OR { 532}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HB1 ))
ASSI { 533}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HG2%)
2.500 0.800 0.800 peak 533 spectrum 1 weight 0.10000E+01 volume 0.45666E-02 ppm1 3.222 ppm2 0.872 CV 1
OR { 533}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HG1%)
OR { 533}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 47 and name HG2%)
ASSI { 534}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 40 and name H5B ))
3.400 1.500 1.500 peak 534 spectrum 1 weight 0.10000E+01 volume 0.98142E-03 ppm1 3.224 ppm2 0.606 CV 1
OR { 534}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 40 and name H6A ))
OR { 534}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 40 and name H5A ))
OR { 534}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 40 and name H6B ))
OR { 534}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 66 and name HD2%)
OR { 534}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 58 and name HD1%)
ASSI { 537}
( segid " " and resid 11 and name HD2%)
( segid " " and resid 72 and name HB% )
2.900 1.000 1.000 peak 537 spectrum 1 weight 0.10000E+01 volume 0.37513E-02 ppm1 0.892 ppm2 1.604 CV 1
OR { 537}
( segid " " and resid 11 and name HD2%)
(( segid " " and resid 53 and name HB1 ))
OR { 537}
( segid " " and resid 63 and name HG2%)
( segid " " and resid 72 and name HB% )
OR { 537}
( segid " " and resid 11 and name HD2%)
( segid " " and resid 2 and name HB% )
ASSI { 538}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 62 and name HB1 ))
3.000 1.200 1.200 peak 538 spectrum 1 weight 0.10000E+01 volume 0.22488E-02 ppm1 0.886 ppm2 2.454 CV 1
OR { 538}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 40 and name H2A ))
OR { 538}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 40 and name H2B ))
ASSI { 539}
( segid " " and resid 11 and name HD2%)
(( segid " " and resid 10 and name HA1 ))
3.900 1.900 1.900 peak 539 spectrum 1 weight 0.10000E+01 volume 0.15526E-02 ppm1 0.890 ppm2 4.069 CV 1
OR { 539}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name HA ))
OR { 539}
( segid " " and resid 11 and name HD2%)
(( segid " " and resid 12 and name HA ))
ASSI { 544}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 60 and name HA ))
3.500 1.500 1.500 peak 544 spectrum 1 weight 0.10000E+01 volume 0.17700E-02 ppm1 0.827 ppm2 4.196 CV 1
OR { 544}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 60 and name HA ))
OR { 544}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 49 and name HA ))
ASSI { 548}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 75 and name HB2 ))
3.900 1.900 1.900 peak 548 spectrum 1 weight 0.10000E+01 volume 0.60241E-03 ppm1 0.405 ppm2 3.094 CV 1
OR { 548}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 71 and name HB1 ))
ASSI { 551}
( segid " " and resid 66 and name HD1%)
( segid " " and resid 66 and name HD2%)
2.400 0.700 0.700 peak 551 spectrum 1 weight 0.10000E+01 volume 0.56421E-02 ppm1 0.406 ppm2 0.610 CV 1
OR { 551}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H6A ))
OR { 551}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H6B ))
OR { 551}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H5B ))
OR { 551}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H5A ))
ASSI { 560}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 71 and name HB2 ))
3.500 1.500 1.500 peak 560 spectrum 1 weight 0.10000E+01 volume 0.21308E-02 ppm1 4.461 ppm2 2.901 CV 1
OR { 560}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 30 and name HE2 ))
ASSI { 561}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 71 and name HB1 ))
3.300 1.300 1.300 peak 561 spectrum 1 weight 0.10000E+01 volume 0.15477E-02 ppm1 4.454 ppm2 3.110 CV 1
OR { 561}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 75 and name HB2 ))
OR { 561}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 75 and name HB1 ))
ASSI { 573}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 75 and name HB2 ))
2.700 0.900 0.900 peak 573 spectrum 1 weight 0.10000E+01 volume 0.31234E-02 ppm1 0.608 ppm2 3.108 CV 1
OR { 573}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 71 and name HB1 ))
OR { 573}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 75 and name HB1 ))
ASSI { 601}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 63 and name HB ))
3.700 1.700 1.700 peak 601 spectrum 1 weight 0.10000E+01 volume 0.16392E-02 ppm1 0.335 ppm2 1.975 CV 1
OR { 601}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 59 and name HG1 ))
OR { 601}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 59 and name HB2 ))
OR { 601}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 59 and name HG2 ))
ASSI { 602}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 62 and name HB2 ))
2.900 1.100 1.100 peak 602 spectrum 1 weight 0.10000E+01 volume 0.20952E-02 ppm1 0.339 ppm2 2.422 CV 1
OR { 602}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 62 and name HB1 ))
OR { 602}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 59 and name HB1 ))
ASSI { 612}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 40 and name H4A ))
2.200 2.200 3.800 peak 612 spectrum 1 weight 0.10000E+01 volume 0.34484E-02 ppm1 0.590 ppm2 0.706 CV 1
OR { 612}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 40 and name H4B ))
OR { 612}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 40 and name H4B ))
OR { 612}
( segid " " and resid 58 and name HD1%)
( segid " " and resid 46 and name HG1%)
OR { 612}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 40 and name H4A ))
OR { 612}
( segid " " and resid 76 and name HD1%)
( segid " " and resid 14 and name HD1%)
OR { 612}
( segid " " and resid 58 and name HD1%)
( segid " " and resid 14 and name HD1%)
OR { 612}
( segid " " and resid 76 and name HD1%)
( segid " " and resid 46 and name HG1%)
ASSI { 614}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 76 and name HG11))
2.300 0.700 0.700 peak 614 spectrum 1 weight 0.10000E+01 volume 0.47814E-02 ppm1 0.594 ppm2 1.956 CV 1
OR { 614}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 11 and name HG ))
OR { 614}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 76 and name HG11))
ASSI { 615}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HG11))
2.200 0.600 0.600 peak 615 spectrum 1 weight 0.10000E+01 volume 0.58545E-02 ppm1 0.587 ppm2 1.520 CV 1
OR { 615}
( segid " " and resid 58 and name HD1%)
( segid " " and resid 50 and name HB% )
ASSI { 616}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HG11))
3.100 1.200 1.200 peak 616 spectrum 1 weight 0.10000E+01 volume 0.14201E-02 ppm1 4.493 ppm2 1.545 CV 1
OR { 616}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HG1 ))
ASSI { 617}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 74 and name HB2 ))
3.700 1.700 1.700 peak 617 spectrum 1 weight 0.10000E+01 volume 0.20474E-02 ppm1 4.494 ppm2 1.944 CV 1
OR { 617}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 59 and name HG2 ))
OR { 617}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 59 and name HG1 ))
OR { 617}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 624}
( segid " " and resid 76 and name HD1%)
( segid " " and resid 54 and name HD% )
3.100 1.200 1.200 peak 624 spectrum 1 weight 0.10000E+01 volume 0.16174E-02 ppm1 0.596 ppm2 7.465 CV 1
OR { 624}
( segid " " and resid 58 and name HD1%)
( segid " " and resid 54 and name HD% )
ASSI { 629}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 80 and name HE22))
3.900 1.900 1.900 peak 629 spectrum 1 weight 0.10000E+01 volume 0.59064E-03 ppm1 0.511 ppm2 7.704 CV 1
OR { 629}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 79 and name HN ))
ASSI { 633}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 54 and name HA ))
3.900 1.900 1.900 peak 633 spectrum 1 weight 0.10000E+01 volume 0.35909E-03 ppm1 0.514 ppm2 4.831 CV 1
OR { 633}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 2 and name HA ))
ASSI { 635}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 54 and name HB2 ))
3.200 1.300 1.300 peak 635 spectrum 1 weight 0.10000E+01 volume 0.13760E-02 ppm1 0.515 ppm2 2.723 CV 1
OR { 635}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 80 and name HG1 ))
ASSI { 637}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HG11))
3.100 1.200 1.200 peak 637 spectrum 1 weight 0.10000E+01 volume 0.15026E-02 ppm1 3.486 ppm2 1.963 CV 1
OR { 637}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 56 and name HB ))
ASSI { 639}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HG12))
2.500 0.800 0.800 peak 639 spectrum 1 weight 0.10000E+01 volume 0.34386E-02 ppm1 3.486 ppm2 0.926 CV 1
OR { 639}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 56 and name HG2%)
OR { 639}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 56 and name HG1%)
ASSI { 640}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 7 and name HG11))
3.800 1.800 1.800 peak 640 spectrum 1 weight 0.10000E+01 volume 0.66180E-03 ppm1 0.514 ppm2 1.550 CV 1
OR { 640}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 2 and name HB% )
OR { 640}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 72 and name HB% )
ASSI { 643}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 80 and name HB2 ))
3.800 1.800 1.800 peak 643 spectrum 1 weight 0.10000E+01 volume 0.78976E-03 ppm1 0.509 ppm2 2.128 CV 1
OR { 643}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 4 and name HB1 ))
ASSI { 709}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 67 and name HA ))
3.100 1.200 1.200 peak 709 spectrum 1 weight 0.10000E+01 volume 0.15209E-02 ppm1 1.050 ppm2 4.485 CV 1
OR { 709}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 71 and name HA ))
OR { 709}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 66 and name HA ))
ASSI { 745}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 76 and name HN ))
3.900 1.900 1.900 peak 745 spectrum 1 weight 0.10000E+01 volume 0.15028E-02 ppm1 1.103 ppm2 8.511 CV 1
OR { 745}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 77 and name HN ))
ASSI { 748}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 7 and name HG2%)
2.500 0.800 0.800 peak 748 spectrum 1 weight 0.10000E+01 volume 0.56132E-02 ppm1 1.103 ppm2 0.547 CV 1
OR { 748}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 76 and name HD1%)
OR { 748}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 7 and name HD1%)
ASSI { 764}
( segid " " and resid 56 and name HG1%)
(( segid " " and resid 80 and name HA ))
3.600 1.600 1.600 peak 764 spectrum 1 weight 0.10000E+01 volume 0.19607E-02 ppm1 0.912 ppm2 4.411 CV 1
OR { 764}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 36 and name HA ))
OR { 764}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 30 and name HA ))
ASSI { 766}
( segid " " and resid 8 and name HG1%)
(( segid " " and resid 9 and name HA ))
2.800 1.000 1.000 peak 766 spectrum 1 weight 0.10000E+01 volume 0.28550E-02 ppm1 0.917 ppm2 4.178 CV 1
OR { 766}
( segid " " and resid 56 and name HG1%)
(( segid " " and resid 51 and name HA ))
ASSI { 772}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 80 and name HA ))
2.800 1.000 1.000 peak 772 spectrum 1 weight 0.10000E+01 volume 0.24062E-02 ppm1 0.958 ppm2 4.407 CV 1
OR { 772}
( segid " " and resid 38 and name HG2%)
(( segid " " and resid 37 and name HA ))
OR { 772}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 78 and name HA ))
ASSI { 773}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 51 and name HA ))
3.000 1.200 1.200 peak 773 spectrum 1 weight 0.10000E+01 volume 0.24655E-02 ppm1 0.961 ppm2 4.184 CV 1
OR { 773}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 75 and name HA ))
OR { 773}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 81 and name HA ))
ASSI { 774}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 80 and name HG1 ))
3.000 1.100 1.100 peak 774 spectrum 1 weight 0.10000E+01 volume 0.28077E-02 ppm1 0.960 ppm2 2.733 CV 1
OR { 774}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 54 and name HB2 ))
ASSI { 775}
( segid " " and resid 56 and name HG1%)
(( segid " " and resid 54 and name HB2 ))
2.700 0.900 0.900 peak 775 spectrum 1 weight 0.10000E+01 volume 0.22202E-02 ppm1 0.914 ppm2 2.729 CV 1
OR { 775}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 25 and name HB1 ))
OR { 775}
( segid " " and resid 56 and name HG1%)
(( segid " " and resid 80 and name HG1 ))
ASSI { 776}
( segid " " and resid 56 and name HG1%)
(( segid " " and resid 79 and name HB2 ))
3.300 1.300 1.300 peak 776 spectrum 1 weight 0.10000E+01 volume 0.19184E-02 ppm1 0.915 ppm2 2.481 CV 1
OR { 776}
( segid " " and resid 56 and name HG1%)
(( segid " " and resid 51 and name HB1 ))
OR { 776}
( segid " " and resid 56 and name HG1%)
(( segid " " and resid 78 and name HB1 ))
ASSI { 778}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 79 and name HB2 ))
3.100 1.200 1.200 peak 778 spectrum 1 weight 0.10000E+01 volume 0.19561E-02 ppm1 0.956 ppm2 2.483 CV 1
OR { 778}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
ASSI { 800}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 64 and name HG2 ))
2.700 2.700 3.300 peak 800 spectrum 1 weight 0.10000E+01 volume 0.54260E-02 ppm1 1.117 ppm2 1.346 CV 1
OR { 800}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 64 and name HG1 ))
OR { 800}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 18 and name HG12))
ASSI { 802}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 34 and name HA ))
3.600 1.600 1.600 peak 802 spectrum 1 weight 0.10000E+01 volume 0.10855E-02 ppm1 1.261 ppm2 4.644 CV 1
OR { 802}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 39 and name HA ))
ASSI { 810}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 32 and name HN ))
4.100 2.100 1.900 peak 810 spectrum 1 weight 0.10000E+01 volume 0.44485E-03 ppm1 1.264 ppm2 8.172 CV 1
OR { 810}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 40 and name H41A))
ASSI { 811}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 12 and name HA ))
2.900 1.000 1.000 peak 811 spectrum 1 weight 0.10000E+01 volume 0.41505E-02 ppm1 0.725 ppm2 4.049 CV 1
OR { 811}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 32 and name HA ))
ASSI { 830}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 73 and name HA ))
3.200 3.200 2.800 peak 830 spectrum 1 weight 0.10000E+01 volume 0.23500E-02 ppm1 0.643 ppm2 3.674 CV 1
OR { 830}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 4 and name HA ))
ASSI { 831}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 28 and name HA ))
2.500 0.800 0.800 peak 831 spectrum 1 weight 0.10000E+01 volume 0.28465E-02 ppm1 0.646 ppm2 3.569 CV 1
OR { 831}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 15 and name HA ))
ASSI { 838}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 32 and name HZ ))
4.100 2.100 1.900 peak 838 spectrum 1 weight 0.10000E+01 volume 0.65313E-03 ppm1 0.648 ppm2 6.877 CV 1
OR { 838}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 4 and name HE21))
ASSI { 841}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 46 and name HG1%)
2.600 0.800 0.800 peak 841 spectrum 1 weight 0.10000E+01 volume 0.56857E-02 ppm1 3.406 ppm2 0.656 CV 1
OR { 841}
(( segid " " and resid 69 and name HA ))
( segid " " and resid 69 and name HG2%)
ASSI { 846}
(( segid " " and resid 69 and name HA ))
( segid " " and resid 72 and name HB% )
2.800 1.000 1.000 peak 846 spectrum 1 weight 0.10000E+01 volume 0.20973E-02 ppm1 3.409 ppm2 1.613 CV 1
OR { 846}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 18 and name HG11))
ASSI { 847}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 46 and name HG2%)
2.400 0.700 0.700 peak 847 spectrum 1 weight 0.10000E+01 volume 0.44485E-02 ppm1 3.412 ppm2 0.987 CV 1
OR { 847}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 48 and name HG1%)
ASSI { 848}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 30 and name HB1 ))
2.500 2.500 3.500 peak 848 spectrum 1 weight 0.10000E+01 volume 0.17036E-02 ppm1 0.435 ppm2 2.040 CV 1
OR { 848}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 8 and name HB ))
OR { 848}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 27 and name HB1 ))
OR { 848}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 4 and name HB2 ))
ASSI { 850}
( segid " " and resid 69 and name HG1%)
( segid " " and resid 15 and name HG2%)
2.600 2.600 3.400 peak 850 spectrum 1 weight 0.10000E+01 volume 0.13555E-02 ppm1 0.438 ppm2 1.172 CV 1
OR { 850}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 40 and name H3A ))
OR { 850}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 40 and name H3B ))
ASSI { 854}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 76 and name HD1%)
2.600 0.800 0.800 peak 854 spectrum 1 weight 0.10000E+01 volume 0.32049E-02 ppm1 3.673 ppm2 0.552 CV 1
OR { 854}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 7 and name HG2%)
OR { 854}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 76 and name HG2%)
ASSI { 856}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 76 and name HB ))
3.100 1.200 1.200 peak 856 spectrum 1 weight 0.10000E+01 volume 0.78025E-03 ppm1 3.665 ppm2 1.776 CV 1
OR { 856}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 7 and name HB ))
ASSI { 863}
( segid " " and resid 48 and name HG1%)
(( segid " " and resid 48 and name HB ))
2.100 0.500 0.500 peak 863 spectrum 1 weight 0.10000E+01 volume 0.13277E-01 ppm1 0.991 ppm2 2.036 CV 1
OR { 863}
( segid " " and resid 23 and name HG2%)
(( segid " " and resid 23 and name HB ))
OR { 863}
( segid " " and resid 23 and name HG1%)
(( segid " " and resid 23 and name HB ))
ASSI { 864}
( segid " " and resid 23 and name HG2%)
(( segid " " and resid 16 and name HB1 ))
2.400 2.400 3.600 peak 864 spectrum 1 weight 0.10000E+01 volume 0.23499E-02 ppm1 0.991 ppm2 3.100 CV 1
OR { 864}
( segid " " and resid 23 and name HG1%)
(( segid " " and resid 16 and name HB1 ))
OR { 864}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 32 and name HB1 ))
OR { 864}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 39 and name HB1 ))
OR { 864}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 32 and name HB2 ))
ASSI { 865}
( segid " " and resid 23 and name HG2%)
(( segid " " and resid 16 and name HB2 ))
2.500 2.500 3.500 peak 865 spectrum 1 weight 0.10000E+01 volume 0.19708E-02 ppm1 0.994 ppm2 2.745 CV 1
OR { 865}
( segid " " and resid 23 and name HG1%)
(( segid " " and resid 16 and name HB2 ))
OR { 865}
( segid " " and resid 48 and name HG1%)
(( segid " " and resid 54 and name HB2 ))
ASSI { 867}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 44 and name HA ))
2.500 0.800 0.800 peak 867 spectrum 1 weight 0.10000E+01 volume 0.55961E-02 ppm1 0.992 ppm2 3.605 CV 1
OR { 867}
( segid " " and resid 23 and name HG1%)
(( segid " " and resid 23 and name HA ))
ASSI { 869}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 46 and name HA ))
3.200 1.300 1.300 peak 869 spectrum 1 weight 0.10000E+01 volume 0.29067E-02 ppm1 0.769 ppm2 3.416 CV 1
OR { 869}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 46 and name HA ))
ASSI { 870}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 13 and name HB1 ))
3.000 1.100 1.100 peak 870 spectrum 1 weight 0.10000E+01 volume 0.29263E-02 ppm1 0.769 ppm2 2.278 CV 1
OR { 870}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 45 and name HB1 ))
OR { 870}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 45 and name HG2 ))
OR { 870}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 13 and name HG2 ))
OR { 870}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 46 and name HB ))
ASSI { 880}
( segid " " and resid 77 and name HD2%)
(( segid " " and resid 74 and name HA ))
2.800 1.000 1.000 peak 880 spectrum 1 weight 0.10000E+01 volume 0.44690E-02 ppm1 0.811 ppm2 3.909 CV 1
OR { 880}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 77 and name HA ))
OR { 880}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 74 and name HA ))
OR { 880}
( segid " " and resid 77 and name HD2%)
(( segid " " and resid 77 and name HA ))
ASSI { 885}
( segid " " and resid 77 and name HD2%)
(( segid " " and resid 4 and name HB1 ))
2.900 1.000 1.000 peak 885 spectrum 1 weight 0.10000E+01 volume 0.30738E-02 ppm1 0.814 ppm2 2.176 CV 1
OR { 885}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 78 and name HB2 ))
OR { 885}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 4 and name HB1 ))
OR { 885}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 80 and name HB2 ))
ASSI { 978}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB1 ))
2.400 0.700 0.700 peak 978 spectrum 1 weight 0.10000E+01 volume 0.50801E-02 ppm1 4.708 ppm2 1.670 CV 1
OR { 978}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB2 ))
OR { 978}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 58 and name HB ))
ASSI { 1022}
(( segid " " and resid 21 and name HB ))
(( segid " " and resid 21 and name HN ))
3.300 1.400 1.400 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.18145E-02 ppm1 1.603 ppm2 6.471 CV 1
OR { 1022}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 21 and name HN ))
ASSI { 1025}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 18 and name HA ))
3.500 1.600 1.600 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.69673E-03 ppm1 1.617 ppm2 3.939 CV 1
OR { 1025}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 17 and name HA ))
OR { 1025}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 42 and name HB1 ))
OR { 1025}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 20 and name HA2 ))
ASSI { 1028}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 18 and name HG12))
2.500 0.800 0.800 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.30080E-02 ppm1 1.608 ppm2 1.308 CV 1
OR { 1028}
(( segid " " and resid 21 and name HB ))
(( segid " " and resid 21 and name HG12))
OR { 1028}
(( segid " " and resid 21 and name HB ))
(( segid " " and resid 21 and name HG11))
ASSI { 1030}
(( segid " " and resid 18 and name HB ))
( segid " " and resid 18 and name HG2%)
2.200 0.600 0.600 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.62976E-02 ppm1 1.605 ppm2 0.980 CV 1
OR { 1030}
(( segid " " and resid 21 and name HB ))
( segid " " and resid 21 and name HG2%)
OR { 1030}
(( segid " " and resid 18 and name HB ))
( segid " " and resid 15 and name HG1%)
OR { 1030}
(( segid " " and resid 21 and name HB ))
( segid " " and resid 15 and name HG1%)
ASSI { 1031}
(( segid " " and resid 21 and name HB ))
( segid " " and resid 21 and name HD1%)
3.000 1.100 1.100 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.13634E-02 ppm1 1.616 ppm2 0.783 CV 1
OR { 1031}
(( segid " " and resid 18 and name HB ))
( segid " " and resid 18 and name HD1%)
OR { 1031}
(( segid " " and resid 21 and name HB ))
( segid " " and resid 36 and name HD2%)
ASSI { 1036}
(( segid " " and resid 75 and name HB1 ))
(( segid " " and resid 74 and name HB2 ))
3.300 1.400 1.400 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.91310E-03 ppm1 3.142 ppm2 1.867 CV 1
OR { 1036}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 38 and name HB ))
OR { 1036}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 38 and name HB ))
OR { 1036}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 41 and name HB1 ))
ASSI { 1038}
(( segid " " and resid 32 and name HB2 ))
( segid " " and resid 33 and name HG2%)
3.500 1.500 1.500 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.85794E-03 ppm1 3.149 ppm2 1.235 CV 1
OR { 1038}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 40 and name H3A ))
OR { 1038}
(( segid " " and resid 32 and name HB1 ))
( segid " " and resid 33 and name HG2%)
OR { 1038}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 40 and name H3B ))
OR { 1038}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 40 and name H3A ))
ASSI { 1050}
(( segid " " and resid 21 and name HG12))
(( segid " " and resid 15 and name HB ))
3.600 1.600 1.600 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.91042E-03 ppm1 1.293 ppm2 2.254 CV 1
OR { 1050}
(( segid " " and resid 21 and name HG12))
(( segid " " and resid 36 and name HB1 ))
OR { 1050}
(( segid " " and resid 21 and name HG11))
(( segid " " and resid 15 and name HB ))
ASSI { 1057}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 38 and name HA ))
3.900 1.900 1.900 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.61954E-03 ppm1 1.535 ppm2 3.965 CV 1
OR { 1057}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 42 and name HB1 ))
OR { 1057}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 20 and name HA2 ))
ASSI { 1058}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 42 and name HB2 ))
3.700 1.700 1.700 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.10117E-02 ppm1 1.536 ppm2 3.619 CV 1
OR { 1058}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 15 and name HA ))
ASSI { 1063}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 30 and name HE1 ))
3.100 1.200 1.200 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.11754E-02 ppm1 0.762 ppm2 2.993 CV 1
OR { 1063}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 35 and name HB1 ))
ASSI { 1072}
( segid " " and resid 36 and name HD2%)
( segid " " and resid 21 and name HG2%)
2.200 0.600 0.600 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.10488E-01 ppm1 0.762 ppm2 0.995 CV 1
OR { 1072}
( segid " " and resid 36 and name HD2%)
( segid " " and resid 15 and name HG1%)
OR { 1072}
( segid " " and resid 36 and name HD2%)
( segid " " and resid 38 and name HG2%)
ASSI { 1076}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 35 and name HB1 ))
3.400 1.500 1.500 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.10579E-02 ppm1 0.762 ppm2 3.050 CV 1
OR { 1076}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 37 and name HB1 ))
ASSI { 1094}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 46 and name HB ))
2.200 0.600 0.600 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.61875E-02 ppm1 0.666 ppm2 2.270 CV 1
OR { 1094}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 69 and name HB ))
ASSI { 1097}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HN ))
2.700 0.900 0.900 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.35250E-02 ppm1 4.215 ppm2 7.734 CV 1
OR { 1097}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 52 and name HN ))
ASSI { 1125}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HD2 ))
2.900 1.000 1.000 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.19062E-02 ppm1 3.896 ppm2 2.701 CV 1
OR { 1125}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 80 and name HG1 ))
ASSI { 1126}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 80 and name HG2 ))
3.800 1.800 1.800 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.78641E-03 ppm1 3.892 ppm2 2.571 CV 1
OR { 1126}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 78 and name HB1 ))
ASSI { 1129}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HG1 ))
2.700 0.900 0.900 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.64124E-02 ppm1 3.891 ppm2 0.819 CV 1
OR { 1129}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 77 and name HD1%)
OR { 1129}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 77 and name HD2%)
ASSI { 1137}
( segid " " and resid 77 and name HD2%)
( segid " " and resid 7 and name HD1%)
2.800 1.000 1.000 peak 1137 spectrum 1 weight 0.10000E+01 volume 0.28385E-02 ppm1 0.812 ppm2 0.527 CV 1
OR { 1137}
( segid " " and resid 77 and name HD2%)
( segid " " and resid 76 and name HG2%)
OR { 1137}
( segid " " and resid 77 and name HD1%)
( segid " " and resid 76 and name HG2%)
OR { 1137}
( segid " " and resid 77 and name HD1%)
( segid " " and resid 7 and name HD1%)
ASSI { 1147}
(( segid " " and resid 75 and name HB1 ))
(( segid " " and resid 75 and name HA ))
3.500 1.500 1.500 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.11014E-02 ppm1 3.144 ppm2 4.221 CV 1
OR { 1147}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 33 and name HB ))
ASSI { 1156}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 32 and name HA ))
2.600 0.800 0.800 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.26328E-02 ppm1 3.142 ppm2 4.090 CV 1
OR { 1156}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HA ))
OR { 1156}
(( segid " " and resid 75 and name HB1 ))
(( segid " " and resid 72 and name HA ))
ASSI { 1159}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 26 and name HA ))
5.100 3.200 0.900 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.22907E-03 ppm1 1.032 ppm2 3.510 CV 1
OR { 1159}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 76 and name HA ))
ASSI { 1166}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 30 and name HN ))
4.700 2.700 1.300 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.35860E-03 ppm1 1.038 ppm2 7.521 CV 1
OR { 1166}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 4 and name HE22))
OR { 1166}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 26 and name HN ))
ASSI { 1173}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 40 and name H37A))
3.800 1.800 1.800 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.80404E-03 ppm1 0.911 ppm2 3.439 CV 1
OR { 1173}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 46 and name HA ))
OR { 1173}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 40 and name H37A))
OR { 1173}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 54 and name HB1 ))
OR { 1173}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 76 and name HA ))
ASSI { 1174}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 48 and name HA ))
3.000 1.200 1.200 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.17913E-02 ppm1 0.911 ppm2 3.948 CV 1
OR { 1174}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 50 and name HA ))
ASSI { 1183}
( segid " " and resid 49 and name HB% )
(( segid " " and resid 15 and name HA ))
3.200 3.200 2.800 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.67763E-03 ppm1 1.517 ppm2 3.558 CV 1
OR { 1183}
( segid " " and resid 49 and name HB% )
(( segid " " and resid 44 and name HA ))
OR { 1183}
( segid " " and resid 1 and name HB% )
(( segid " " and resid 79 and name HB1 ))
ASSI { 1187}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 6 and name HA ))
2.700 0.900 0.900 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.31310E-02 ppm1 1.507 ppm2 4.126 CV 1
OR { 1187}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 51 and name HA ))
ASSI { 1192}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 54 and name HB1 ))
3.700 1.700 1.700 peak 1192 spectrum 1 weight 0.10000E+01 volume 0.15041E-02 ppm1 1.492 ppm2 3.424 CV 1
OR { 1192}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 46 and name HA ))
OR { 1192}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 8 and name HA ))
ASSI { 1194}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 53 and name HB2 ))
3.700 1.700 1.700 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.13082E-02 ppm1 1.486 ppm2 1.048 CV 1
OR { 1194}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 14 and name HG12))
OR { 1194}
( segid " " and resid 9 and name HB% )
( segid " " and resid 8 and name HG2%)
ASSI { 1213}
(( segid " " and resid 22 and name HD1 ))
(( segid " " and resid 36 and name HB1 ))
5.600 4.000 0.400 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.23628E-03 ppm1 4.035 ppm2 2.260 CV 1
OR { 1213}
(( segid " " and resid 22 and name HD1 ))
(( segid " " and resid 24 and name HG2 ))
OR { 1213}
(( segid " " and resid 22 and name HD1 ))
(( segid " " and resid 24 and name HG1 ))
OR { 1213}
(( segid " " and resid 22 and name HD1 ))
(( segid " " and resid 15 and name HB ))
ASSI { 1219}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 5 and name HG1 ))
4.600 2.600 1.400 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.87290E-03 ppm1 1.354 ppm2 2.468 CV 1
OR { 1219}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 6 and name HB1 ))
ASSI { 1220}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 5 and name HG2 ))
4.600 2.600 1.400 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.57016E-03 ppm1 1.356 ppm2 2.339 CV 1
OR { 1220}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 6 and name HG2 ))
ASSI { 1222}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 4 and name HB2 ))
3.900 1.900 1.900 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.12694E-02 ppm1 1.351 ppm2 2.073 CV 1
OR { 1222}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 5 and name HB1 ))
OR { 1222}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 6 and name HB2 ))
ASSI { 1231}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 77 and name HA ))
3.700 1.700 1.700 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.11382E-02 ppm1 4.435 ppm2 3.928 CV 1
OR { 1231}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 7 and name HA ))
ASSI { 1244}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 54 and name HB2 ))
4.800 2.900 1.200 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.38651E-03 ppm1 1.560 ppm2 2.733 CV 1
OR { 1244}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 80 and name HG1 ))
ASSI { 1251}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 56 and name HN ))
2.900 1.000 1.000 peak 1251 spectrum 1 weight 0.10000E+01 volume 0.20280E-02 ppm1 4.172 ppm2 7.839 CV 1
OR { 1251}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 55 and name HN ))
ASSI { 1254}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB2 ))
2.900 1.000 1.000 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.38524E-02 ppm1 4.160 ppm2 2.089 CV 1
OR { 1254}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 43 and name HB1 ))
ASSI { 1269}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 7 and name HN ))
2.600 0.900 0.900 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.40400E-02 ppm1 3.923 ppm2 8.386 CV 1
OR { 1269}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 8 and name HN ))
ASSI { 1270}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 28 and name HD2%)
3.400 1.400 1.400 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.12566E-02 ppm1 3.924 ppm2 0.906 CV 1
OR { 1270}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 8 and name HG1%)
ASSI { 1271}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 11 and name HN ))
4.200 2.200 1.800 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.44707E-03 ppm1 3.889 ppm2 9.219 CV 1
OR { 1271}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 4 and name HN ))
ASSI { 1272}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 9 and name HN ))
4.100 2.100 1.900 peak 1272 spectrum 1 weight 0.10000E+01 volume 0.47479E-03 ppm1 3.885 ppm2 7.705 CV 1
OR { 1272}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 6 and name HN ))
OR { 1272}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 80 and name HE22))
ASSI { 1275}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 11 and name HD2%)
5.200 3.300 0.800 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.62666E-03 ppm1 3.875 ppm2 0.894 CV 1
OR { 1275}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 8 and name HG1%)
OR { 1275}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 76 and name HG12))
OR { 1275}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 56 and name HG1%)
ASSI { 1277}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 3 and name HA ))
4.400 2.400 1.600 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.64769E-03 ppm1 3.887 ppm2 4.397 CV 1
OR { 1277}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 80 and name HA ))
ASSI { 1280}
(( segid " " and resid 7 and name HB ))
( segid " " and resid 11 and name HD1%)
4.200 2.200 1.800 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.87156E-03 ppm1 1.787 ppm2 0.857 CV 1
OR { 1280}
(( segid " " and resid 7 and name HB ))
( segid " " and resid 77 and name HD2%)
OR { 1280}
(( segid " " and resid 7 and name HB ))
( segid " " and resid 28 and name HD2%)
OR { 1280}
(( segid " " and resid 7 and name HB ))
( segid " " and resid 8 and name HG1%)
OR { 1280}
(( segid " " and resid 7 and name HB ))
( segid " " and resid 11 and name HD2%)
ASSI { 1281}
(( segid " " and resid 7 and name HG11))
(( segid " " and resid 7 and name HA ))
3.900 1.900 1.900 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.84060E-03 ppm1 1.540 ppm2 3.898 CV 1
OR { 1281}
(( segid " " and resid 7 and name HG11))
(( segid " " and resid 77 and name HA ))
ASSI { 1288}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 4 and name HN ))
4.500 2.500 1.500 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.54310E-03 ppm1 0.510 ppm2 9.240 CV 1
OR { 1288}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 11 and name HN ))
ASSI { 1291}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 80 and name HE22))
3.500 1.500 1.500 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.48627E-03 ppm1 0.517 ppm2 7.774 CV 1
OR { 1291}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 55 and name HN ))
ASSI { 1296}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 6 and name HB2 ))
3.800 1.800 1.800 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.60509E-03 ppm1 0.522 ppm2 2.148 CV 1
OR { 1296}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 80 and name HB2 ))
OR { 1296}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 4 and name HB1 ))
OR { 1296}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 4 and name HG2 ))
OR { 1296}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 11 and name HB1 ))
ASSI { 1297}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 76 and name HG11))
4.600 2.700 1.400 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.64693E-03 ppm1 0.524 ppm2 1.990 CV 1
OR { 1297}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 11 and name HG ))
OR { 1297}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 56 and name HB ))
OR { 1297}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 8 and name HB ))
ASSI { 1299}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 7 and name HG2%)
3.300 1.400 1.400 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.87319E-03 ppm1 3.372 ppm2 0.552 CV 1
OR { 1299}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 76 and name HD1%)
OR { 1299}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 7 and name HD1%)
ASSI { 1305}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 12 and name HB% )
4.100 2.100 1.900 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.94242E-03 ppm1 1.032 ppm2 1.677 CV 1
OR { 1305}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 77 and name HB2 ))
ASSI { 1308}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 28 and name HN ))
4.100 2.100 1.900 peak 1308 spectrum 1 weight 0.10000E+01 volume 0.54042E-03 ppm1 1.040 ppm2 8.501 CV 1
OR { 1308}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 77 and name HN ))
ASSI { 1309}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 8 and name HG1%)
3.300 1.300 1.300 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.13346E-02 ppm1 4.224 ppm2 0.877 CV 1
OR { 1309}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 53 and name HG1 ))
OR { 1309}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 26 and name HG2%)
OR { 1309}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 11 and name HD1%)
OR { 1309}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 11 and name HD2%)
ASSI { 1310}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 26 and name HG1%)
4.000 2.000 2.000 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.83198E-03 ppm1 4.224 ppm2 0.727 CV 1
OR { 1310}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 14 and name HD1%)
OR { 1310}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 14 and name HD1%)
ASSI { 1311}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 52 and name HG2 ))
3.300 1.300 1.300 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.48866E-03 ppm1 4.225 ppm2 2.248 CV 1
OR { 1311}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 13 and name HG2 ))
ASSI { 1319}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 14 and name HN ))
6.000 4.600 0.000 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.61326E-04 ppm1 3.853 ppm2 8.163 CV 1
OR { 1319}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 54 and name HN ))
ASSI { 1322}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 54 and name HA ))
3.900 3.900 2.100 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.38943E-03 ppm1 4.039 ppm2 4.799 CV 1
OR { 1322}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 2 and name HA ))
ASSI { 1323}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 9 and name HA ))
3.900 1.900 1.900 peak 1323 spectrum 1 weight 0.10000E+01 volume 0.67521E-03 ppm1 3.863 ppm2 4.199 CV 1
OR { 1323}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 11 and name HA ))
ASSI { 1331}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 11 and name HD1%)
2.700 0.900 0.900 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.26049E-02 ppm1 1.273 ppm2 0.868 CV 1
OR { 1331}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 11 and name HD2%)
OR { 1331}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 8 and name HG1%)
ASSI { 1333}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 26 and name HG1%)
4.100 2.100 1.900 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.22960E-03 ppm1 1.265 ppm2 0.738 CV 1
OR { 1333}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 14 and name HD1%)
ASSI { 1335}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 69 and name HB ))
3.800 1.800 1.800 peak 1335 spectrum 1 weight 0.10000E+01 volume 0.45096E-03 ppm1 0.850 ppm2 2.322 CV 1
OR { 1335}
(( segid " " and resid 58 and name HG12))
(( segid " " and resid 51 and name HG2 ))
OR { 1335}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 26 and name HB ))
ASSI { 1337}
(( segid " " and resid 58 and name HG12))
( segid " " and resid 58 and name HD1%)
2.400 0.700 0.700 peak 1337 spectrum 1 weight 0.10000E+01 volume 0.41671E-02 ppm1 0.847 ppm2 0.558 CV 1
OR { 1337}
( segid " " and resid 11 and name HD1%)
( segid " " and resid 7 and name HG2%)
OR { 1337}
( segid " " and resid 11 and name HD1%)
( segid " " and resid 76 and name HD1%)
ASSI { 1342}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 54 and name HZ ))
4.800 2.900 1.200 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.36868E-03 ppm1 0.846 ppm2 7.469 CV 1
OR { 1342}
(( segid " " and resid 53 and name HG1 ))
( segid " " and resid 54 and name HD% )
OR { 1342}
( segid " " and resid 11 and name HD1%)
( segid " " and resid 54 and name HD% )
ASSI { 1344}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 32 and name HZ ))
3.400 1.400 1.400 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.51337E-03 ppm1 0.852 ppm2 6.861 CV 1
OR { 1344}
(( segid " " and resid 58 and name HG12))
( segid " " and resid 75 and name HD% )
ASSI { 1346}
( segid " " and resid 11 and name HD1%)
( segid " " and resid 54 and name HE% )
4.700 2.800 1.300 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.42030E-03 ppm1 0.847 ppm2 7.127 CV 1
OR { 1346}
(( segid " " and resid 53 and name HG1 ))
( segid " " and resid 54 and name HE% )
ASSI { 1353}
(( segid " " and resid 11 and name HG ))
( segid " " and resid 76 and name HD1%)
4.000 2.000 2.000 peak 1353 spectrum 1 weight 0.10000E+01 volume 0.50323E-03 ppm1 1.994 ppm2 0.606 CV 1
OR { 1353}
(( segid " " and resid 11 and name HG ))
( segid " " and resid 40 and name H8% )
OR { 1353}
(( segid " " and resid 11 and name HG ))
( segid " " and resid 69 and name HG2%)
OR { 1353}
(( segid " " and resid 11 and name HG ))
(( segid " " and resid 40 and name H6B ))
OR { 1353}
(( segid " " and resid 11 and name HG ))
(( segid " " and resid 40 and name H6A ))
ASSI { 1360}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 15 and name HG1%)
5.100 3.300 0.900 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.31946E-03 ppm1 4.042 ppm2 1.043 CV 1
OR { 1360}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 21 and name HG2%)
ASSI { 1362}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 13 and name HA ))
5.700 4.000 0.300 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.59077E-04 ppm1 1.681 ppm2 3.921 CV 1
OR { 1362}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 20 and name HA2 ))
OR { 1362}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 7 and name HA ))
ASSI { 1367}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 26 and name HN ))
4.500 2.600 1.500 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.49724E-03 ppm1 1.679 ppm2 7.492 CV 1
OR { 1367}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 54 and name HZ ))
ASSI { 1368}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 15 and name HB ))
4.200 2.200 1.800 peak 1368 spectrum 1 weight 0.10000E+01 volume 0.76149E-03 ppm1 1.678 ppm2 2.243 CV 1
OR { 1368}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 13 and name HG2 ))
OR { 1368}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 13 and name HB1 ))
OR { 1368}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 13 and name HB2 ))
ASSI { 1369}
( segid " " and resid 12 and name HB% )
( segid " " and resid 26 and name HG2%)
3.000 1.100 1.100 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.14202E-02 ppm1 1.678 ppm2 0.879 CV 1
OR { 1369}
( segid " " and resid 12 and name HB% )
( segid " " and resid 8 and name HG1%)
ASSI { 1375}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 16 and name HB1 ))
3.400 1.400 1.400 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.11660E-02 ppm1 3.939 ppm2 3.105 CV 1
OR { 1375}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 16 and name HB1 ))
ASSI { 1396}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 38 and name HB ))
3.700 1.700 1.700 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.56451E-03 ppm1 4.515 ppm2 1.879 CV 1
OR { 1396}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 43 and name HB2 ))
ASSI { 1398}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 32 and name HB1 ))
4.000 2.000 2.000 peak 1398 spectrum 1 weight 0.10000E+01 volume 0.62721E-03 ppm1 4.519 ppm2 3.118 CV 1
OR { 1398}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 32 and name HB2 ))
OR { 1398}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 39 and name HB1 ))
ASSI { 1413}
(( segid " " and resid 14 and name HB ))
( segid " " and resid 11 and name HD2%)
4.300 2.400 1.700 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.61921E-03 ppm1 2.086 ppm2 0.849 CV 1
OR { 1413}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 53 and name HG1 ))
OR { 1413}
(( segid " " and resid 14 and name HB ))
( segid " " and resid 21 and name HD1%)
OR { 1413}
(( segid " " and resid 14 and name HB ))
( segid " " and resid 11 and name HD1%)
OR { 1413}
(( segid " " and resid 14 and name HB ))
( segid " " and resid 47 and name HG1%)
ASSI { 1426}
( segid " " and resid 14 and name HG2%)
( segid " " and resid 18 and name HD1%)
2.700 0.900 0.900 peak 1426 spectrum 1 weight 0.10000E+01 volume 0.67123E-02 ppm1 1.049 ppm2 0.732 CV 1
OR { 1426}
( segid " " and resid 14 and name HG2%)
( segid " " and resid 14 and name HD1%)
ASSI { 1429}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 10 and name HA1 ))
4.200 2.200 1.800 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.52292E-03 ppm1 0.724 ppm2 4.081 CV 1
OR { 1429}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 12 and name HA ))
ASSI { 1434}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 14 and name HA ))
4.100 2.100 1.900 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.72823E-03 ppm1 0.724 ppm2 3.818 CV 1
OR { 1434}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 10 and name HA2 ))
ASSI { 1444}
( segid " " and resid 14 and name HD1%)
( segid " " and resid 15 and name HG2%)
4.700 2.700 1.300 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.53577E-03 ppm1 0.731 ppm2 1.177 CV 1
OR { 1444}
( segid " " and resid 18 and name HD1%)
( segid " " and resid 15 and name HG2%)
ASSI { 1445}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 13 and name HB2 ))
3.500 1.600 1.600 peak 1445 spectrum 1 weight 0.10000E+01 volume 0.45728E-03 ppm1 0.728 ppm2 2.227 CV 1
OR { 1445}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 46 and name HB ))
OR { 1445}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 46 and name HB ))
OR { 1445}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 15 and name HB ))
OR { 1445}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 44 and name HB ))
ASSI { 1451}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HN ))
3.400 1.400 1.400 peak 1451 spectrum 1 weight 0.10000E+01 volume 0.83830E-03 ppm1 3.597 ppm2 7.003 CV 1
OR { 1451}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 32 and name HE% )
ASSI { 1456}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB ))
2.500 0.800 0.800 peak 1456 spectrum 1 weight 0.10000E+01 volume 0.53217E-02 ppm1 3.587 ppm2 2.225 CV 1
OR { 1456}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB ))
OR { 1456}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 47 and name HB ))
OR { 1456}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 46 and name HB ))
ASSI { 1459}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HB ))
2.400 0.700 0.700 peak 1459 spectrum 1 weight 0.10000E+01 volume 0.33158E-02 ppm1 3.600 ppm2 1.652 CV 1
OR { 1459}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 12 and name HB% )
OR { 1459}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HG11))
ASSI { 1461}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HG12))
4.200 2.200 1.800 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.46001E-03 ppm1 3.596 ppm2 1.289 CV 1
OR { 1461}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 21 and name HG11))
OR { 1461}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 21 and name HG12))
ASSI { 1462}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 18 and name HD1%)
4.400 2.400 1.600 peak 1462 spectrum 1 weight 0.10000E+01 volume 0.75713E-03 ppm1 3.594 ppm2 0.756 CV 1
OR { 1462}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 14 and name HD1%)
OR { 1462}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 18 and name HD1%)
ASSI { 1467}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 11 and name HA ))
3.600 1.600 1.600 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.55642E-03 ppm1 1.167 ppm2 4.255 CV 1
OR { 1467}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 49 and name HA ))
ASSI { 1476}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 44 and name HN ))
4.500 2.500 1.500 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.49800E-03 ppm1 1.166 ppm2 7.316 CV 1
OR { 1476}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 37 and name HN ))
ASSI { 1478}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 13 and name HN ))
4.700 2.800 1.300 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.43324E-03 ppm1 1.166 ppm2 7.936 CV 1
OR { 1478}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 47 and name HN ))
ASSI { 1480}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 43 and name HG1 ))
3.400 1.500 1.500 peak 1480 spectrum 1 weight 0.10000E+01 volume 0.83960E-03 ppm1 1.169 ppm2 2.363 CV 1
OR { 1480}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 26 and name HB ))
ASSI { 1481}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 14 and name HG11))
4.500 2.600 1.500 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.68630E-03 ppm1 1.163 ppm2 2.018 CV 1
OR { 1481}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 11 and name HG ))
ASSI { 1482}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 43 and name HB2 ))
4.100 2.100 1.900 peak 1482 spectrum 1 weight 0.10000E+01 volume 0.41013E-03 ppm1 1.163 ppm2 1.904 CV 1
OR { 1482}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 38 and name HB ))
ASSI { 1484}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 21 and name HA ))
4.300 2.300 1.700 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.93509E-03 ppm1 0.996 ppm2 4.339 CV 1
OR { 1484}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 36 and name HA ))
OR { 1484}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 42 and name HA ))
ASSI { 1494}
( segid " " and resid 46 and name HG2%)
( segid " " and resid 32 and name HE% )
3.600 1.600 1.600 peak 1494 spectrum 1 weight 0.10000E+01 volume 0.10073E-02 ppm1 0.992 ppm2 6.996 CV 1
OR { 1494}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 45 and name HN ))
OR { 1494}
( segid " " and resid 15 and name HG1%)
( segid " " and resid 32 and name HE% )
ASSI { 1499}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 32 and name HN ))
2.900 1.100 1.100 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.15705E-02 ppm1 4.085 ppm2 8.193 CV 1
OR { 1499}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HN ))
OR { 1499}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 69 and name HN ))
ASSI { 1501}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 43 and name HN ))
4.400 2.500 1.600 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.62281E-03 ppm1 4.083 ppm2 8.327 CV 1
OR { 1501}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 71 and name HN ))
ASSI { 1502}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 36 and name HN ))
3.700 1.700 1.700 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.88663E-03 ppm1 4.083 ppm2 7.473 CV 1
OR { 1502}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 36 and name HN ))
ASSI { 1503}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 32 and name HD% )
3.000 1.200 1.200 peak 1503 spectrum 1 weight 0.10000E+01 volume 0.15676E-02 ppm1 4.081 ppm2 7.187 CV 1
OR { 1503}
(( segid " " and resid 31 and name HB1 ))
( segid " " and resid 32 and name HD% )
ASSI { 1506}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 35 and name HN ))
3.700 1.700 1.700 peak 1506 spectrum 1 weight 0.10000E+01 volume 0.68463E-03 ppm1 4.088 ppm2 7.701 CV 1
OR { 1506}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 35 and name HN ))
ASSI { 1514}
(( segid " " and resid 18 and name HG12))
( segid " " and resid 18 and name HG2%)
3.400 1.400 1.400 peak 1514 spectrum 1 weight 0.10000E+01 volume 0.20178E-02 ppm1 1.303 ppm2 0.932 CV 1
OR { 1514}
(( segid " " and resid 18 and name HG12))
( segid " " and resid 46 and name HG2%)
ASSI { 1515}
(( segid " " and resid 18 and name HG11))
( segid " " and resid 18 and name HG2%)
3.000 1.100 1.100 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.15006E-02 ppm1 1.635 ppm2 0.934 CV 1
OR { 1515}
(( segid " " and resid 18 and name HG11))
( segid " " and resid 46 and name HG2%)
ASSI { 1520}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 47 and name HN ))
4.300 2.300 1.700 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.52916E-03 ppm1 0.938 ppm2 7.923 CV 1
OR { 1520}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 49 and name HN ))
ASSI { 1528}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 17 and name HG1 ))
4.000 2.000 2.000 peak 1528 spectrum 1 weight 0.10000E+01 volume 0.60203E-03 ppm1 0.769 ppm2 2.431 CV 1
OR { 1528}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 45 and name HG1 ))
ASSI { 1532}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 21 and name HA ))
6.000 5.000 0.000 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.46558E-04 ppm1 1.526 ppm2 4.286 CV 1
OR { 1532}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 42 and name HA ))
ASSI { 1534}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 18 and name HN ))
4.800 2.800 1.200 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.35645E-03 ppm1 1.532 ppm2 8.236 CV 1
OR { 1534}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 39 and name HN ))
ASSI { 1535}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 38 and name HN ))
5.400 3.600 0.600 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.91486E-04 ppm1 1.538 ppm2 8.040 CV 1
OR { 1535}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 16 and name HD22))
ASSI { 1540}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 36 and name HB1 ))
3.600 1.600 1.600 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.24541E-02 ppm1 4.080 ppm2 2.277 CV 1
OR { 1540}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 43 and name HG2 ))
OR { 1540}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 15 and name HB ))
OR { 1540}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 69 and name HB ))
ASSI { 1545}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 36 and name HG ))
3.400 1.400 1.400 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.85170E-03 ppm1 4.074 ppm2 1.466 CV 1
OR { 1545}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 36 and name HG ))
ASSI { 1546}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 36 and name HB2 ))
3.100 1.200 1.200 peak 1546 spectrum 1 weight 0.10000E+01 volume 0.12429E-02 ppm1 4.076 ppm2 1.595 CV 1
OR { 1546}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 36 and name HB2 ))
OR { 1546}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 30 and name HD1 ))
OR { 1546}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 67 and name HG1 ))
ASSI { 1553}
(( segid " " and resid 42 and name HB1 ))
(( segid " " and resid 42 and name HN ))
3.700 1.700 1.700 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.11344E-02 ppm1 3.958 ppm2 8.387 CV 1
OR { 1553}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 17 and name HN ))
ASSI { 1561}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 43 and name HG1 ))
4.400 2.400 1.600 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.60513E-03 ppm1 1.262 ppm2 2.316 CV 1
OR { 1561}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 36 and name HB1 ))
OR { 1561}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 43 and name HG2 ))
ASSI { 1566}
(( segid " " and resid 66 and name HB1 ))
( segid " " and resid 66 and name HD2%)
3.200 1.300 1.300 peak 1566 spectrum 1 weight 0.10000E+01 volume 0.92223E-03 ppm1 2.186 ppm2 0.616 CV 1
OR { 1566}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 40 and name H6A ))
OR { 1566}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 40 and name H5B ))
OR { 1566}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 40 and name H5A ))
ASSI { 1568}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 76 and name HG11))
4.000 2.000 2.000 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.42604E-03 ppm1 0.403 ppm2 1.946 CV 1
OR { 1568}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 74 and name HB1 ))
OR { 1568}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 74 and name HB2 ))
OR { 1568}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 11 and name HG ))
OR { 1568}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 59 and name HG2 ))
ASSI { 1569}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 58 and name HB ))
3.500 3.500 2.500 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.55010E-03 ppm1 0.411 ppm2 1.662 CV 1
OR { 1569}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 74 and name HD2 ))
OR { 1569}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 77 and name HG ))
OR { 1569}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 77 and name HB2 ))
ASSI { 1571}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 75 and name HA ))
5.300 3.500 0.700 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.21662E-03 ppm1 0.410 ppm2 4.228 CV 1
OR { 1571}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 73 and name HB ))
ASSI { 1574}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 66 and name HD1%)
2.600 2.600 3.400 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.13868E-02 ppm1 0.515 ppm2 0.394 CV 1
OR { 1574}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 69 and name HG1%)
ASSI { 1597}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 27 and name HA ))
3.300 3.300 2.700 peak 1597 spectrum 1 weight 0.10000E+01 volume 0.46985E-03 ppm1 0.757 ppm2 4.648 CV 1
OR { 1597}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 16 and name HA ))
OR { 1597}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 34 and name HA ))
OR { 1597}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 39 and name HA ))
ASSI { 1600}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 8 and name HG1%)
3.300 1.400 1.400 peak 1600 spectrum 1 weight 0.10000E+01 volume 0.10218E-02 ppm1 4.667 ppm2 0.914 CV 1
OR { 1600}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 28 and name HD2%)
OR { 1600}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 38 and name HG1%)
OR { 1600}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 26 and name HG2%)
ASSI { 1603}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 23 and name HA ))
4.300 2.300 1.700 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.42637E-03 ppm1 2.742 ppm2 3.610 CV 1
OR { 1603}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 15 and name HA ))
ASSI { 1612}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 43 and name HN ))
3.500 1.500 1.500 peak 1612 spectrum 1 weight 0.10000E+01 volume 0.58968E-03 ppm1 3.649 ppm2 8.278 CV 1
OR { 1612}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 39 and name HN ))
ASSI { 1613}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 45 and name HA ))
3.300 3.300 2.700 peak 1613 spectrum 1 weight 0.10000E+01 volume 0.12072E-02 ppm1 3.652 ppm2 4.086 CV 1
OR { 1613}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 40 and name HB1 ))
OR { 1613}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 32 and name HA ))
ASSI { 1615}
(( segid " " and resid 42 and name HB2 ))
( segid " " and resid 18 and name HG2%)
3.200 1.300 1.300 peak 1615 spectrum 1 weight 0.10000E+01 volume 0.19621E-02 ppm1 3.656 ppm2 0.933 CV 1
OR { 1615}
(( segid " " and resid 42 and name HB2 ))
( segid " " and resid 38 and name HG1%)
ASSI { 1616}
(( segid " " and resid 42 and name HB2 ))
( segid " " and resid 19 and name HB% )
3.600 1.600 1.600 peak 1616 spectrum 1 weight 0.10000E+01 volume 0.40527E-03 ppm1 3.647 ppm2 1.545 CV 1
OR { 1616}
(( segid " " and resid 42 and name HB2 ))
( segid " " and resid 43 and name HE% )
ASSI { 1622}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 46 and name HG1%)
3.400 1.500 1.500 peak 1622 spectrum 1 weight 0.10000E+01 volume 0.92563E-03 ppm1 3.946 ppm2 0.668 CV 1
OR { 1622}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HG2 ))
ASSI { 1623}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 46 and name HG2%)
2.500 0.800 0.800 peak 1623 spectrum 1 weight 0.10000E+01 volume 0.56706E-02 ppm1 3.948 ppm2 0.938 CV 1
OR { 1623}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 18 and name HG2%)
OR { 1623}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 44 and name HG1%)
OR { 1623}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 47 and name HG2%)
ASSI { 1624}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB2 ))
3.500 1.500 1.500 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.68438E-03 ppm1 3.946 ppm2 1.106 CV 1
OR { 1624}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 44 and name HG2%)
ASSI { 1625}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HG2 ))
2.200 0.600 0.600 peak 1625 spectrum 1 weight 0.10000E+01 volume 0.89375E-02 ppm1 3.944 ppm2 2.273 CV 1
OR { 1625}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HB ))
OR { 1625}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 52 and name HG2 ))
ASSI { 1634}
( segid " " and resid 49 and name HB% )
(( segid " " and resid 48 and name HA ))
4.100 2.100 1.900 peak 1634 spectrum 1 weight 0.10000E+01 volume 0.87813E-03 ppm1 1.524 ppm2 3.904 CV 1
OR { 1634}
( segid " " and resid 49 and name HB% )
(( segid " " and resid 53 and name HA ))
ASSI { 1638}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name HA ))
2.500 2.500 3.500 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.22650E-02 ppm1 1.538 ppm2 4.160 CV 1
OR { 1638}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name HB2 ))
OR { 1638}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 33 and name HB ))
OR { 1638}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name HB1 ))
OR { 1638}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 60 and name HA ))
ASSI { 1644}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H37A))
3.400 1.400 1.400 peak 1644 spectrum 1 weight 0.10000E+01 volume 0.15029E-02 ppm1 1.536 ppm2 3.402 CV 1
OR { 1644}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 46 and name HA ))
ASSI { 1645}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H42B))
3.800 1.800 1.800 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.80957E-03 ppm1 1.543 ppm2 3.257 CV 1
OR { 1645}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 47 and name HA ))
ASSI { 1656}
( segid " " and resid 43 and name HE% )
( segid " " and resid 47 and name HG2%)
2.600 0.900 0.900 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.69920E-02 ppm1 1.539 ppm2 0.916 CV 1
OR { 1656}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H7B ))
OR { 1656}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H7A ))
ASSI { 1660}
( segid " " and resid 43 and name HE% )
( segid " " and resid 32 and name HE% )
3.600 1.700 1.700 peak 1660 spectrum 1 weight 0.10000E+01 volume 0.11568E-02 ppm1 1.539 ppm2 6.984 CV 1
OR { 1660}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 45 and name HN ))
ASSI { 1661}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 32 and name HZ ))
3.100 3.100 2.900 peak 1661 spectrum 1 weight 0.10000E+01 volume 0.70524E-03 ppm1 1.540 ppm2 6.841 CV 1
OR { 1661}
( segid " " and resid 43 and name HE% )
( segid " " and resid 75 and name HD% )
ASSI { 1663}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 46 and name HN ))
3.800 1.800 1.800 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.97765E-03 ppm1 1.538 ppm2 8.062 CV 1
OR { 1663}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H36A))
ASSI { 1676}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 79 and name HB2 ))
3.600 1.700 1.700 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.66109E-03 ppm1 3.493 ppm2 2.511 CV 1
OR { 1676}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 78 and name HB1 ))
ASSI { 1685}
(( segid " " and resid 13 and name HG2 ))
( segid " " and resid 9 and name HB% )
3.500 1.500 1.500 peak 1685 spectrum 1 weight 0.10000E+01 volume 0.65916E-03 ppm1 2.292 ppm2 1.532 CV 1
OR { 1685}
(( segid " " and resid 45 and name HG2 ))
( segid " " and resid 49 and name HB% )
OR { 1685}
(( segid " " and resid 45 and name HG2 ))
( segid " " and resid 43 and name HE% )
OR { 1685}
(( segid " " and resid 13 and name HG2 ))
( segid " " and resid 50 and name HB% )
OR { 1685}
(( segid " " and resid 13 and name HG2 ))
( segid " " and resid 49 and name HB% )
OR { 1685}
(( segid " " and resid 13 and name HG2 ))
( segid " " and resid 2 and name HB% )
ASSI { 1691}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 35 and name HB1 ))
3.700 3.700 2.300 peak 1691 spectrum 1 weight 0.10000E+01 volume 0.16956E-03 ppm1 5.246 ppm2 3.002 CV 1
OR { 1691}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 30 and name HE1 ))
ASSI { 1692}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 71 and name HB1 ))
4.300 2.300 1.700 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.27105E-03 ppm1 5.251 ppm2 3.133 CV 1
OR { 1692}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 32 and name HB2 ))
ASSI { 1694}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 73 and name HN ))
4.200 2.200 1.800 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.50080E-03 ppm1 4.499 ppm2 8.664 CV 1
OR { 1694}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 60 and name HN ))
OR { 1694}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 61 and name HN ))
ASSI { 1712}
(( segid " " and resid 68 and name HB ))
(( segid " " and resid 29 and name HA ))
3.500 1.500 1.500 peak 1712 spectrum 1 weight 0.10000E+01 volume 0.10250E-02 ppm1 4.345 ppm2 4.468 CV 1
OR { 1712}
(( segid " " and resid 68 and name HB ))
(( segid " " and resid 71 and name HA ))
ASSI { 1742}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 43 and name HN ))
4.000 2.000 2.000 peak 1742 spectrum 1 weight 0.10000E+01 volume 0.12514E-02 ppm1 2.279 ppm2 8.312 CV 1
OR { 1742}
(( segid " " and resid 69 and name HB ))
(( segid " " and resid 71 and name HN ))
ASSI { 1747}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 11 and name HB1 ))
4.400 2.500 1.600 peak 1747 spectrum 1 weight 0.10000E+01 volume 0.83453E-04 ppm1 0.441 ppm2 2.153 CV 1
OR { 1747}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 66 and name HB1 ))
OR { 1747}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 4 and name HG2 ))
ASSI { 1754}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 27 and name HA ))
3.400 3.400 2.600 peak 1754 spectrum 1 weight 0.10000E+01 volume 0.27931E-03 ppm1 0.437 ppm2 4.628 CV 1
OR { 1754}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 25 and name HA ))
OR { 1754}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 34 and name HA ))
ASSI { 1756}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 35 and name HB2 ))
3.300 3.300 2.700 peak 1756 spectrum 1 weight 0.10000E+01 volume 0.33567E-03 ppm1 0.436 ppm2 2.738 CV 1
OR { 1756}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 29 and name HB1 ))
OR { 1756}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 34 and name HB1 ))
ASSI { 1759}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 40 and name H2B ))
3.300 3.300 2.700 peak 1759 spectrum 1 weight 0.10000E+01 volume 0.33977E-03 ppm1 0.436 ppm2 2.438 CV 1
OR { 1759}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 40 and name H2A ))
OR { 1759}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 34 and name HB2 ))
OR { 1759}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 37 and name HB2 ))
ASSI { 1760}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 27 and name HA ))
3.000 3.000 3.000 peak 1760 spectrum 1 weight 0.10000E+01 volume 0.54470E-03 ppm1 0.648 ppm2 4.627 CV 1
OR { 1760}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 16 and name HA ))
ASSI { 1762}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 35 and name HB1 ))
3.500 1.500 1.500 peak 1762 spectrum 1 weight 0.10000E+01 volume 0.28010E-03 ppm1 0.647 ppm2 3.045 CV 1
OR { 1762}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 30 and name HE1 ))
OR { 1762}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 27 and name HE1 ))
OR { 1762}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 27 and name HE2 ))
OR { 1762}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 67 and name HE1 ))
OR { 1762}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 75 and name HB2 ))
ASSI { 1763}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 72 and name HB% )
3.300 1.300 1.300 peak 1763 spectrum 1 weight 0.10000E+01 volume 0.22393E-02 ppm1 1.104 ppm2 1.622 CV 1
OR { 1763}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 77 and name HG ))
ASSI { 1771}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 15 and name HN ))
3.900 1.900 1.900 peak 1771 spectrum 1 weight 0.10000E+01 volume 0.91562E-03 ppm1 0.668 ppm2 8.790 CV 1
OR { 1771}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 50 and name HN ))
ASSI { 1776}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 8 and name HN ))
3.500 1.500 1.500 peak 1776 spectrum 1 weight 0.10000E+01 volume 0.22933E-03 ppm1 0.587 ppm2 8.401 CV 1
OR { 1776}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 7 and name HN ))
OR { 1776}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 10 and name HN ))
OR { 1776}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 8 and name HN ))
ASSI { 1778}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 54 and name HB2 ))
3.500 1.500 1.500 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.66310E-03 ppm1 0.590 ppm2 2.741 CV 1
OR { 1778}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 54 and name HB2 ))
OR { 1778}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 80 and name HG1 ))
ASSI { 1779}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 51 and name HB2 ))
3.200 1.300 1.300 peak 1779 spectrum 1 weight 0.10000E+01 volume 0.62046E-03 ppm1 0.594 ppm2 2.093 CV 1
OR { 1779}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 11 and name HB1 ))
OR { 1779}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 48 and name HB ))
OR { 1779}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 80 and name HB2 ))
OR { 1779}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 80 and name HB2 ))
ASSI { 1795}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 73 and name HA ))
4.900 3.000 1.100 peak 1795 spectrum 1 weight 0.10000E+01 volume 0.38592E-03 ppm1 0.516 ppm2 3.661 CV 1
OR { 1795}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 4 and name HA ))
ASSI { 1799}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 66 and name HN ))
4.400 2.400 1.600 peak 1799 spectrum 1 weight 0.10000E+01 volume 0.35533E-03 ppm1 0.342 ppm2 7.746 CV 1
OR { 1799}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 65 and name HD22))
OR { 1799}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 79 and name HN ))
ASSI { 1802}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 48 and name HA ))
3.500 3.500 2.500 peak 1802 spectrum 1 weight 0.10000E+01 volume 0.27391E-03 ppm1 0.340 ppm2 3.948 CV 1
OR { 1802}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 50 and name HA ))
OR { 1802}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 74 and name HA ))
ASSI { 1803}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 72 and name HA ))
4.500 2.500 1.500 peak 1803 spectrum 1 weight 0.10000E+01 volume 0.37447E-03 ppm1 0.336 ppm2 4.078 CV 1
OR { 1803}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 64 and name HA ))
ASSI { 1806}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 66 and name HG ))
4.000 2.000 2.000 peak 1806 spectrum 1 weight 0.10000E+01 volume 0.39214E-03 ppm1 0.339 ppm2 1.831 CV 1
OR { 1806}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 64 and name HB1 ))
ASSI { 1808}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 75 and name HB2 ))
5.000 3.100 1.000 peak 1808 spectrum 1 weight 0.10000E+01 volume 0.22437E-03 ppm1 0.338 ppm2 3.085 CV 1
OR { 1808}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 65 and name HB1 ))
ASSI { 1809}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 79 and name HN ))
3.600 1.600 1.600 peak 1809 spectrum 1 weight 0.10000E+01 volume 0.54135E-03 ppm1 3.484 ppm2 7.714 CV 1
OR { 1809}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 80 and name HE22))
ASSI { 1813}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 69 and name HN ))
4.300 2.400 1.700 peak 1813 spectrum 1 weight 0.10000E+01 volume 0.52572E-03 ppm1 2.052 ppm2 8.154 CV 1
OR { 1813}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 32 and name HN ))
OR { 1813}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 69 and name HN ))
ASSI { 1814}
(( segid " " and resid 48 and name HB ))
(( segid " " and resid 46 and name HN ))
4.200 2.200 1.800 peak 1814 spectrum 1 weight 0.10000E+01 volume 0.46177E-03 ppm1 2.058 ppm2 8.042 CV 1
OR { 1814}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 38 and name HN ))
OR { 1814}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 74 and name HN ))
ASSI { 1816}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 29 and name HA ))
3.900 1.900 1.900 peak 1816 spectrum 1 weight 0.10000E+01 volume 0.11281E-02 ppm1 2.055 ppm2 4.479 CV 1
OR { 1816}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 33 and name HA ))
OR { 1816}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 29 and name HA ))
ASSI { 1821}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 14 and name HG2%)
4.600 2.700 1.400 peak 1821 spectrum 1 weight 0.10000E+01 volume 0.33057E-03 ppm1 3.295 ppm2 1.048 CV 1
OR { 1821}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 14 and name HG12))
OR { 1821}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 53 and name HB2 ))
ASSI { 1822}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 14 and name HD1%)
4.000 2.000 2.000 peak 1822 spectrum 1 weight 0.10000E+01 volume 0.77392E-03 ppm1 3.301 ppm2 0.726 CV 1
OR { 1822}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 40 and name H4A ))
OR { 1822}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 40 and name H4B ))
ASSI { 1823}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HA ))
4.100 2.100 1.900 peak 1823 spectrum 1 weight 0.10000E+01 volume 0.60606E-03 ppm1 3.296 ppm2 3.952 CV 1
OR { 1823}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 50 and name HA ))
ASSI { 1830}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 47 and name HN ))
3.700 1.700 1.700 peak 1830 spectrum 1 weight 0.10000E+01 volume 0.83642E-03 ppm1 4.050 ppm2 7.922 CV 1
OR { 1830}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 49 and name HN ))
ASSI { 1833}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 58 and name HD1%)
4.300 2.300 1.700 peak 1833 spectrum 1 weight 0.10000E+01 volume 0.58909E-03 ppm1 3.946 ppm2 0.598 CV 1
OR { 1833}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 40 and name H8% )
OR { 1833}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 76 and name HD1%)
ASSI { 1834}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 56 and name HG1%)
3.200 1.300 1.300 peak 1834 spectrum 1 weight 0.10000E+01 volume 0.24445E-02 ppm1 3.947 ppm2 0.939 CV 1
OR { 1834}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 47 and name HG2%)
OR { 1834}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 40 and name H7B ))
OR { 1834}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 40 and name H7A ))
OR { 1834}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 76 and name HG12))
OR { 1834}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 56 and name HG2%)
ASSI { 1835}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 52 and name HG2 ))
3.200 1.300 1.300 peak 1835 spectrum 1 weight 0.10000E+01 volume 0.24300E-02 ppm1 3.948 ppm2 2.266 CV 1
OR { 1835}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 51 and name HG2 ))
ASSI { 1838}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 58 and name HG11))
3.500 1.600 1.600 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.77439E-03 ppm1 4.166 ppm2 1.534 CV 1
OR { 1838}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 50 and name HB% )
OR { 1838}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 43 and name HE% )
ASSI { 1844}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 76 and name HG2%)
4.000 2.000 2.000 peak 1844 spectrum 1 weight 0.10000E+01 volume 0.79043E-03 ppm1 2.730 ppm2 0.522 CV 1
OR { 1844}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 7 and name HD1%)
OR { 1844}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 7 and name HG2%)
ASSI { 1850}
( segid " " and resid 47 and name HG2%)
( segid " " and resid 58 and name HD1%)
3.100 1.200 1.200 peak 1850 spectrum 1 weight 0.10000E+01 volume 0.15312E-02 ppm1 0.912 ppm2 0.584 CV 1
OR { 1850}
( segid " " and resid 47 and name HG2%)
( segid " " and resid 40 and name H8% )
ASSI { 1854}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 28 and name HB2 ))
3.600 1.600 1.600 peak 1854 spectrum 1 weight 0.10000E+01 volume 0.57854E-03 ppm1 3.786 ppm2 1.460 CV 1
OR { 1854}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 74 and name HG2 ))
OR { 1854}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 74 and name HG1 ))
OR { 1854}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 1856}
(( segid " " and resid 70 and name HA1 ))
(( segid " " and resid 28 and name HB2 ))
3.600 1.600 1.600 peak 1856 spectrum 1 weight 0.10000E+01 volume 0.57883E-03 ppm1 4.014 ppm2 1.478 CV 1
OR { 1856}
(( segid " " and resid 70 and name HA1 ))
(( segid " " and resid 74 and name HG2 ))
OR { 1856}
(( segid " " and resid 70 and name HA1 ))
(( segid " " and resid 67 and name HG2 ))
OR { 1856}
(( segid " " and resid 70 and name HA1 ))
(( segid " " and resid 74 and name HG1 ))
ASSI { 1858}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HG1 ))
3.300 1.300 1.300 peak 1858 spectrum 1 weight 0.10000E+01 volume 0.18170E-02 ppm1 4.046 ppm2 2.437 CV 1
OR { 1858}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 40 and name H2A ))
OR { 1858}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 40 and name H2B ))
ASSI { 23}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 5 and name HA ))
5.600 3.900 0.400 peak 23 spectrum 1 weight 0.10000E+01 volume 0.12290E-03 ppm1 9.223 ppm2 3.951 CV 1
OR { 23}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 74 and name HA ))
ASSI { 48}
(( segid " " and resid 6 and name HN ))
( segid " " and resid 2 and name HB% )
4.400 2.400 1.600 peak 48 spectrum 1 weight 0.10000E+01 volume 0.83487E-03 ppm1 7.685 ppm2 1.548 CV 1
OR { 48}
(( segid " " and resid 6 and name HN ))
( segid " " and resid 9 and name HB% )
OR { 48}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 7 and name HG11))
ASSI { 49}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB1 ))
3.100 1.200 1.200 peak 49 spectrum 1 weight 0.10000E+01 volume 0.36456E-02 ppm1 7.686 ppm2 2.479 CV 1
OR { 49}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HG1 ))
ASSI { 51}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB2 ))
2.400 0.700 0.700 peak 51 spectrum 1 weight 0.10000E+01 volume 0.29499E-02 ppm1 7.685 ppm2 2.100 CV 1
OR { 51}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HB1 ))
ASSI { 52}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HB2 ))
3.700 1.700 1.700 peak 52 spectrum 1 weight 0.10000E+01 volume 0.89999E-03 ppm1 7.691 ppm2 1.981 CV 1
OR { 52}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 4 and name HB2 ))
ASSI { 76}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 4 and name HA ))
3.900 1.900 1.900 peak 76 spectrum 1 weight 0.10000E+01 volume 0.72069E-03 ppm1 8.381 ppm2 3.705 CV 1
OR { 76}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 73 and name HA ))
ASSI { 78}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 9 and name HN ))
2.700 0.900 0.900 peak 78 spectrum 1 weight 0.10000E+01 volume 0.24574E-02 ppm1 8.381 ppm2 7.727 CV 1
OR { 78}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 6 and name HN ))
ASSI { 89}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 10 and name HN ))
2.300 0.700 0.700 peak 89 spectrum 1 weight 0.10000E+01 volume 0.53682E-02 ppm1 7.727 ppm2 8.385 CV 1
OR { 89}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HN ))
ASSI { 92}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HA ))
3.700 1.700 1.700 peak 92 spectrum 1 weight 0.10000E+01 volume 0.76990E-03 ppm1 8.390 ppm2 4.230 CV 1
OR { 92}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 11 and name HA ))
ASSI { 101}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 11 and name HG ))
4.400 2.400 1.600 peak 101 spectrum 1 weight 0.10000E+01 volume 0.43027E-03 ppm1 8.382 ppm2 2.000 CV 1
OR { 101}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 8 and name HB ))
ASSI { 104}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 76 and name HD1%)
5.300 3.500 0.700 peak 104 spectrum 1 weight 0.10000E+01 volume 0.20644E-03 ppm1 9.226 ppm2 0.637 CV 1
OR { 104}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 46 and name HG1%)
OR { 104}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 40 and name H8% )
OR { 104}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 53 and name HG2 ))
OR { 104}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 69 and name HG2%)
OR { 104}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 40 and name H6B ))
ASSI { 105}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 7 and name HG2%)
4.100 2.100 1.900 peak 105 spectrum 1 weight 0.10000E+01 volume 0.66122E-03 ppm1 9.223 ppm2 0.554 CV 1
OR { 105}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 76 and name HD1%)
OR { 105}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 7 and name HD1%)
ASSI { 107}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 14 and name HD1%)
4.500 2.500 1.500 peak 107 spectrum 1 weight 0.10000E+01 volume 0.31354E-03 ppm1 9.221 ppm2 0.732 CV 1
OR { 107}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 26 and name HG1%)
ASSI { 136}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 26 and name HG2%)
4.000 2.000 2.000 peak 136 spectrum 1 weight 0.10000E+01 volume 0.10429E-02 ppm1 8.917 ppm2 0.893 CV 1
OR { 136}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 8 and name HG1%)
OR { 136}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 11 and name HD1%)
OR { 136}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 11 and name HD2%)
ASSI { 137}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 26 and name HG1%)
3.600 1.600 1.600 peak 137 spectrum 1 weight 0.10000E+01 volume 0.91495E-03 ppm1 8.915 ppm2 0.729 CV 1
OR { 137}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 14 and name HD1%)
ASSI { 140}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 13 and name HG2 ))
4.200 2.200 1.800 peak 140 spectrum 1 weight 0.10000E+01 volume 0.64564E-03 ppm1 8.918 ppm2 2.308 CV 1
OR { 140}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 26 and name HB ))
OR { 140}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 13 and name HB1 ))
ASSI { 142}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HG ))
4.600 2.700 1.400 peak 142 spectrum 1 weight 0.10000E+01 volume 0.42679E-03 ppm1 8.916 ppm2 1.996 CV 1
OR { 142}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 8 and name HB ))
ASSI { 145}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA ))
3.100 1.200 1.200 peak 145 spectrum 1 weight 0.10000E+01 volume 0.13440E-02 ppm1 8.917 ppm2 4.225 CV 1
OR { 145}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 9 and name HA ))
ASSI { 149}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HA ))
3.300 1.300 1.300 peak 149 spectrum 1 weight 0.10000E+01 volume 0.13659E-02 ppm1 7.935 ppm2 4.048 CV 1
OR { 149}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 10 and name HA1 ))
ASSI { 151}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 10 and name HA2 ))
3.700 1.700 1.700 peak 151 spectrum 1 weight 0.10000E+01 volume 0.57138E-03 ppm1 7.933 ppm2 3.837 CV 1
OR { 151}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 14 and name HA ))
ASSI { 157}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 73 and name HG2%)
5.400 3.600 0.600 peak 157 spectrum 1 weight 0.10000E+01 volume 0.26516E-03 ppm1 7.930 ppm2 1.063 CV 1
OR { 157}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 14 and name HG12))
OR { 157}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 14 and name HG2%)
ASSI { 158}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 14 and name HG12))
5.000 3.100 1.000 peak 158 spectrum 1 weight 0.10000E+01 volume 0.35178E-03 ppm1 7.939 ppm2 1.025 CV 1
OR { 158}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 14 and name HG2%)
OR { 158}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 46 and name HG2%)
OR { 158}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 15 and name HG1%)
OR { 158}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 23 and name HG1%)
ASSI { 159}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 23 and name HG2%)
4.300 2.300 1.700 peak 159 spectrum 1 weight 0.10000E+01 volume 0.72492E-03 ppm1 7.935 ppm2 0.958 CV 1
OR { 159}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 26 and name HG2%)
OR { 159}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 46 and name HG2%)
OR { 159}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 15 and name HG1%)
OR { 159}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 23 and name HG1%)
ASSI { 163}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 11 and name HA ))
3.200 1.300 1.300 peak 163 spectrum 1 weight 0.10000E+01 volume 0.11262E-02 ppm1 8.158 ppm2 4.247 CV 1
OR { 163}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 49 and name HA ))
ASSI { 164}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 12 and name HA ))
3.900 1.900 1.900 peak 164 spectrum 1 weight 0.10000E+01 volume 0.44351E-03 ppm1 8.152 ppm2 4.052 CV 1
OR { 164}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 10 and name HA1 ))
ASSI { 165}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HA ))
3.600 1.600 1.600 peak 165 spectrum 1 weight 0.10000E+01 volume 0.70180E-03 ppm1 8.165 ppm2 3.925 CV 1
OR { 165}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 50 and name HA ))
OR { 165}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 53 and name HA ))
ASSI { 167}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB1 ))
3.100 1.200 1.200 peak 167 spectrum 1 weight 0.10000E+01 volume 0.17133E-02 ppm1 8.158 ppm2 2.246 CV 1
OR { 167}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB2 ))
OR { 167}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HG2 ))
OR { 167}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HB ))
ASSI { 213}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 21 and name HG11))
4.600 2.600 1.400 peak 213 spectrum 1 weight 0.10000E+01 volume 0.36665E-03 ppm1 8.469 ppm2 1.290 CV 1
OR { 213}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HG12))
OR { 213}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 21 and name HG12))
ASSI { 214}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 15 and name HB ))
4.300 2.300 1.700 peak 214 spectrum 1 weight 0.10000E+01 volume 0.30738E-03 ppm1 8.469 ppm2 2.240 CV 1
OR { 214}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 17 and name HG2 ))
OR { 214}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 46 and name HB ))
OR { 214}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 36 and name HB1 ))
ASSI { 224}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 16 and name HD22))
4.300 2.400 1.700 peak 224 spectrum 1 weight 0.10000E+01 volume 0.44141E-03 ppm1 6.464 ppm2 8.061 CV 1
OR { 224}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 38 and name HN ))
ASSI { 226}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 16 and name HB1 ))
4.000 2.000 2.000 peak 226 spectrum 1 weight 0.10000E+01 volume 0.23679E-03 ppm1 6.462 ppm2 3.102 CV 1
OR { 226}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 37 and name HB1 ))
OR { 226}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 32 and name HB1 ))
ASSI { 230}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 38 and name HG1%)
4.900 3.000 1.100 peak 230 spectrum 1 weight 0.10000E+01 volume 0.27384E-03 ppm1 6.462 ppm2 0.916 CV 1
OR { 230}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 26 and name HG2%)
OR { 230}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 38 and name HG2%)
ASSI { 234}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HA ))
4.800 2.900 1.200 peak 234 spectrum 1 weight 0.10000E+01 volume 0.40994E-03 ppm1 8.502 ppm2 4.036 CV 1
OR { 234}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HD1 ))
ASSI { 252}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 23 and name HG1%)
3.200 1.300 1.300 peak 252 spectrum 1 weight 0.10000E+01 volume 0.10510E-02 ppm1 7.730 ppm2 0.998 CV 1
OR { 252}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 23 and name HG2%)
OR { 252}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 21 and name HG2%)
OR { 252}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 15 and name HG1%)
ASSI { 264}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 21 and name HG2%)
3.800 1.800 1.800 peak 264 spectrum 1 weight 0.10000E+01 volume 0.68094E-03 ppm1 7.474 ppm2 0.999 CV 1
OR { 264}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 23 and name HG1%)
OR { 264}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 15 and name HG1%)
OR { 264}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 8 and name HG2%)
ASSI { 266}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 27 and name HG1 ))
4.500 2.500 1.500 peak 266 spectrum 1 weight 0.10000E+01 volume 0.27850E-03 ppm1 7.479 ppm2 1.339 CV 1
OR { 266}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 27 and name HG2 ))
OR { 266}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 30 and name HG2 ))
OR { 266}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 268}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HB2 ))
3.800 1.800 1.800 peak 268 spectrum 1 weight 0.10000E+01 volume 0.46244E-03 ppm1 7.477 ppm2 2.021 CV 1
OR { 268}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HB1 ))
OR { 268}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 30 and name HB1 ))
OR { 268}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 27 and name HB1 ))
OR { 268}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 8 and name HB ))
ASSI { 290}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 8 and name HG2%)
5.300 3.500 0.700 peak 290 spectrum 1 weight 0.10000E+01 volume 0.15101E-03 ppm1 8.390 ppm2 1.040 CV 1
OR { 290}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 68 and name HG2%)
ASSI { 296}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 26 and name HG1%)
4.500 2.600 1.500 peak 296 spectrum 1 weight 0.10000E+01 volume 0.43781E-03 ppm1 7.503 ppm2 0.760 CV 1
OR { 296}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 28 and name HD1%)
OR { 296}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 36 and name HD2%)
ASSI { 299}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 68 and name HG2%)
5.100 3.200 0.900 peak 299 spectrum 1 weight 0.10000E+01 volume 0.16178E-03 ppm1 7.497 ppm2 1.068 CV 1
OR { 299}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 8 and name HG2%)
OR { 299}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 73 and name HG2%)
ASSI { 306}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HB1 ))
4.000 2.000 2.000 peak 306 spectrum 1 weight 0.10000E+01 volume 0.56677E-03 ppm1 7.504 ppm2 2.600 CV 1
OR { 306}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB2 ))
ASSI { 307}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 35 and name HB1 ))
4.600 2.700 1.400 peak 307 spectrum 1 weight 0.10000E+01 volume 0.53364E-03 ppm1 7.505 ppm2 3.022 CV 1
OR { 307}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HE1 ))
OR { 307}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 65 and name HB1 ))
ASSI { 323}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 36 and name HB1 ))
5.500 3.800 0.500 peak 323 spectrum 1 weight 0.10000E+01 volume 0.18508E-03 ppm1 10.154 ppm2 2.273 CV 1
OR { 323}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 69 and name HB ))
ASSI { 337}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 36 and name HN ))
4.100 2.100 1.900 peak 337 spectrum 1 weight 0.10000E+01 volume 0.38211E-03 ppm1 10.160 ppm2 7.481 CV 1
OR { 337}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HN ))
ASSI { 350}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HA ))
3.100 1.200 1.200 peak 350 spectrum 1 weight 0.10000E+01 volume 0.11088E-02 ppm1 8.615 ppm2 4.091 CV 1
OR { 350}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HB1 ))
ASSI { 364}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 31 and name HB2 ))
3.100 1.200 1.200 peak 364 spectrum 1 weight 0.10000E+01 volume 0.17987E-02 ppm1 7.700 ppm2 3.862 CV 1
OR { 364}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 77 and name HA ))
ASSI { 369}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HB2 ))
2.600 0.900 0.900 peak 369 spectrum 1 weight 0.10000E+01 volume 0.26056E-02 ppm1 7.705 ppm2 2.506 CV 1
OR { 369}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HB1 ))
ASSI { 370}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 36 and name HG ))
4.600 2.600 1.400 peak 370 spectrum 1 weight 0.10000E+01 volume 0.51366E-03 ppm1 7.704 ppm2 1.459 CV 1
OR { 370}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 30 and name HD2 ))
ASSI { 371}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 76 and name HB ))
4.300 2.300 1.700 peak 371 spectrum 1 weight 0.10000E+01 volume 0.27791E-03 ppm1 7.710 ppm2 1.776 CV 1
OR { 371}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 77 and name HB1 ))
OR { 371}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 30 and name HG1 ))
ASSI { 377}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 38 and name HG1%)
4.500 2.600 1.500 peak 377 spectrum 1 weight 0.10000E+01 volume 0.51768E-03 ppm1 7.462 ppm2 0.947 CV 1
OR { 377}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 21 and name HG2%)
OR { 377}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 38 and name HG2%)
OR { 377}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 26 and name HG2%)
ASSI { 386}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 34 and name HB2 ))
4.100 2.100 1.900 peak 386 spectrum 1 weight 0.10000E+01 volume 0.31277E-03 ppm1 7.468 ppm2 2.476 CV 1
OR { 386}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 37 and name HB2 ))
ASSI { 423}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HB1 ))
5.100 3.300 0.900 peak 423 spectrum 1 weight 0.10000E+01 volume 0.28999E-03 ppm1 8.125 ppm2 3.975 CV 1
OR { 423}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name H32A))
OR { 423}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 43 and name HA ))
ASSI { 431}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 41 and name HD1%)
3.400 1.500 1.500 peak 431 spectrum 1 weight 0.10000E+01 volume 0.10726E-02 ppm1 8.385 ppm2 0.930 CV 1
OR { 431}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 41 and name HD2%)
OR { 431}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 18 and name HG2%)
OR { 431}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 38 and name HG1%)
OR { 431}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 44 and name HG1%)
ASSI { 449}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 18 and name HG2%)
3.000 1.100 1.100 peak 449 spectrum 1 weight 0.10000E+01 volume 0.18723E-02 ppm1 8.312 ppm2 0.919 CV 1
OR { 449}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 38 and name HG2%)
OR { 449}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 38 and name HG1%)
OR { 449}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 41 and name HD1%)
OR { 449}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 47 and name HG2%)
OR { 449}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 40 and name H7B ))
ASSI { 466}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 46 and name HN ))
3.900 1.900 1.900 peak 466 spectrum 1 weight 0.10000E+01 volume 0.65477E-03 ppm1 7.295 ppm2 8.036 CV 1
OR { 466}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 40 and name H36A))
ASSI { 481}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HA ))
2.900 1.100 1.100 peak 481 spectrum 1 weight 0.10000E+01 volume 0.17388E-02 ppm1 8.049 ppm2 3.942 CV 1
OR { 481}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 43 and name HA ))
ASSI { 485}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 18 and name HD1%)
3.600 1.700 1.700 peak 485 spectrum 1 weight 0.10000E+01 volume 0.10645E-02 ppm1 8.047 ppm2 0.775 CV 1
OR { 485}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 77 and name HD2%)
OR { 485}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 77 and name HD1%)
ASSI { 487}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 47 and name HG1%)
4.000 2.000 2.000 peak 487 spectrum 1 weight 0.10000E+01 volume 0.70268E-03 ppm1 8.045 ppm2 0.903 CV 1
OR { 487}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 47 and name HG2%)
OR { 487}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 76 and name HG12))
ASSI { 518}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 46 and name HG1%)
4.300 2.300 1.700 peak 518 spectrum 1 weight 0.10000E+01 volume 0.41257E-03 ppm1 8.773 ppm2 0.623 CV 1
OR { 518}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 58 and name HD1%)
OR { 518}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 40 and name H8% )
OR { 518}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 53 and name HG2 ))
ASSI { 520}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 47 and name HG2%)
5.300 3.500 0.700 peak 520 spectrum 1 weight 0.10000E+01 volume 0.17113E-03 ppm1 8.776 ppm2 0.887 CV 1
OR { 520}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 47 and name HG1%)
OR { 520}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 53 and name HG1 ))
OR { 520}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 11 and name HD2%)
OR { 520}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 40 and name H7B ))
OR { 520}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 40 and name H7A ))
OR { 520}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 58 and name HG12))
ASSI { 521}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HB2 ))
4.500 2.500 1.500 peak 521 spectrum 1 weight 0.10000E+01 volume 0.43706E-03 ppm1 8.771 ppm2 2.088 CV 1
OR { 521}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 52 and name HB1 ))
OR { 521}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 52 and name HB2 ))
ASSI { 522}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 46 and name HA ))
4.000 2.000 2.000 peak 522 spectrum 1 weight 0.10000E+01 volume 0.40900E-03 ppm1 8.773 ppm2 3.423 CV 1
OR { 522}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 54 and name HB1 ))
ASSI { 532}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 47 and name HG2%)
4.100 2.100 1.900 peak 532 spectrum 1 weight 0.10000E+01 volume 0.78863E-03 ppm1 8.839 ppm2 0.870 CV 1
OR { 532}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 47 and name HG1%)
OR { 532}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 53 and name HG1 ))
OR { 532}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 58 and name HG12))
OR { 532}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 11 and name HD2%)
OR { 532}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 63 and name HG2%)
ASSI { 544}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 50 and name HA ))
3.700 1.700 1.700 peak 544 spectrum 1 weight 0.10000E+01 volume 0.94812E-03 ppm1 7.746 ppm2 3.938 CV 1
OR { 544}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 53 and name HA ))
ASSI { 549}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HB1 ))
3.700 1.700 1.700 peak 549 spectrum 1 weight 0.10000E+01 volume 0.17622E-02 ppm1 8.197 ppm2 2.125 CV 1
OR { 549}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 51 and name HB2 ))
ASSI { 559}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 56 and name HG1%)
4.300 2.400 1.700 peak 559 spectrum 1 weight 0.10000E+01 volume 0.45582E-03 ppm1 8.134 ppm2 0.917 CV 1
OR { 559}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 56 and name HG2%)
OR { 559}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 11 and name HD2%)
ASSI { 560}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HG1 ))
4.300 2.300 1.700 peak 560 spectrum 1 weight 0.10000E+01 volume 0.39135E-03 ppm1 8.140 ppm2 0.842 CV 1
OR { 560}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 11 and name HD2%)
ASSI { 582}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 40 and name H2A ))
3.900 1.900 1.900 peak 582 spectrum 1 weight 0.10000E+01 volume 0.50202E-03 ppm1 7.714 ppm2 2.453 CV 1
OR { 582}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 40 and name H2B ))
OR { 582}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 62 and name HB1 ))
ASSI { 601}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HA ))
2.900 1.100 1.100 peak 601 spectrum 1 weight 0.10000E+01 volume 0.17540E-02 ppm1 8.515 ppm2 3.491 CV 1
OR { 601}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HA ))
ASSI { 602}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HG11))
2.300 0.700 0.700 peak 602 spectrum 1 weight 0.10000E+01 volume 0.32701E-02 ppm1 8.516 ppm2 1.957 CV 1
OR { 602}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HG11))
ASSI { 610}
(( segid " " and resid 71 and name HN ))
( segid " " and resid 69 and name HG2%)
5.200 3.300 0.800 peak 610 spectrum 1 weight 0.10000E+01 volume 0.25580E-03 ppm1 8.341 ppm2 0.627 CV 1
OR { 610}
(( segid " " and resid 71 and name HN ))
( segid " " and resid 66 and name HD2%)
ASSI { 625}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HB2 ))
3.400 1.400 1.400 peak 625 spectrum 1 weight 0.10000E+01 volume 0.11045E-02 ppm1 7.278 ppm2 1.772 CV 1
OR { 625}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 66 and name HG ))
ASSI { 643}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 51 and name HB2 ))
4.400 2.400 1.600 peak 643 spectrum 1 weight 0.10000E+01 volume 0.46625E-03 ppm1 7.828 ppm2 2.108 CV 1
OR { 643}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 80 and name HB2 ))
ASSI { 653}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 28 and name HB2 ))
3.700 1.700 1.700 peak 653 spectrum 1 weight 0.10000E+01 volume 0.52828E-03 ppm1 9.414 ppm2 1.462 CV 1
OR { 653}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 67 and name HG2 ))
OR { 653}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 74 and name HG2 ))
OR { 653}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 74 and name HG1 ))
ASSI { 654}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 28 and name HB1 ))
4.100 2.100 1.900 peak 654 spectrum 1 weight 0.10000E+01 volume 0.30147E-03 ppm1 9.418 ppm2 1.737 CV 1
OR { 654}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 28 and name HG ))
OR { 654}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 7 and name HB ))
ASSI { 656}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 28 and name HD2%)
4.200 2.200 1.800 peak 656 spectrum 1 weight 0.10000E+01 volume 0.39787E-03 ppm1 9.413 ppm2 0.893 CV 1
OR { 656}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 11 and name HD1%)
OR { 656}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 11 and name HD2%)
OR { 656}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 66 and name HB2 ))
OR { 656}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 76 and name HG12))
ASSI { 657}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 28 and name HD1%)
3.800 1.800 1.800 peak 657 spectrum 1 weight 0.10000E+01 volume 0.10549E-02 ppm1 9.415 ppm2 0.799 CV 1
OR { 657}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 11 and name HD1%)
ASSI { 691}
(( segid " " and resid 80 and name HN ))
( segid " " and resid 76 and name HG2%)
4.100 2.100 1.900 peak 691 spectrum 1 weight 0.10000E+01 volume 0.36151E-03 ppm1 7.882 ppm2 0.515 CV 1
OR { 691}
(( segid " " and resid 80 and name HN ))
( segid " " and resid 7 and name HD1%)
ASSI { 701}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 59 and name HB2 ))
3.000 1.100 1.100 peak 701 spectrum 1 weight 0.10000E+01 volume 0.16824E-02 ppm1 7.481 ppm2 1.941 CV 1
OR { 701}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 59 and name HG1 ))
OR { 701}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HB ))
OR { 701}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 714}
(( segid " " and resid 80 and name HE21))
( segid " " and resid 1 and name HB% )
3.500 1.600 1.600 peak 714 spectrum 1 weight 0.10000E+01 volume 0.11964E-02 ppm1 7.634 ppm2 1.524 CV 1
OR { 714}
(( segid " " and resid 80 and name HE21))
( segid " " and resid 2 and name HB% )
ASSI { 716}
(( segid " " and resid 80 and name HE21))
( segid " " and resid 7 and name HD1%)
3.200 1.300 1.300 peak 716 spectrum 1 weight 0.10000E+01 volume 0.12712E-02 ppm1 7.634 ppm2 0.525 CV 1
OR { 716}
(( segid " " and resid 80 and name HE21))
( segid " " and resid 76 and name HG2%)
ASSI { 717}
(( segid " " and resid 80 and name HE22))
( segid " " and resid 7 and name HD1%)
3.200 1.300 1.300 peak 717 spectrum 1 weight 0.10000E+01 volume 0.85208E-03 ppm1 7.733 ppm2 0.525 CV 1
OR { 717}
(( segid " " and resid 80 and name HE22))
( segid " " and resid 76 and name HG2%)
ASSI { 724}
(( segid " " and resid 4 and name HE22))
( segid " " and resid 28 and name HD1%)
4.000 2.000 2.000 peak 724 spectrum 1 weight 0.10000E+01 volume 0.68932E-03 ppm1 7.505 ppm2 0.807 CV 1
OR { 724}
(( segid " " and resid 4 and name HE22))
( segid " " and resid 77 and name HD2%)
ASSI { 725}
(( segid " " and resid 16 and name HD22))
(( segid " " and resid 22 and name HA ))
3.100 1.200 1.200 peak 725 spectrum 1 weight 0.10000E+01 volume 0.16865E-02 ppm1 8.062 ppm2 4.298 CV 1
OR { 725}
(( segid " " and resid 16 and name HD22))
(( segid " " and resid 21 and name HA ))
ASSI { 727}
(( segid " " and resid 16 and name HD22))
(( segid " " and resid 20 and name HA2 ))
4.000 2.000 2.000 peak 727 spectrum 1 weight 0.10000E+01 volume 0.43190E-03 ppm1 8.066 ppm2 3.935 CV 1
OR { 727}
(( segid " " and resid 16 and name HD22))
(( segid " " and resid 17 and name HA ))
ASSI { 730}
(( segid " " and resid 16 and name HD22))
( segid " " and resid 23 and name HG2%)
3.800 1.800 1.800 peak 730 spectrum 1 weight 0.10000E+01 volume 0.10432E-02 ppm1 8.058 ppm2 0.983 CV 1
OR { 730}
(( segid " " and resid 16 and name HD22))
( segid " " and resid 23 and name HG1%)
OR { 730}
(( segid " " and resid 16 and name HD22))
( segid " " and resid 15 and name HG1%)
OR { 730}
(( segid " " and resid 16 and name HD22))
( segid " " and resid 21 and name HG2%)
ASSI { 733}
(( segid " " and resid 16 and name HD21))
( segid " " and resid 23 and name HG2%)
3.900 1.900 1.900 peak 733 spectrum 1 weight 0.10000E+01 volume 0.70607E-03 ppm1 6.843 ppm2 1.003 CV 1
OR { 733}
(( segid " " and resid 16 and name HD21))
( segid " " and resid 23 and name HG1%)
OR { 733}
(( segid " " and resid 16 and name HD21))
( segid " " and resid 21 and name HG2%)
OR { 733}
(( segid " " and resid 16 and name HD21))
( segid " " and resid 15 and name HG1%)
ASSI { 735}
(( segid " " and resid 16 and name HD21))
(( segid " " and resid 22 and name HA ))
3.100 1.200 1.200 peak 735 spectrum 1 weight 0.10000E+01 volume 0.14042E-02 ppm1 6.853 ppm2 4.302 CV 1
OR { 735}
(( segid " " and resid 16 and name HD21))
(( segid " " and resid 21 and name HA ))
ASSI { 742}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HA ))
3.100 1.200 1.200 peak 742 spectrum 1 weight 0.10000E+01 volume 0.10641E-02 ppm1 8.257 ppm2 3.907 CV 1
OR { 742}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 74 and name HA ))
ASSI { 743}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HB1 ))
2.600 0.900 0.900 peak 743 spectrum 1 weight 0.10000E+01 volume 0.34430E-02 ppm1 8.258 ppm2 2.529 CV 1
OR { 743}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 79 and name HB2 ))
ASSI { 745}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HB1 ))
3.200 1.300 1.300 peak 745 spectrum 1 weight 0.10000E+01 volume 0.22295E-02 ppm1 8.259 ppm2 1.770 CV 1
OR { 745}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 76 and name HB ))
ASSI { 747}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HA ))
2.600 0.800 0.800 peak 747 spectrum 1 weight 0.10000E+01 volume 0.26124E-02 ppm1 8.491 ppm2 3.901 CV 1
OR { 747}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 74 and name HA ))
OR { 747}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 74 and name HA ))
ASSI { 748}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HG ))
2.600 0.800 0.800 peak 748 spectrum 1 weight 0.10000E+01 volume 0.38522E-02 ppm1 8.491 ppm2 1.634 CV 1
OR { 748}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HB2 ))
OR { 748}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 72 and name HB% )
ASSI { 749}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HB ))
2.000 0.500 0.500 peak 749 spectrum 1 weight 0.10000E+01 volume 0.78163E-02 ppm1 8.496 ppm2 1.772 CV 1
OR { 749}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HB ))
OR { 749}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HB1 ))
ASSI { 759}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 11 and name HD1%)
3.700 1.700 1.700 peak 759 spectrum 1 weight 0.10000E+01 volume 0.11737E-02 ppm1 8.643 ppm2 0.827 CV 1
OR { 759}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 63 and name HG1%)
OR { 759}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 77 and name HD2%)
OR { 759}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 28 and name HD1%)
OR { 759}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 77 and name HD1%)
ASSI { 761}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 76 and name HD1%)
4.300 2.300 1.700 peak 761 spectrum 1 weight 0.10000E+01 volume 0.56610E-03 ppm1 8.642 ppm2 0.563 CV 1
OR { 761}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 7 and name HG2%)
OR { 761}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 66 and name HD2%)
OR { 761}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 76 and name HG2%)
OR { 761}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 7 and name HD1%)
ASSI { 766}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HB1 ))
2.800 1.000 1.000 peak 766 spectrum 1 weight 0.10000E+01 volume 0.24550E-02 ppm1 7.940 ppm2 1.970 CV 1
OR { 766}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 76 and name HG11))
ASSI { 767}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HB2 ))
3.300 1.400 1.400 peak 767 spectrum 1 weight 0.10000E+01 volume 0.14903E-02 ppm1 7.939 ppm2 1.912 CV 1
OR { 767}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 76 and name HG11))
ASSI { 769}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 66 and name HD2%)
3.900 1.900 1.900 peak 769 spectrum 1 weight 0.10000E+01 volume 0.12149E-02 ppm1 7.939 ppm2 0.610 CV 1
OR { 769}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 76 and name HD1%)
OR { 769}
(( segid " " and resid 34 and name HN ))
( segid " " and resid 36 and name HD1%)
ASSI { 785}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 15 and name HG1%)
4.200 2.200 1.800 peak 785 spectrum 1 weight 0.10000E+01 volume 0.45385E-03 ppm1 7.808 ppm2 0.985 CV 1
OR { 785}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 21 and name HG2%)
OR { 785}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 38 and name HG2%)
ASSI { 788}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 11 and name HA ))
3.700 1.700 1.700 peak 788 spectrum 1 weight 0.10000E+01 volume 0.53804E-03 ppm1 8.789 ppm2 4.246 CV 1
OR { 788}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 49 and name HA ))
ASSI { 795}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 15 and name HG1%)
3.700 1.700 1.700 peak 795 spectrum 1 weight 0.10000E+01 volume 0.21471E-02 ppm1 8.789 ppm2 1.010 CV 1
OR { 795}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HG12))
ASSI { 811}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 13 and name HA ))
3.500 1.600 1.600 peak 811 spectrum 1 weight 0.10000E+01 volume 0.13392E-02 ppm1 8.688 ppm2 3.935 CV 1
OR { 811}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 17 and name HA ))
OR { 811}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 20 and name HA2 ))
OR { 811}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 18 and name HA ))
ASSI { 812}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 12 and name HA ))
3.800 1.800 1.800 peak 812 spectrum 1 weight 0.10000E+01 volume 0.51965E-03 ppm1 8.691 ppm2 4.043 CV 1
OR { 812}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 20 and name HA1 ))
ASSI { 815}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 12 and name HB% )
4.600 2.600 1.400 peak 815 spectrum 1 weight 0.10000E+01 volume 0.29000E-03 ppm1 8.689 ppm2 1.676 CV 1
OR { 815}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 18 and name HG11))
ASSI { 817}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 18 and name HG2%)
4.400 2.400 1.600 peak 817 spectrum 1 weight 0.10000E+01 volume 0.62210E-03 ppm1 8.694 ppm2 0.917 CV 1
OR { 817}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 26 and name HG2%)
OR { 817}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 38 and name HG2%)
ASSI { 821}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 18 and name HN ))
3.800 1.800 1.800 peak 821 spectrum 1 weight 0.10000E+01 volume 0.47282E-03 ppm1 8.688 ppm2 8.180 CV 1
OR { 821}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 14 and name HN ))
ASSI { 845}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 66 and name HD2%)
3.800 1.800 1.800 peak 845 spectrum 1 weight 0.10000E+01 volume 0.82963E-03 ppm1 8.208 ppm2 0.619 CV 1
OR { 845}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 40 and name H8% )
ASSI { 853}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 73 and name HA ))
3.400 1.500 1.500 peak 853 spectrum 1 weight 0.10000E+01 volume 0.85916E-03 ppm1 8.514 ppm2 3.670 CV 1
OR { 853}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 73 and name HA ))
ASSI { 854}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 76 and name HD1%)
3.700 1.700 1.700 peak 854 spectrum 1 weight 0.10000E+01 volume 0.20074E-02 ppm1 8.518 ppm2 0.601 CV 1
OR { 854}
(( segid " " and resid 77 and name HN ))
( segid " " and resid 76 and name HD1%)
ASSI { 855}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HG12))
3.600 1.600 1.600 peak 855 spectrum 1 weight 0.10000E+01 volume 0.22787E-02 ppm1 8.514 ppm2 0.921 CV 1
OR { 855}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HG12))
OR { 855}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 56 and name HG2%)
ASSI { 877}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 69 and name HG2%)
4.400 2.400 1.600 peak 877 spectrum 1 weight 0.10000E+01 volume 0.31359E-03 ppm1 6.358 ppm2 0.630 CV 1
OR { 877}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 36 and name HD1%)
ASSI { 888}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 46 and name HG1%)
4.400 2.400 1.600 peak 888 spectrum 1 weight 0.10000E+01 volume 0.28324E-03 ppm1 7.903 ppm2 0.666 CV 1
OR { 888}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 53 and name HG2 ))
ASSI { 901}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 33 and name HG2%)
4.200 2.200 1.800 peak 901 spectrum 1 weight 0.10000E+01 volume 0.41449E-03 ppm1 8.192 ppm2 1.258 CV 1
OR { 901}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 40 and name H3A ))
ASSI { 904}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 68 and name HB ))
4.700 2.800 1.300 peak 904 spectrum 1 weight 0.10000E+01 volume 0.47726E-03 ppm1 8.189 ppm2 4.358 CV 1
OR { 904}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 30 and name HA ))
OR { 904}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 36 and name HA ))
ASSI { 24}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 40 and name H5B ))
4.500 2.500 1.500 peak 24 spectrum 1 weight 0.10000E+01 volume 0.52049E-03 ppm1 2.191 ppm2 0.657 CV 1
OR { 24}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 40 and name H5A ))
OR { 24}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 40 and name H6A ))
OR { 24}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 40 and name H6B ))
OR { 24}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 40 and name H6A ))
OR { 24}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 40 and name H5B ))
OR { 24}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 40 and name H5A ))
ASSI { 27}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 40 and name H4A ))
4.000 2.000 2.000 peak 27 spectrum 1 weight 0.10000E+01 volume 0.57112E-03 ppm1 2.202 ppm2 0.743 CV 1
OR { 27}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 40 and name H4B ))
OR { 27}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 40 and name H4B ))
ASSI { 28}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 40 and name H3B ))
3.400 1.500 1.500 peak 28 spectrum 1 weight 0.10000E+01 volume 0.15067E-02 ppm1 0.901 ppm2 1.221 CV 1
OR { 28}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 40 and name H3A ))
OR { 28}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 40 and name H3B ))
OR { 28}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 40 and name H3B ))
OR { 28}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 40 and name H3A ))
ASSI { 122}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 40 and name H2B ))
3.800 1.800 1.800 peak 122 spectrum 1 weight 0.10000E+01 volume 0.49079E-03 ppm1 4.462 ppm2 2.465 CV 1
OR { 122}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 40 and name H2A ))
OR { 122}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 40 and name H2A ))
OR { 122}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 40 and name H2B ))
ASSI { 2}
( segid " " and resid 54 and name HD% )
(( segid " " and resid 50 and name HA ))
2.900 1.100 1.100 peak 2 spectrum 1 weight 0.10000E+01 volume 0.17909E-02 ppm1 7.457 ppm2 3.934 CV 1
OR { 2}
( segid " " and resid 54 and name HD% )
(( segid " " and resid 7 and name HA ))
ASSI { 3}
( segid " " and resid 54 and name HD% )
( segid " " and resid 50 and name HB% )
2.700 0.900 0.900 peak 3 spectrum 1 weight 0.10000E+01 volume 0.25616E-02 ppm1 7.455 ppm2 1.507 CV 1
OR { 3}
( segid " " and resid 54 and name HD% )
(( segid " " and resid 7 and name HG11))
ASSI { 5}
( segid " " and resid 54 and name HD% )
( segid " " and resid 7 and name HD1%)
2.600 0.900 0.900 peak 5 spectrum 1 weight 0.10000E+01 volume 0.23455E-02 ppm1 7.457 ppm2 0.541 CV 1
OR { 5}
( segid " " and resid 54 and name HD% )
( segid " " and resid 76 and name HG2%)
OR { 5}
( segid " " and resid 54 and name HD% )
( segid " " and resid 7 and name HG2%)
OR { 5}
( segid " " and resid 54 and name HD% )
( segid " " and resid 76 and name HD1%)
ASSI { 10}
( segid " " and resid 75 and name HD% )
(( segid " " and resid 76 and name HG12))
3.200 1.200 1.200 peak 10 spectrum 1 weight 0.10000E+01 volume 0.14392E-02 ppm1 6.821 ppm2 0.913 CV 1
OR { 10}
( segid " " and resid 75 and name HD% )
( segid " " and resid 56 and name HG2%)
OR { 10}
( segid " " and resid 75 and name HD% )
( segid " " and resid 56 and name HG1%)
ASSI { 11}
( segid " " and resid 75 and name HD% )
( segid " " and resid 58 and name HD1%)
2.800 1.000 1.000 peak 11 spectrum 1 weight 0.10000E+01 volume 0.34179E-02 ppm1 6.817 ppm2 0.606 CV 1
OR { 11}
( segid " " and resid 75 and name HD% )
( segid " " and resid 66 and name HD2%)
OR { 11}
( segid " " and resid 75 and name HD% )
( segid " " and resid 76 and name HD1%)
OR { 11}
( segid " " and resid 75 and name HD% )
( segid " " and resid 40 and name H8% )
ASSI { 20}
( segid " " and resid 75 and name HE% )
( segid " " and resid 58 and name HD1%)
2.400 2.400 3.600 peak 20 spectrum 1 weight 0.10000E+01 volume 0.23422E-02 ppm1 6.533 ppm2 0.600 CV 1
OR { 20}
( segid " " and resid 75 and name HE% )
( segid " " and resid 66 and name HD2%)
OR { 20}
( segid " " and resid 75 and name HE% )
( segid " " and resid 40 and name H8% )
ASSI { 23}
( segid " " and resid 75 and name HE% )
( segid " " and resid 56 and name HG2%)
2.300 2.300 3.700 peak 23 spectrum 1 weight 0.10000E+01 volume 0.27179E-02 ppm1 6.536 ppm2 0.928 CV 1
OR { 23}
( segid " " and resid 75 and name HE% )
( segid " " and resid 56 and name HG1%)
OR { 23}
( segid " " and resid 75 and name HE% )
(( segid " " and resid 76 and name HG12))
ASSI { 27}
( segid " " and resid 54 and name HE% )
(( segid " " and resid 7 and name HA ))
2.400 0.700 0.700 peak 27 spectrum 1 weight 0.10000E+01 volume 0.32005E-02 ppm1 7.122 ppm2 3.888 CV 1
OR { 27}
( segid " " and resid 54 and name HE% )
(( segid " " and resid 10 and name HA2 ))
ASSI { 28}
( segid " " and resid 54 and name HE% )
( segid " " and resid 50 and name HB% )
3.200 1.300 1.300 peak 28 spectrum 1 weight 0.10000E+01 volume 0.92391E-03 ppm1 7.124 ppm2 1.523 CV 1
OR { 28}
( segid " " and resid 54 and name HE% )
( segid " " and resid 2 and name HB% )
OR { 28}
( segid " " and resid 54 and name HE% )
(( segid " " and resid 7 and name HG11))
ASSI { 30}
( segid " " and resid 54 and name HE% )
( segid " " and resid 7 and name HG2%)
3.300 1.300 1.300 peak 30 spectrum 1 weight 0.10000E+01 volume 0.10872E-02 ppm1 7.127 ppm2 0.558 CV 1
OR { 30}
( segid " " and resid 54 and name HE% )
( segid " " and resid 7 and name HD1%)
OR { 30}
( segid " " and resid 54 and name HE% )
( segid " " and resid 76 and name HD1%)
OR { 30}
( segid " " and resid 54 and name HE% )
( segid " " and resid 76 and name HG2%)
ASSI { 31}
(( segid " " and resid 54 and name HZ ))
(( segid " " and resid 10 and name HA2 ))
3.500 1.500 1.500 peak 31 spectrum 1 weight 0.10000E+01 volume 0.19925E-02 ppm1 7.455 ppm2 3.883 CV 1
OR { 31}
(( segid " " and resid 54 and name HZ ))
(( segid " " and resid 7 and name HA ))
ASSI { 35}
( segid " " and resid 32 and name HD% )
( segid " " and resid 36 and name HD1%)
3.500 1.500 1.500 peak 35 spectrum 1 weight 0.10000E+01 volume 0.10129E-02 ppm1 7.183 ppm2 0.585 CV 1
OR { 35}
( segid " " and resid 32 and name HD% )
( segid " " and resid 40 and name H8% )
ASSI { 36}
( segid " " and resid 32 and name HD% )
( segid " " and resid 46 and name HG2%)
3.400 1.400 1.400 peak 36 spectrum 1 weight 0.10000E+01 volume 0.16441E-02 ppm1 7.187 ppm2 0.947 CV 1
OR { 36}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H7A ))
OR { 36}
( segid " " and resid 32 and name HD% )
( segid " " and resid 38 and name HG1%)
OR { 36}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 66 and name HB2 ))
OR { 36}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H7B ))
OR { 36}
( segid " " and resid 32 and name HD% )
( segid " " and resid 38 and name HG2%)
OR { 36}
( segid " " and resid 32 and name HD% )
( segid " " and resid 26 and name HG2%)
OR { 36}
( segid " " and resid 32 and name HD% )
( segid " " and resid 47 and name HG2%)
ASSI { 37}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 67 and name HA ))
3.700 1.700 1.700 peak 37 spectrum 1 weight 0.10000E+01 volume 0.68237E-03 ppm1 7.184 ppm2 4.463 CV 1
OR { 37}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 66 and name HA ))
ASSI { 41}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 69 and name HA ))
3.000 1.100 1.100 peak 41 spectrum 1 weight 0.10000E+01 volume 0.12566E-02 ppm1 6.981 ppm2 3.406 CV 1
OR { 41}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 8 and name HA ))
ASSI { 43}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H6B ))
3.200 1.200 1.200 peak 43 spectrum 1 weight 0.10000E+01 volume 0.15791E-02 ppm1 6.978 ppm2 0.666 CV 1
OR { 43}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H5A ))
OR { 43}
( segid " " and resid 32 and name HE% )
( segid " " and resid 46 and name HG1%)
OR { 43}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H5B ))
OR { 43}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H6A ))
OR { 43}
( segid " " and resid 32 and name HE% )
( segid " " and resid 69 and name HG2%)
ASSI { 44}
( segid " " and resid 32 and name HE% )
( segid " " and resid 15 and name HG2%)
3.100 1.200 1.200 peak 44 spectrum 1 weight 0.10000E+01 volume 0.11124E-02 ppm1 6.984 ppm2 1.177 CV 1
OR { 44}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H3A ))
OR { 44}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H3B ))
ASSI { 47}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 69 and name HA ))
3.800 1.800 1.800 peak 47 spectrum 1 weight 0.10000E+01 volume 0.86779E-03 ppm1 6.863 ppm2 3.413 CV 1
OR { 47}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 8 and name HA ))
ASSI { 48}
(( segid " " and resid 32 and name HZ ))
( segid " " and resid 11 and name HD1%)
3.100 1.200 1.200 peak 48 spectrum 1 weight 0.10000E+01 volume 0.93941E-03 ppm1 6.862 ppm2 0.885 CV 1
OR { 48}
(( segid " " and resid 32 and name HZ ))
( segid " " and resid 11 and name HD2%)
OR { 48}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 40 and name H7A ))
OR { 48}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 40 and name H7B ))
ASSI { 2}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 66 and name HD1%)
2.700 0.900 0.900 peak 2 spectrum 1 weight 0.10000E+01 volume 0.20784E-02 ppm1 4.095 ppm2 0.403 CV 1
ASSI { 4}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 72 and name HB% )
2.400 0.700 0.700 peak 4 spectrum 1 weight 0.10000E+01 volume 0.43425E-02 ppm1 4.100 ppm2 1.606 CV 1
ASSI { 6}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 73 and name HA ))
3.500 1.500 1.500 peak 6 spectrum 1 weight 0.10000E+01 volume 0.10401E-02 ppm1 1.600 ppm2 3.681 CV 1
ASSI { 7}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 69 and name HA ))
2.900 1.000 1.000 peak 7 spectrum 1 weight 0.10000E+01 volume 0.15561E-02 ppm1 1.598 ppm2 3.415 CV 1
ASSI { 8}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 40 and name H4B ))
3.100 1.200 1.200 peak 8 spectrum 1 weight 0.10000E+01 volume 0.14932E-02 ppm1 1.605 ppm2 0.747 CV 1
OR { 8}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 40 and name H4A ))
ASSI { 9}
( segid " " and resid 72 and name HB% )
( segid " " and resid 40 and name H8% )
2.600 0.800 0.800 peak 9 spectrum 1 weight 0.10000E+01 volume 0.39011E-02 ppm1 1.601 ppm2 0.622 CV 1
ASSI { 10}
( segid " " and resid 72 and name HB% )
( segid " " and resid 66 and name HD1%)
3.000 1.100 1.100 peak 10 spectrum 1 weight 0.10000E+01 volume 0.12726E-02 ppm1 1.602 ppm2 0.427 CV 1
ASSI { 12}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 73 and name HN ))
2.900 1.000 1.000 peak 12 spectrum 1 weight 0.10000E+01 volume 0.19023E-02 ppm1 1.601 ppm2 8.647 CV 1
ASSI { 15}
( segid " " and resid 72 and name HB% )
( segid " " and resid 32 and name HE% )
2.900 1.100 1.100 peak 15 spectrum 1 weight 0.10000E+01 volume 0.18164E-02 ppm1 1.605 ppm2 6.990 CV 1
ASSI { 18}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HA ))
3.200 1.300 1.300 peak 18 spectrum 1 weight 0.10000E+01 volume 0.25768E-02 ppm1 0.827 ppm2 4.331 CV 1
ASSI { 20}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HN ))
2.700 0.900 0.900 peak 20 spectrum 1 weight 0.10000E+01 volume 0.14888E-02 ppm1 4.307 ppm2 6.467 CV 1
ASSI { 23}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HD1 ))
2.000 0.500 0.500 peak 23 spectrum 1 weight 0.10000E+01 volume 0.61452E-02 ppm1 4.310 ppm2 4.036 CV 1
ASSI { 24}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HD2 ))
2.900 1.000 1.000 peak 24 spectrum 1 weight 0.10000E+01 volume 0.31943E-02 ppm1 4.311 ppm2 3.691 CV 1
ASSI { 25}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 15 and name HB ))
2.900 1.100 1.100 peak 25 spectrum 1 weight 0.10000E+01 volume 0.75805E-03 ppm1 0.822 ppm2 2.250 CV 1
ASSI { 28}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HB2 ))
3.000 1.100 1.100 peak 28 spectrum 1 weight 0.10000E+01 volume 0.23763E-02 ppm1 4.312 ppm2 2.484 CV 1
ASSI { 29}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HG12))
2.100 0.600 0.600 peak 29 spectrum 1 weight 0.10000E+01 volume 0.60312E-02 ppm1 0.829 ppm2 1.301 CV 1
OR { 29}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HG11))
ASSI { 30}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HN ))
2.800 1.000 1.000 peak 30 spectrum 1 weight 0.10000E+01 volume 0.22832E-02 ppm1 4.316 ppm2 8.668 CV 1
ASSI { 33}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 24 and name HN ))
4.200 2.200 1.800 peak 33 spectrum 1 weight 0.10000E+01 volume 0.40077E-03 ppm1 0.817 ppm2 9.241 CV 1
ASSI { 36}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 40 and name H7A ))
2.500 2.500 3.500 peak 36 spectrum 1 weight 0.10000E+01 volume 0.40651E-02 ppm1 1.601 ppm2 0.925 CV 1
OR { 36}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 40 and name H7B ))
ASSI { 37}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 12 and name HB% )
2.300 0.700 0.700 peak 37 spectrum 1 weight 0.10000E+01 volume 0.53326E-02 ppm1 4.043 ppm2 1.678 CV 1
ASSI { 41}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 14 and name HD1%)
3.300 3.300 2.700 peak 41 spectrum 1 weight 0.10000E+01 volume 0.34332E-02 ppm1 4.040 ppm2 0.728 CV 1
ASSI { 43}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 15 and name HB ))
2.400 0.700 0.700 peak 43 spectrum 1 weight 0.10000E+01 volume 0.22298E-02 ppm1 4.038 ppm2 2.243 CV 1
ASSI { 44}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HN ))
2.800 0.900 0.900 peak 44 spectrum 1 weight 0.10000E+01 volume 0.18984E-02 ppm1 4.044 ppm2 8.922 CV 1
ASSI { 45}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 15 and name HN ))
3.200 1.300 1.300 peak 45 spectrum 1 weight 0.10000E+01 volume 0.75910E-03 ppm1 4.048 ppm2 8.791 CV 1
ASSI { 47}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HN ))
3.300 1.400 1.400 peak 47 spectrum 1 weight 0.10000E+01 volume 0.77707E-03 ppm1 4.048 ppm2 7.937 CV 1
ASSI { 50}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 12 and name HN ))
2.400 0.700 0.700 peak 50 spectrum 1 weight 0.10000E+01 volume 0.51077E-02 ppm1 1.676 ppm2 8.924 CV 1
ASSI { 52}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 11 and name HA ))
3.500 1.500 1.500 peak 52 spectrum 1 weight 0.10000E+01 volume 0.26248E-02 ppm1 1.676 ppm2 4.214 CV 1
ASSI { 53}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 15 and name HA ))
3.900 1.900 1.900 peak 53 spectrum 1 weight 0.10000E+01 volume 0.22306E-02 ppm1 1.675 ppm2 3.607 CV 1
ASSI { 59}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 2 and name HN ))
2.700 0.900 0.900 peak 59 spectrum 1 weight 0.10000E+01 volume 0.24725E-02 ppm1 1.560 ppm2 8.842 CV 1
ASSI { 60}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 3 and name HN ))
2.700 0.900 0.900 peak 60 spectrum 1 weight 0.10000E+01 volume 0.26444E-02 ppm1 1.559 ppm2 8.556 CV 1
ASSI { 62}
(( segid " " and resid 2 and name HA ))
( segid " " and resid 2 and name HB% )
2.000 0.500 0.500 peak 62 spectrum 1 weight 0.10000E+01 volume 0.13952E-01 ppm1 4.821 ppm2 1.547 CV 1
ASSI { 64}
( segid " " and resid 2 and name HB% )
( segid " " and resid 54 and name HD% )
3.500 1.500 1.500 peak 64 spectrum 1 weight 0.10000E+01 volume 0.12692E-02 ppm1 1.558 ppm2 7.465 CV 1
ASSI { 65}
( segid " " and resid 2 and name HB% )
( segid " " and resid 54 and name HE% )
4.100 2.100 1.900 peak 65 spectrum 1 weight 0.10000E+01 volume 0.84718E-03 ppm1 1.564 ppm2 7.121 CV 1
ASSI { 66}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 6 and name HB1 ))
3.000 1.100 1.100 peak 66 spectrum 1 weight 0.10000E+01 volume 0.22423E-02 ppm1 1.562 ppm2 2.487 CV 1
ASSI { 67}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 6 and name HG2 ))
4.400 2.500 1.600 peak 67 spectrum 1 weight 0.10000E+01 volume 0.91545E-03 ppm1 1.564 ppm2 2.363 CV 1
ASSI { 69}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 7 and name HG12))
2.900 1.000 1.000 peak 69 spectrum 1 weight 0.10000E+01 volume 0.15316E-02 ppm1 1.566 ppm2 0.264 CV 1
ASSI { 70}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 7 and name HA ))
3.700 1.700 1.700 peak 70 spectrum 1 weight 0.10000E+01 volume 0.72283E-03 ppm1 1.561 ppm2 3.887 CV 1
ASSI { 71}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 6 and name HB2 ))
2.600 0.800 0.800 peak 71 spectrum 1 weight 0.10000E+01 volume 0.20693E-02 ppm1 1.560 ppm2 2.097 CV 1
ASSI { 72}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 7 and name HN ))
3.400 1.500 1.500 peak 72 spectrum 1 weight 0.10000E+01 volume 0.14634E-02 ppm1 1.559 ppm2 8.422 CV 1
ASSI { 73}
(( segid " " and resid 1 and name HA ))
(( segid " " and resid 2 and name HN ))
2.900 1.000 1.000 peak 73 spectrum 1 weight 0.10000E+01 volume 0.35577E-02 ppm1 4.019 ppm2 8.841 CV 1
ASSI { 75}
(( segid " " and resid 1 and name HA ))
( segid " " and resid 1 and name HB% )
2.600 0.800 0.800 peak 75 spectrum 1 weight 0.10000E+01 volume 0.39712E-02 ppm1 4.016 ppm2 1.509 CV 1
ASSI { 77}
( segid " " and resid 1 and name HB% )
(( segid " " and resid 80 and name HG1 ))
3.700 1.700 1.700 peak 77 spectrum 1 weight 0.10000E+01 volume 0.12835E-02 ppm1 1.506 ppm2 2.701 CV 1
ASSI { 79}
( segid " " and resid 49 and name HB% )
(( segid " " and resid 48 and name HN ))
3.300 1.400 1.400 peak 79 spectrum 1 weight 0.10000E+01 volume 0.39345E-02 ppm1 1.508 ppm2 7.778 CV 1
ASSI { 80}
( segid " " and resid 1 and name HB% )
(( segid " " and resid 80 and name HE21))
3.500 1.500 1.500 peak 80 spectrum 1 weight 0.10000E+01 volume 0.12180E-02 ppm1 1.503 ppm2 7.647 CV 1
ASSI { 81}
(( segid " " and resid 1 and name HA ))
(( segid " " and resid 2 and name HA ))
3.600 1.700 1.700 peak 81 spectrum 1 weight 0.10000E+01 volume 0.97639E-03 ppm1 4.015 ppm2 4.804 CV 1
ASSI { 83}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HB ))
2.600 0.900 0.900 peak 83 spectrum 1 weight 0.10000E+01 volume 0.45234E-02 ppm1 4.430 ppm2 4.716 CV 1
ASSI { 84}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HN ))
2.800 0.900 0.900 peak 84 spectrum 1 weight 0.10000E+01 volume 0.15276E-02 ppm1 4.430 ppm2 8.558 CV 1
ASSI { 85}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 5 and name HN ))
4.300 2.300 1.700 peak 85 spectrum 1 weight 0.10000E+01 volume 0.53330E-03 ppm1 4.433 ppm2 8.873 CV 1
ASSI { 86}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HN ))
2.300 0.700 0.700 peak 86 spectrum 1 weight 0.10000E+01 volume 0.48648E-02 ppm1 4.431 ppm2 9.242 CV 1
ASSI { 87}
(( segid " " and resid 3 and name HB ))
(( segid " " and resid 5 and name HN ))
2.900 1.000 1.000 peak 87 spectrum 1 weight 0.10000E+01 volume 0.16080E-02 ppm1 4.715 ppm2 8.856 CV 1
ASSI { 88}
(( segid " " and resid 3 and name HB ))
(( segid " " and resid 4 and name HN ))
3.000 1.100 1.100 peak 88 spectrum 1 weight 0.10000E+01 volume 0.29133E-02 ppm1 4.710 ppm2 9.243 CV 1
ASSI { 89}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 4 and name HN ))
2.700 0.900 0.900 peak 89 spectrum 1 weight 0.10000E+01 volume 0.13341E-02 ppm1 1.354 ppm2 9.240 CV 1
ASSI { 90}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 5 and name HN ))
3.500 1.500 1.500 peak 90 spectrum 1 weight 0.10000E+01 volume 0.96613E-03 ppm1 1.351 ppm2 8.880 CV 1
ASSI { 91}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 3 and name HN ))
3.100 1.200 1.200 peak 91 spectrum 1 weight 0.10000E+01 volume 0.43404E-02 ppm1 1.353 ppm2 8.554 CV 1
ASSI { 92}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 2 and name HA ))
3.900 1.900 1.900 peak 92 spectrum 1 weight 0.10000E+01 volume 0.16706E-02 ppm1 1.352 ppm2 4.836 CV 1
ASSI { 93}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 3 and name HB ))
2.300 0.700 0.700 peak 93 spectrum 1 weight 0.10000E+01 volume 0.55211E-02 ppm1 1.353 ppm2 4.712 CV 1
ASSI { 94}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 3 and name HA ))
2.500 0.800 0.800 peak 94 spectrum 1 weight 0.10000E+01 volume 0.47697E-02 ppm1 1.354 ppm2 4.436 CV 1
ASSI { 96}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 3 and name HG1 ))
3.600 1.700 1.700 peak 96 spectrum 1 weight 0.10000E+01 volume 0.55320E-03 ppm1 1.352 ppm2 4.953 CV 1
ASSI { 97}
(( segid " " and resid 3 and name HB ))
(( segid " " and resid 3 and name HG1 ))
3.000 1.200 1.200 peak 97 spectrum 1 weight 0.10000E+01 volume 0.14351E-02 ppm1 4.717 ppm2 4.928 CV 1
ASSI { 98}
(( segid " " and resid 3 and name HB ))
(( segid " " and resid 2 and name HA ))
3.600 1.600 1.600 peak 98 spectrum 1 weight 0.10000E+01 volume 0.19180E-02 ppm1 4.716 ppm2 4.836 CV 1
ASSI { 101}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 77 and name HD2%)
3.300 1.300 1.300 peak 101 spectrum 1 weight 0.10000E+01 volume 0.13364E-02 ppm1 4.432 ppm2 0.816 CV 1
OR { 101}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 77 and name HD1%)
ASSI { 102}
( segid " " and resid 3 and name HG2%)
( segid " " and resid 73 and name HG2%)
2.900 2.900 3.100 peak 102 spectrum 1 weight 0.10000E+01 volume 0.14041E-01 ppm1 1.345 ppm2 1.113 CV 1
ASSI { 103}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 6 and name HN ))
4.500 2.500 1.500 peak 103 spectrum 1 weight 0.10000E+01 volume 0.63072E-03 ppm1 1.353 ppm2 7.679 CV 1
ASSI { 104}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HN ))
2.700 0.900 0.900 peak 104 spectrum 1 weight 0.10000E+01 volume 0.16776E-02 ppm1 3.697 ppm2 9.245 CV 1
ASSI { 109}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 73 and name HG2%)
3.000 1.100 1.100 peak 109 spectrum 1 weight 0.10000E+01 volume 0.16763E-02 ppm1 3.701 ppm2 1.101 CV 1
ASSI { 111}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 7 and name HG2%)
3.400 1.400 1.400 peak 111 spectrum 1 weight 0.10000E+01 volume 0.24483E-02 ppm1 3.698 ppm2 0.531 CV 1
OR { 111}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 7 and name HD1%)
ASSI { 112}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB2 ))
2.700 0.900 0.900 peak 112 spectrum 1 weight 0.10000E+01 volume 0.17159E-02 ppm1 3.697 ppm2 2.032 CV 1
ASSI { 113}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 7 and name HB ))
2.600 0.800 0.800 peak 113 spectrum 1 weight 0.10000E+01 volume 0.16487E-02 ppm1 3.701 ppm2 1.791 CV 1
ASSI { 114}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB1 ))
2.600 0.800 0.800 peak 114 spectrum 1 weight 0.10000E+01 volume 0.47643E-02 ppm1 3.697 ppm2 2.174 CV 1
OR { 114}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HG2 ))
ASSI { 120}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HA ))
3.500 1.500 1.500 peak 120 spectrum 1 weight 0.10000E+01 volume 0.10121E-02 ppm1 2.167 ppm2 3.696 CV 1
ASSI { 121}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
2.800 1.000 1.000 peak 121 spectrum 1 weight 0.10000E+01 volume 0.26893E-02 ppm1 3.925 ppm2 8.866 CV 1
ASSI { 123}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HG1 ))
3.100 1.200 1.200 peak 123 spectrum 1 weight 0.10000E+01 volume 0.16498E-02 ppm1 3.916 ppm2 2.460 CV 1
ASSI { 125}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB1 ))
2.800 1.000 1.000 peak 125 spectrum 1 weight 0.10000E+01 volume 0.32668E-02 ppm1 3.924 ppm2 2.069 CV 1
ASSI { 127}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 8 and name HG2%)
3.100 1.200 1.200 peak 127 spectrum 1 weight 0.10000E+01 volume 0.18908E-02 ppm1 3.922 ppm2 1.017 CV 1
ASSI { 130}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HN ))
3.300 1.400 1.400 peak 130 spectrum 1 weight 0.10000E+01 volume 0.12047E-02 ppm1 3.928 ppm2 7.705 CV 1
ASSI { 134}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HN ))
3.700 1.700 1.700 peak 134 spectrum 1 weight 0.10000E+01 volume 0.14317E-02 ppm1 2.293 ppm2 8.863 CV 1
ASSI { 137}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HA ))
3.100 1.200 1.200 peak 137 spectrum 1 weight 0.10000E+01 volume 0.28775E-02 ppm1 2.290 ppm2 3.936 CV 1
ASSI { 138}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 9 and name HB% )
2.700 0.900 0.900 peak 138 spectrum 1 weight 0.10000E+01 volume 0.33566E-02 ppm1 4.131 ppm2 1.512 CV 1
ASSI { 139}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HN ))
3.100 1.200 1.200 peak 139 spectrum 1 weight 0.10000E+01 volume 0.14152E-02 ppm1 4.118 ppm2 8.395 CV 1
ASSI { 148}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 7 and name HN ))
3.800 1.800 1.800 peak 148 spectrum 1 weight 0.10000E+01 volume 0.14855E-02 ppm1 0.554 ppm2 8.400 CV 1
ASSI { 150}
( segid " " and resid 7 and name HG2%)
( segid " " and resid 54 and name HD% )
3.900 1.900 1.900 peak 150 spectrum 1 weight 0.10000E+01 volume 0.51810E-03 ppm1 0.553 ppm2 7.462 CV 1
OR { 150}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 54 and name HZ ))
ASSI { 151}
( segid " " and resid 7 and name HG2%)
( segid " " and resid 54 and name HE% )
3.300 1.300 1.300 peak 151 spectrum 1 weight 0.10000E+01 volume 0.74038E-03 ppm1 0.552 ppm2 7.126 CV 1
ASSI { 155}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 8 and name HA ))
3.300 1.400 1.400 peak 155 spectrum 1 weight 0.10000E+01 volume 0.60836E-03 ppm1 0.551 ppm2 3.372 CV 1
ASSI { 159}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 7 and name HG11))
2.600 0.900 0.900 peak 159 spectrum 1 weight 0.10000E+01 volume 0.19687E-02 ppm1 0.551 ppm2 1.543 CV 1
ASSI { 160}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 7 and name HG12))
3.500 1.600 1.600 peak 160 spectrum 1 weight 0.10000E+01 volume 0.18275E-02 ppm1 0.553 ppm2 0.246 CV 1
ASSI { 161}
( segid " " and resid 7 and name HG2%)
( segid " " and resid 73 and name HG2%)
2.700 0.900 0.900 peak 161 spectrum 1 weight 0.10000E+01 volume 0.23343E-02 ppm1 0.551 ppm2 1.096 CV 1
ASSI { 164}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HN ))
2.500 0.800 0.800 peak 164 spectrum 1 weight 0.10000E+01 volume 0.24583E-02 ppm1 3.883 ppm2 8.400 CV 1
ASSI { 165}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 54 and name HD% )
3.400 1.500 1.500 peak 165 spectrum 1 weight 0.10000E+01 volume 0.14643E-02 ppm1 3.889 ppm2 7.464 CV 1
OR { 165}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 54 and name HZ ))
ASSI { 166}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 54 and name HE% )
2.600 0.800 0.800 peak 166 spectrum 1 weight 0.10000E+01 volume 0.15104E-02 ppm1 3.881 ppm2 7.126 CV 1
ASSI { 168}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG11))
3.500 1.500 1.500 peak 168 spectrum 1 weight 0.10000E+01 volume 0.17741E-02 ppm1 3.876 ppm2 1.548 CV 1
ASSI { 170}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 7 and name HG2%)
2.600 0.800 0.800 peak 170 spectrum 1 weight 0.10000E+01 volume 0.30741E-02 ppm1 3.880 ppm2 0.547 CV 1
ASSI { 171}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG12))
2.800 1.000 1.000 peak 171 spectrum 1 weight 0.10000E+01 volume 0.15829E-02 ppm1 3.888 ppm2 0.256 CV 1
ASSI { 172}
(( segid " " and resid 7 and name HB ))
(( segid " " and resid 7 and name HN ))
2.400 0.700 0.700 peak 172 spectrum 1 weight 0.10000E+01 volume 0.27035E-02 ppm1 1.783 ppm2 8.401 CV 1
ASSI { 174}
(( segid " " and resid 7 and name HB ))
(( segid " " and resid 7 and name HA ))
3.000 1.100 1.100 peak 174 spectrum 1 weight 0.10000E+01 volume 0.10764E-02 ppm1 1.789 ppm2 3.904 CV 1
ASSI { 175}
(( segid " " and resid 7 and name HB ))
( segid " " and resid 7 and name HG2%)
2.000 0.500 0.500 peak 175 spectrum 1 weight 0.10000E+01 volume 0.67805E-02 ppm1 1.782 ppm2 0.538 CV 1
ASSI { 178}
(( segid " " and resid 76 and name HB ))
(( segid " " and resid 76 and name HG11))
2.700 0.900 0.900 peak 178 spectrum 1 weight 0.10000E+01 volume 0.11980E-02 ppm1 1.792 ppm2 1.966 CV 1
ASSI { 179}
(( segid " " and resid 7 and name HB ))
(( segid " " and resid 7 and name HG11))
2.700 0.900 0.900 peak 179 spectrum 1 weight 0.10000E+01 volume 0.13317E-02 ppm1 1.798 ppm2 1.548 CV 1
ASSI { 184}
( segid " " and resid 7 and name HD1%)
( segid " " and resid 73 and name HG2%)
4.400 2.400 1.600 peak 184 spectrum 1 weight 0.10000E+01 volume 0.11137E-02 ppm1 0.526 ppm2 1.099 CV 1
ASSI { 188}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 6 and name HN ))
2.700 2.700 3.300 peak 188 spectrum 1 weight 0.10000E+01 volume 0.10140E-02 ppm1 0.528 ppm2 7.670 CV 1
ASSI { 189}
( segid " " and resid 7 and name HD1%)
( segid " " and resid 54 and name HD% )
3.100 1.200 1.200 peak 189 spectrum 1 weight 0.10000E+01 volume 0.66771E-03 ppm1 0.524 ppm2 7.454 CV 1
OR { 189}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 54 and name HZ ))
ASSI { 200}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HN ))
2.200 0.600 0.600 peak 200 spectrum 1 weight 0.10000E+01 volume 0.54189E-02 ppm1 1.034 ppm2 8.387 CV 1
ASSI { 201}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 9 and name HN ))
4.500 2.500 1.500 peak 201 spectrum 1 weight 0.10000E+01 volume 0.70616E-03 ppm1 1.037 ppm2 7.742 CV 1
ASSI { 202}
( segid " " and resid 8 and name HG1%)
(( segid " " and resid 8 and name HN ))
3.800 1.900 1.900 peak 202 spectrum 1 weight 0.10000E+01 volume 0.18498E-02 ppm1 0.889 ppm2 8.387 CV 1
ASSI { 205}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HN ))
3.200 1.300 1.300 peak 205 spectrum 1 weight 0.10000E+01 volume 0.87901E-03 ppm1 3.367 ppm2 7.730 CV 1
ASSI { 206}
( segid " " and resid 8 and name HG1%)
(( segid " " and resid 8 and name HA ))
2.400 0.700 0.700 peak 206 spectrum 1 weight 0.10000E+01 volume 0.39322E-02 ppm1 0.889 ppm2 3.375 CV 1
ASSI { 208}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HA ))
2.400 0.700 0.700 peak 208 spectrum 1 weight 0.10000E+01 volume 0.40096E-02 ppm1 1.033 ppm2 3.374 CV 1
ASSI { 212}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HB ))
2.900 1.000 1.000 peak 212 spectrum 1 weight 0.10000E+01 volume 0.16697E-02 ppm1 3.371 ppm2 2.008 CV 1
ASSI { 220}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 7 and name HB ))
3.200 1.300 1.300 peak 220 spectrum 1 weight 0.10000E+01 volume 0.20082E-02 ppm1 1.033 ppm2 1.772 CV 1
ASSI { 221}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 4 and name HG2 ))
3.100 1.200 1.200 peak 221 spectrum 1 weight 0.10000E+01 volume 0.20768E-02 ppm1 1.033 ppm2 2.158 CV 1
OR { 221}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 4 and name HB1 ))
ASSI { 222}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HB ))
2.300 0.600 0.600 peak 222 spectrum 1 weight 0.10000E+01 volume 0.55203E-02 ppm1 1.036 ppm2 2.013 CV 1
ASSI { 224}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 69 and name HG2%)
2.900 1.000 1.000 peak 224 spectrum 1 weight 0.10000E+01 volume 0.22329E-02 ppm1 1.037 ppm2 0.647 CV 1
ASSI { 226}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 7 and name HG2%)
3.500 1.500 1.500 peak 226 spectrum 1 weight 0.10000E+01 volume 0.11521E-02 ppm1 1.030 ppm2 0.543 CV 1
OR { 226}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 7 and name HD1%)
ASSI { 231}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 9 and name HA ))
2.100 0.500 0.500 peak 231 spectrum 1 weight 0.10000E+01 volume 0.14783E-01 ppm1 1.512 ppm2 4.225 CV 1
ASSI { 235}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 10 and name HN ))
2.600 0.900 0.900 peak 235 spectrum 1 weight 0.10000E+01 volume 0.38937E-02 ppm1 1.509 ppm2 8.395 CV 1
ASSI { 237}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name HN ))
3.200 1.300 1.300 peak 237 spectrum 1 weight 0.10000E+01 volume 0.12151E-02 ppm1 4.223 ppm2 8.789 CV 1
ASSI { 240}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 10 and name HN ))
2.500 0.800 0.800 peak 240 spectrum 1 weight 0.10000E+01 volume 0.25630E-02 ppm1 4.042 ppm2 8.392 CV 1
ASSI { 241}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 11 and name HN ))
3.100 1.200 1.200 peak 241 spectrum 1 weight 0.10000E+01 volume 0.10414E-02 ppm1 4.050 ppm2 9.236 CV 1
ASSI { 245}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 54 and name HZ ))
3.100 1.200 1.200 peak 245 spectrum 1 weight 0.10000E+01 volume 0.81665E-03 ppm1 4.054 ppm2 7.473 CV 1
OR { 245}
(( segid " " and resid 10 and name HA1 ))
( segid " " and resid 54 and name HD% )
ASSI { 246}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 54 and name HZ ))
4.200 2.200 1.800 peak 246 spectrum 1 weight 0.10000E+01 volume 0.89199E-03 ppm1 3.855 ppm2 7.466 CV 1
OR { 246}
(( segid " " and resid 10 and name HA2 ))
( segid " " and resid 54 and name HD% )
ASSI { 248}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 13 and name HG2 ))
4.400 2.400 1.600 peak 248 spectrum 1 weight 0.10000E+01 volume 0.12229E-02 ppm1 4.049 ppm2 2.274 CV 1
OR { 248}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 13 and name HB1 ))
ASSI { 249}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HN ))
2.900 1.000 1.000 peak 249 spectrum 1 weight 0.10000E+01 volume 0.14343E-02 ppm1 4.244 ppm2 9.232 CV 1
ASSI { 250}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 15 and name HN ))
3.800 1.800 1.800 peak 250 spectrum 1 weight 0.10000E+01 volume 0.44438E-03 ppm1 4.240 ppm2 8.794 CV 1
ASSI { 251}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 14 and name HN ))
3.200 1.300 1.300 peak 251 spectrum 1 weight 0.10000E+01 volume 0.93195E-03 ppm1 4.239 ppm2 8.162 CV 1
ASSI { 254}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 11 and name HN ))
3.700 1.700 1.700 peak 254 spectrum 1 weight 0.10000E+01 volume 0.17847E-02 ppm1 0.845 ppm2 9.235 CV 1
ASSI { 256}
(( segid " " and resid 53 and name HG1 ))
(( segid " " and resid 53 and name HN ))
3.900 1.900 1.900 peak 256 spectrum 1 weight 0.10000E+01 volume 0.79382E-03 ppm1 0.850 ppm2 8.172 CV 1
ASSI { 257}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 11 and name HA ))
4.500 2.500 1.500 peak 257 spectrum 1 weight 0.10000E+01 volume 0.78544E-03 ppm1 0.844 ppm2 4.254 CV 1
ASSI { 259}
(( segid " " and resid 53 and name HG1 ))
(( segid " " and resid 53 and name HA ))
3.600 1.600 1.600 peak 259 spectrum 1 weight 0.10000E+01 volume 0.99930E-03 ppm1 0.843 ppm2 3.901 CV 1
ASSI { 261}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 8 and name HA ))
2.700 0.900 0.900 peak 261 spectrum 1 weight 0.10000E+01 volume 0.12459E-02 ppm1 0.840 ppm2 3.380 CV 1
ASSI { 262}
(( segid " " and resid 53 and name HG1 ))
(( segid " " and resid 53 and name HD1 ))
3.500 1.500 1.500 peak 262 spectrum 1 weight 0.10000E+01 volume 0.55776E-03 ppm1 0.836 ppm2 2.879 CV 1
ASSI { 263}
(( segid " " and resid 53 and name HG1 ))
(( segid " " and resid 53 and name HD2 ))
3.000 1.100 1.100 peak 263 spectrum 1 weight 0.10000E+01 volume 0.99750E-03 ppm1 0.840 ppm2 2.691 CV 1
ASSI { 264}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 11 and name HB1 ))
2.700 0.900 0.900 peak 264 spectrum 1 weight 0.10000E+01 volume 0.27808E-02 ppm1 0.845 ppm2 2.111 CV 1
ASSI { 265}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 11 and name HG ))
2.000 0.500 0.500 peak 265 spectrum 1 weight 0.10000E+01 volume 0.10285E-01 ppm1 0.844 ppm2 1.986 CV 1
ASSI { 266}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB2 ))
3.000 1.100 1.100 peak 266 spectrum 1 weight 0.10000E+01 volume 0.21001E-02 ppm1 4.239 ppm2 1.276 CV 1
ASSI { 268}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 8 and name HA ))
4.500 2.500 1.500 peak 268 spectrum 1 weight 0.10000E+01 volume 0.79880E-03 ppm1 2.112 ppm2 3.372 CV 1
ASSI { 271}
( segid " " and resid 11 and name HD2%)
(( segid " " and resid 11 and name HA ))
2.200 0.600 0.600 peak 271 spectrum 1 weight 0.10000E+01 volume 0.61628E-02 ppm1 0.880 ppm2 4.244 CV 1
ASSI { 272}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 63 and name HA ))
2.600 0.800 0.800 peak 272 spectrum 1 weight 0.10000E+01 volume 0.36487E-02 ppm1 0.884 ppm2 3.230 CV 1
ASSI { 273}
( segid " " and resid 11 and name HD2%)
( segid " " and resid 54 and name HE% )
2.600 0.800 0.800 peak 273 spectrum 1 weight 0.10000E+01 volume 0.23180E-02 ppm1 0.880 ppm2 7.126 CV 1
ASSI { 274}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 64 and name HN ))
3.600 1.600 1.600 peak 274 spectrum 1 weight 0.10000E+01 volume 0.18429E-02 ppm1 0.882 ppm2 7.005 CV 1
ASSI { 275}
( segid " " and resid 11 and name HD2%)
(( segid " " and resid 32 and name HZ ))
2.900 1.100 1.100 peak 275 spectrum 1 weight 0.10000E+01 volume 0.15370E-02 ppm1 0.882 ppm2 6.869 CV 1
ASSI { 276}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 63 and name HN ))
2.500 0.800 0.800 peak 276 spectrum 1 weight 0.10000E+01 volume 0.36302E-02 ppm1 0.884 ppm2 7.617 CV 1
ASSI { 277}
( segid " " and resid 63 and name HG2%)
(( segid " " and resid 62 and name HN ))
3.500 1.500 1.500 peak 277 spectrum 1 weight 0.10000E+01 volume 0.18962E-02 ppm1 0.882 ppm2 7.473 CV 1
ASSI { 278}
( segid " " and resid 11 and name HD2%)
(( segid " " and resid 11 and name HN ))
3.500 1.600 1.600 peak 278 spectrum 1 weight 0.10000E+01 volume 0.22358E-02 ppm1 0.884 ppm2 9.228 CV 1
ASSI { 279}
( segid " " and resid 11 and name HD2%)
(( segid " " and resid 11 and name HB1 ))
2.500 0.800 0.800 peak 279 spectrum 1 weight 0.10000E+01 volume 0.31890E-02 ppm1 0.879 ppm2 2.108 CV 1
ASSI { 280}
( segid " " and resid 11 and name HD2%)
(( segid " " and resid 11 and name HG ))
2.000 0.500 0.500 peak 280 spectrum 1 weight 0.10000E+01 volume 0.87855E-02 ppm1 0.881 ppm2 1.980 CV 1
ASSI { 281}
( segid " " and resid 63 and name HG2%)
( segid " " and resid 58 and name HG2%)
2.500 0.800 0.800 peak 281 spectrum 1 weight 0.10000E+01 volume 0.42725E-02 ppm1 0.884 ppm2 0.343 CV 1
ASSI { 283}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HN ))
2.600 0.900 0.900 peak 283 spectrum 1 weight 0.10000E+01 volume 0.35010E-02 ppm1 3.936 ppm2 7.945 CV 1
ASSI { 288}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HG1 ))
3.800 1.800 1.800 peak 288 spectrum 1 weight 0.10000E+01 volume 0.11736E-02 ppm1 3.932 ppm2 2.600 CV 1
ASSI { 292}
(( segid " " and resid 74 and name HA ))
( segid " " and resid 77 and name HD2%)
2.700 0.900 0.900 peak 292 spectrum 1 weight 0.10000E+01 volume 0.34512E-02 ppm1 3.929 ppm2 0.817 CV 1
OR { 292}
(( segid " " and resid 74 and name HA ))
( segid " " and resid 77 and name HD1%)
ASSI { 294}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HN ))
2.800 1.000 1.000 peak 294 spectrum 1 weight 0.10000E+01 volume 0.14959E-02 ppm1 2.292 ppm2 7.937 CV 1
ASSI { 296}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HN ))
2.800 1.000 1.000 peak 296 spectrum 1 weight 0.10000E+01 volume 0.18328E-02 ppm1 3.809 ppm2 8.169 CV 1
ASSI { 304}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 15 and name HB ))
3.800 3.800 2.200 peak 304 spectrum 1 weight 0.10000E+01 volume 0.13221E-02 ppm1 3.815 ppm2 2.253 CV 1
ASSI { 305}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB ))
2.900 1.000 1.000 peak 305 spectrum 1 weight 0.10000E+01 volume 0.19715E-02 ppm1 3.810 ppm2 2.102 CV 1
ASSI { 306}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 14 and name HG2%)
2.500 0.800 0.800 peak 306 spectrum 1 weight 0.10000E+01 volume 0.53230E-02 ppm1 3.812 ppm2 1.051 CV 1
OR { 306}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HG12))
ASSI { 307}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 14 and name HD1%)
3.900 1.900 1.900 peak 307 spectrum 1 weight 0.10000E+01 volume 0.11965E-02 ppm1 3.807 ppm2 0.735 CV 1
ASSI { 309}
(( segid " " and resid 14 and name HG12))
(( segid " " and resid 14 and name HA ))
4.000 2.000 2.000 peak 309 spectrum 1 weight 0.10000E+01 volume 0.10030E-02 ppm1 1.049 ppm2 3.812 CV 1
ASSI { 312}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 14 and name HN ))
2.600 0.900 0.900 peak 312 spectrum 1 weight 0.10000E+01 volume 0.16972E-02 ppm1 0.729 ppm2 8.174 CV 1
ASSI { 313}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 12 and name HN ))
4.400 2.400 1.600 peak 313 spectrum 1 weight 0.10000E+01 volume 0.45641E-03 ppm1 0.724 ppm2 8.913 CV 1
ASSI { 314}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 15 and name HN ))
4.000 2.000 2.000 peak 314 spectrum 1 weight 0.10000E+01 volume 0.12711E-02 ppm1 0.729 ppm2 8.786 CV 1
ASSI { 315}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 15 and name HN ))
3.200 1.300 1.300 peak 315 spectrum 1 weight 0.10000E+01 volume 0.18423E-02 ppm1 1.052 ppm2 8.792 CV 1
ASSI { 316}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 13 and name HN ))
4.400 2.500 1.600 peak 316 spectrum 1 weight 0.10000E+01 volume 0.10177E-02 ppm1 1.051 ppm2 7.925 CV 1
ASSI { 317}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 14 and name HA ))
2.600 0.800 0.800 peak 317 spectrum 1 weight 0.10000E+01 volume 0.31455E-02 ppm1 1.049 ppm2 3.815 CV 1
ASSI { 318}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 15 and name HA ))
3.400 1.500 1.500 peak 318 spectrum 1 weight 0.10000E+01 volume 0.80722E-03 ppm1 1.051 ppm2 3.577 CV 1
ASSI { 319}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 46 and name HA ))
2.400 0.700 0.700 peak 319 spectrum 1 weight 0.10000E+01 volume 0.32164E-02 ppm1 1.050 ppm2 3.422 CV 1
ASSI { 320}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 13 and name HA ))
4.200 2.200 1.800 peak 320 spectrum 1 weight 0.10000E+01 volume 0.99578E-03 ppm1 1.049 ppm2 3.943 CV 1
ASSI { 323}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 13 and name HA ))
3.400 1.500 1.500 peak 323 spectrum 1 weight 0.10000E+01 volume 0.33243E-02 ppm1 0.729 ppm2 3.944 CV 1
ASSI { 324}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 14 and name HN ))
3.600 1.600 1.600 peak 324 spectrum 1 weight 0.10000E+01 volume 0.21526E-02 ppm1 1.051 ppm2 8.172 CV 1
ASSI { 325}
( segid " " and resid 14 and name HD1%)
( segid " " and resid 54 and name HE% )
3.200 1.200 1.200 peak 325 spectrum 1 weight 0.10000E+01 volume 0.84387E-03 ppm1 0.729 ppm2 7.130 CV 1
ASSI { 326}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 53 and name HD1 ))
3.700 1.700 1.700 peak 326 spectrum 1 weight 0.10000E+01 volume 0.88835E-03 ppm1 0.729 ppm2 2.870 CV 1
ASSI { 328}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 15 and name HB ))
3.800 1.800 1.800 peak 328 spectrum 1 weight 0.10000E+01 volume 0.14944E-02 ppm1 1.048 ppm2 2.245 CV 1
ASSI { 329}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 14 and name HB ))
2.200 0.600 0.600 peak 329 spectrum 1 weight 0.10000E+01 volume 0.49356E-02 ppm1 1.049 ppm2 2.091 CV 1
ASSI { 332}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 14 and name HB ))
2.500 0.800 0.800 peak 332 spectrum 1 weight 0.10000E+01 volume 0.28748E-02 ppm1 0.728 ppm2 2.091 CV 1
ASSI { 333}
( segid " " and resid 14 and name HD1%)
( segid " " and resid 14 and name HG2%)
2.800 1.000 1.000 peak 333 spectrum 1 weight 0.10000E+01 volume 0.93241E-02 ppm1 0.727 ppm2 1.052 CV 1
ASSI { 334}
( segid " " and resid 14 and name HG2%)
( segid " " and resid 49 and name HB% )
2.200 0.600 0.600 peak 334 spectrum 1 weight 0.10000E+01 volume 0.78314E-02 ppm1 1.045 ppm2 1.513 CV 1
ASSI { 335}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HN ))
2.200 0.600 0.600 peak 335 spectrum 1 weight 0.10000E+01 volume 0.47894E-02 ppm1 1.166 ppm2 8.798 CV 1
ASSI { 336}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HN ))
2.600 0.800 0.800 peak 336 spectrum 1 weight 0.10000E+01 volume 0.22079E-02 ppm1 3.591 ppm2 8.799 CV 1
ASSI { 339}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 32 and name HE% )
2.700 0.900 0.900 peak 339 spectrum 1 weight 0.10000E+01 volume 0.20101E-02 ppm1 1.168 ppm2 6.987 CV 1
ASSI { 340}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 32 and name HD% )
3.100 1.200 1.200 peak 340 spectrum 1 weight 0.10000E+01 volume 0.89216E-03 ppm1 1.163 ppm2 7.182 CV 1
ASSI { 342}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 12 and name HA ))
3.000 1.100 1.100 peak 342 spectrum 1 weight 0.10000E+01 volume 0.20910E-02 ppm1 1.166 ppm2 4.047 CV 1
ASSI { 344}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HA ))
2.400 0.700 0.700 peak 344 spectrum 1 weight 0.10000E+01 volume 0.42039E-02 ppm1 1.165 ppm2 3.598 CV 1
ASSI { 346}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 14 and name HN ))
4.200 2.200 1.800 peak 346 spectrum 1 weight 0.10000E+01 volume 0.70130E-03 ppm1 1.166 ppm2 8.178 CV 1
ASSI { 347}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 14 and name HN ))
4.000 2.000 2.000 peak 347 spectrum 1 weight 0.10000E+01 volume 0.10711E-02 ppm1 3.595 ppm2 8.206 CV 1
ASSI { 348}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 15 and name HA ))
2.400 0.700 0.700 peak 348 spectrum 1 weight 0.10000E+01 volume 0.36612E-02 ppm1 0.998 ppm2 3.601 CV 1
ASSI { 354}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 36 and name HD1%)
3.000 1.100 1.100 peak 354 spectrum 1 weight 0.10000E+01 volume 0.17313E-02 ppm1 1.166 ppm2 0.597 CV 1
ASSI { 355}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 69 and name HG1%)
3.700 1.700 1.700 peak 355 spectrum 1 weight 0.10000E+01 volume 0.91172E-03 ppm1 1.161 ppm2 0.438 CV 1
ASSI { 357}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 12 and name HA ))
3.900 1.900 1.900 peak 357 spectrum 1 weight 0.10000E+01 volume 0.14845E-02 ppm1 3.598 ppm2 4.043 CV 1
ASSI { 361}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HN ))
2.900 1.000 1.000 peak 361 spectrum 1 weight 0.10000E+01 volume 0.17837E-02 ppm1 4.671 ppm2 8.697 CV 1
ASSI { 362}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 21 and name HN ))
2.400 0.700 0.700 peak 362 spectrum 1 weight 0.10000E+01 volume 0.29736E-02 ppm1 4.665 ppm2 6.469 CV 1
ASSI { 363}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB1 ))
2.900 1.000 1.000 peak 363 spectrum 1 weight 0.10000E+01 volume 0.25767E-02 ppm1 4.670 ppm2 3.102 CV 1
ASSI { 365}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB2 ))
2.800 1.000 1.000 peak 365 spectrum 1 weight 0.10000E+01 volume 0.14747E-02 ppm1 4.673 ppm2 2.742 CV 1
ASSI { 366}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HD22))
3.600 1.600 1.600 peak 366 spectrum 1 weight 0.10000E+01 volume 0.17926E-02 ppm1 4.667 ppm2 8.066 CV 1
ASSI { 367}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HN ))
2.800 1.000 1.000 peak 367 spectrum 1 weight 0.10000E+01 volume 0.24367E-02 ppm1 4.667 ppm2 7.836 CV 1
ASSI { 369}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 56 and name HG2%)
2.700 0.900 0.900 peak 369 spectrum 1 weight 0.10000E+01 volume 0.40720E-02 ppm1 4.665 ppm2 0.946 CV 1
OR { 369}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 56 and name HG1%)
ASSI { 370}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB ))
2.500 0.800 0.800 peak 370 spectrum 1 weight 0.10000E+01 volume 0.33932E-02 ppm1 4.665 ppm2 2.001 CV 1
ASSI { 373}
(( segid " " and resid 45 and name HB1 ))
(( segid " " and resid 45 and name HN ))
3.700 1.700 1.700 peak 373 spectrum 1 weight 0.10000E+01 volume 0.16689E-02 ppm1 2.283 ppm2 6.997 CV 1
ASSI { 374}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HN ))
2.700 0.900 0.900 peak 374 spectrum 1 weight 0.10000E+01 volume 0.13023E-02 ppm1 2.151 ppm2 6.997 CV 1
ASSI { 378}
(( segid " " and resid 45 and name HG2 ))
(( segid " " and resid 45 and name HN ))
3.200 1.300 1.300 peak 378 spectrum 1 weight 0.10000E+01 volume 0.19755E-02 ppm1 2.277 ppm2 6.998 CV 1
ASSI { 379}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HB2 ))
2.900 1.000 1.000 peak 379 spectrum 1 weight 0.10000E+01 volume 0.34923E-02 ppm1 4.057 ppm2 2.151 CV 1
ASSI { 380}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 44 and name HG2%)
2.400 2.400 3.600 peak 380 spectrum 1 weight 0.10000E+01 volume 0.20439E-02 ppm1 4.058 ppm2 1.104 CV 1
ASSI { 381}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 44 and name HG1%)
3.000 1.100 1.100 peak 381 spectrum 1 weight 0.10000E+01 volume 0.20362E-02 ppm1 4.063 ppm2 0.973 CV 1
ASSI { 382}
(( segid " " and resid 45 and name HB1 ))
(( segid " " and resid 45 and name HA ))
2.500 0.800 0.800 peak 382 spectrum 1 weight 0.10000E+01 volume 0.29801E-02 ppm1 2.287 ppm2 4.059 CV 1
ASSI { 383}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 46 and name HN ))
3.200 1.300 1.300 peak 383 spectrum 1 weight 0.10000E+01 volume 0.76701E-03 ppm1 2.143 ppm2 8.041 CV 1
ASSI { 386}
(( segid " " and resid 45 and name HG2 ))
( segid " " and resid 44 and name HG1%)
3.400 1.400 1.400 peak 386 spectrum 1 weight 0.10000E+01 volume 0.14846E-02 ppm1 2.282 ppm2 0.972 CV 1
ASSI { 387}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HB ))
2.600 0.800 0.800 peak 387 spectrum 1 weight 0.10000E+01 volume 0.25612E-02 ppm1 3.411 ppm2 2.273 CV 1
ASSI { 391}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 46 and name HN ))
2.600 2.600 3.400 peak 391 spectrum 1 weight 0.10000E+01 volume 0.49871E-02 ppm1 0.977 ppm2 8.058 CV 1
ASSI { 393}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 46 and name HA ))
2.400 0.700 0.700 peak 393 spectrum 1 weight 0.10000E+01 volume 0.42139E-02 ppm1 0.976 ppm2 3.418 CV 1
ASSI { 394}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 46 and name HN ))
3.200 1.300 1.300 peak 394 spectrum 1 weight 0.10000E+01 volume 0.13318E-02 ppm1 0.672 ppm2 8.056 CV 1
ASSI { 395}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HN ))
2.700 0.900 0.900 peak 395 spectrum 1 weight 0.10000E+01 volume 0.19553E-02 ppm1 3.415 ppm2 8.060 CV 1
ASSI { 396}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 47 and name HN ))
3.000 1.100 1.100 peak 396 spectrum 1 weight 0.10000E+01 volume 0.12989E-02 ppm1 0.673 ppm2 7.932 CV 1
ASSI { 398}
( segid " " and resid 46 and name HG1%)
(( segid " " and resid 46 and name HA ))
2.600 0.800 0.800 peak 398 spectrum 1 weight 0.10000E+01 volume 0.38607E-02 ppm1 0.668 ppm2 3.421 CV 1
ASSI { 400}
( segid " " and resid 46 and name HG1%)
( segid " " and resid 15 and name HG2%)
2.700 0.900 0.900 peak 400 spectrum 1 weight 0.10000E+01 volume 0.21638E-02 ppm1 0.670 ppm2 1.176 CV 1
ASSI { 402}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 47 and name HN ))
3.200 1.300 1.300 peak 402 spectrum 1 weight 0.10000E+01 volume 0.56384E-02 ppm1 0.912 ppm2 7.935 CV 1
ASSI { 403}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB ))
2.900 1.000 1.000 peak 403 spectrum 1 weight 0.10000E+01 volume 0.11949E-02 ppm1 3.296 ppm2 2.223 CV 1
ASSI { 404}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 50 and name HB% )
2.800 1.000 1.000 peak 404 spectrum 1 weight 0.10000E+01 volume 0.17795E-02 ppm1 3.295 ppm2 1.488 CV 1
ASSI { 405}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 40 and name H8% )
3.000 1.100 1.100 peak 405 spectrum 1 weight 0.10000E+01 volume 0.17791E-02 ppm1 3.300 ppm2 0.624 CV 1
ASSI { 406}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HN ))
2.800 1.000 1.000 peak 406 spectrum 1 weight 0.10000E+01 volume 0.17344E-02 ppm1 3.297 ppm2 7.937 CV 1
ASSI { 407}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HN ))
3.600 1.600 1.600 peak 407 spectrum 1 weight 0.10000E+01 volume 0.53707E-03 ppm1 3.301 ppm2 7.811 CV 1
ASSI { 408}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 47 and name HN ))
2.500 0.800 0.800 peak 408 spectrum 1 weight 0.10000E+01 volume 0.30034E-02 ppm1 2.217 ppm2 7.936 CV 1
ASSI { 409}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 48 and name HN ))
3.600 1.600 1.600 peak 409 spectrum 1 weight 0.10000E+01 volume 0.12171E-02 ppm1 0.911 ppm2 7.812 CV 1
ASSI { 410}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 47 and name HA ))
2.500 0.800 0.800 peak 410 spectrum 1 weight 0.10000E+01 volume 0.44920E-02 ppm1 0.912 ppm2 3.306 CV 1
ASSI { 411}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 44 and name HA ))
3.600 1.600 1.600 peak 411 spectrum 1 weight 0.10000E+01 volume 0.17775E-02 ppm1 0.908 ppm2 3.583 CV 1
ASSI { 413}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 47 and name HA ))
3.100 1.200 1.200 peak 413 spectrum 1 weight 0.10000E+01 volume 0.35026E-02 ppm1 0.856 ppm2 3.306 CV 1
ASSI { 415}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 47 and name HB ))
2.200 0.600 0.600 peak 415 spectrum 1 weight 0.10000E+01 volume 0.55831E-02 ppm1 0.855 ppm2 2.216 CV 1
ASSI { 419}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 44 and name HA ))
3.000 1.200 1.200 peak 419 spectrum 1 weight 0.10000E+01 volume 0.99654E-03 ppm1 0.851 ppm2 3.583 CV 1
ASSI { 420}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 48 and name HA ))
3.100 1.200 1.200 peak 420 spectrum 1 weight 0.10000E+01 volume 0.19230E-02 ppm1 0.858 ppm2 3.936 CV 1
ASSI { 421}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 48 and name HN ))
2.800 1.000 1.000 peak 421 spectrum 1 weight 0.10000E+01 volume 0.12554E-02 ppm1 0.851 ppm2 7.802 CV 1
ASSI { 422}
( segid " " and resid 47 and name HG1%)
(( segid " " and resid 47 and name HN ))
2.700 0.900 0.900 peak 422 spectrum 1 weight 0.10000E+01 volume 0.16578E-02 ppm1 0.855 ppm2 7.936 CV 1
ASSI { 423}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HN ))
2.800 0.900 0.900 peak 423 spectrum 1 weight 0.10000E+01 volume 0.21966E-02 ppm1 3.921 ppm2 7.807 CV 1
ASSI { 424}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HB ))
2.700 0.900 0.900 peak 424 spectrum 1 weight 0.10000E+01 volume 0.22996E-02 ppm1 3.931 ppm2 2.067 CV 1
ASSI { 429}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 48 and name HN ))
3.000 1.100 1.100 peak 429 spectrum 1 weight 0.10000E+01 volume 0.67110E-02 ppm1 1.104 ppm2 7.811 CV 1
ASSI { 432}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 48 and name HA ))
2.400 0.700 0.700 peak 432 spectrum 1 weight 0.10000E+01 volume 0.69154E-02 ppm1 1.106 ppm2 3.929 CV 1
ASSI { 434}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 51 and name HG1 ))
3.100 1.200 1.200 peak 434 spectrum 1 weight 0.10000E+01 volume 0.73116E-03 ppm1 3.921 ppm2 2.814 CV 1
ASSI { 435}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 51 and name HN ))
3.300 1.400 1.400 peak 435 spectrum 1 weight 0.10000E+01 volume 0.11189E-02 ppm1 3.926 ppm2 8.843 CV 1
ASSI { 436}
( segid " " and resid 48 and name HG1%)
(( segid " " and resid 48 and name HA ))
2.800 1.000 1.000 peak 436 spectrum 1 weight 0.10000E+01 volume 0.59839E-02 ppm1 0.992 ppm2 3.936 CV 1
ASSI { 437}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 45 and name HA ))
3.300 3.300 2.700 peak 437 spectrum 1 weight 0.10000E+01 volume 0.35445E-02 ppm1 1.105 ppm2 4.053 CV 1
ASSI { 445}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HN ))
2.700 0.900 0.900 peak 445 spectrum 1 weight 0.10000E+01 volume 0.30201E-02 ppm1 4.229 ppm2 7.917 CV 1
ASSI { 446}
( segid " " and resid 1 and name HB% )
(( segid " " and resid 2 and name HN ))
2.500 0.800 0.800 peak 446 spectrum 1 weight 0.10000E+01 volume 0.41135E-02 ppm1 1.517 ppm2 8.807 CV 1
ASSI { 447}
( segid " " and resid 49 and name HB% )
(( segid " " and resid 46 and name HA ))
2.700 0.900 0.900 peak 447 spectrum 1 weight 0.10000E+01 volume 0.22540E-02 ppm1 1.518 ppm2 3.422 CV 1
ASSI { 450}
( segid " " and resid 49 and name HB% )
( segid " " and resid 14 and name HG2%)
2.300 0.700 0.700 peak 450 spectrum 1 weight 0.10000E+01 volume 0.61569E-02 ppm1 1.521 ppm2 1.051 CV 1
OR { 450}
( segid " " and resid 49 and name HB% )
(( segid " " and resid 14 and name HG12))
ASSI { 451}
( segid " " and resid 49 and name HB% )
( segid " " and resid 14 and name HD1%)
3.100 1.200 1.200 peak 451 spectrum 1 weight 0.10000E+01 volume 0.36217E-02 ppm1 1.522 ppm2 0.746 CV 1
ASSI { 452}
( segid " " and resid 1 and name HB% )
(( segid " " and resid 80 and name HB2 ))
3.000 1.200 1.200 peak 452 spectrum 1 weight 0.10000E+01 volume 0.24122E-02 ppm1 1.512 ppm2 2.110 CV 1
ASSI { 453}
( segid " " and resid 49 and name HB% )
(( segid " " and resid 14 and name HG11))
3.700 1.700 1.700 peak 453 spectrum 1 weight 0.10000E+01 volume 0.22210E-02 ppm1 1.514 ppm2 1.965 CV 1
ASSI { 457}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 53 and name HN ))
2.900 1.100 1.100 peak 457 spectrum 1 weight 0.10000E+01 volume 0.13480E-02 ppm1 3.940 ppm2 8.187 CV 1
ASSI { 458}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 54 and name HD% )
3.100 1.200 1.200 peak 458 spectrum 1 weight 0.10000E+01 volume 0.10620E-02 ppm1 3.946 ppm2 7.460 CV 1
ASSI { 460}
( segid " " and resid 50 and name HB% )
( segid " " and resid 54 and name HD% )
2.800 1.000 1.000 peak 460 spectrum 1 weight 0.10000E+01 volume 0.16327E-02 ppm1 1.483 ppm2 7.467 CV 1
ASSI { 461}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 50 and name HN ))
2.300 0.600 0.600 peak 461 spectrum 1 weight 0.10000E+01 volume 0.60706E-02 ppm1 1.486 ppm2 8.794 CV 1
ASSI { 462}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 50 and name HA ))
2.300 0.700 0.700 peak 462 spectrum 1 weight 0.10000E+01 volume 0.50352E-02 ppm1 1.486 ppm2 3.947 CV 1
ASSI { 470}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 14 and name HD1%)
2.500 0.800 0.800 peak 470 spectrum 1 weight 0.10000E+01 volume 0.36686E-02 ppm1 3.945 ppm2 0.731 CV 1
ASSI { 472}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 53 and name HB1 ))
3.300 1.300 1.300 peak 472 spectrum 1 weight 0.10000E+01 volume 0.14797E-02 ppm1 3.948 ppm2 1.622 CV 1
ASSI { 478}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HG1 ))
3.200 1.300 1.300 peak 478 spectrum 1 weight 0.10000E+01 volume 0.17763E-02 ppm1 4.173 ppm2 2.828 CV 1
ASSI { 480}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HN ))
2.700 0.900 0.900 peak 480 spectrum 1 weight 0.10000E+01 volume 0.15239E-02 ppm1 2.101 ppm2 8.847 CV 1
ASSI { 485}
(( segid " " and resid 51 and name HG1 ))
(( segid " " and resid 51 and name HG2 ))
1.800 0.400 0.400 peak 485 spectrum 1 weight 0.10000E+01 volume 0.46503E-02 ppm1 2.812 ppm2 2.285 CV 1
ASSI { 486}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HN ))
2.500 0.800 0.800 peak 486 spectrum 1 weight 0.10000E+01 volume 0.43559E-02 ppm1 4.115 ppm2 7.736 CV 1
ASSI { 487}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HN ))
3.500 1.500 1.500 peak 487 spectrum 1 weight 0.10000E+01 volume 0.81895E-03 ppm1 4.115 ppm2 8.196 CV 1
ASSI { 492}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 53 and name HN ))
3.800 1.800 1.800 peak 492 spectrum 1 weight 0.10000E+01 volume 0.14335E-02 ppm1 2.138 ppm2 8.198 CV 1
ASSI { 495}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HN ))
2.600 0.900 0.900 peak 495 spectrum 1 weight 0.10000E+01 volume 0.29716E-02 ppm1 3.899 ppm2 8.197 CV 1
ASSI { 499}
(( segid " " and resid 53 and name HD1 ))
(( segid " " and resid 53 and name HB2 ))
3.600 1.600 1.600 peak 499 spectrum 1 weight 0.10000E+01 volume 0.74859E-03 ppm1 2.865 ppm2 1.074 CV 1
ASSI { 504}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 53 and name HB2 ))
3.900 1.900 1.900 peak 504 spectrum 1 weight 0.10000E+01 volume 0.66335E-03 ppm1 2.690 ppm2 1.084 CV 1
ASSI { 506}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB2 ))
2.800 1.000 1.000 peak 506 spectrum 1 weight 0.10000E+01 volume 0.21588E-02 ppm1 3.905 ppm2 1.080 CV 1
ASSI { 510}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 54 and name HA ))
2.800 1.000 1.000 peak 510 spectrum 1 weight 0.10000E+01 volume 0.17148E-02 ppm1 3.426 ppm2 4.834 CV 1
ASSI { 522}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 57 and name HN ))
2.200 0.600 0.600 peak 522 spectrum 1 weight 0.10000E+01 volume 0.81782E-02 ppm1 4.664 ppm2 8.191 CV 1
ASSI { 526}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HN ))
2.800 1.000 1.000 peak 526 spectrum 1 weight 0.10000E+01 volume 0.21753E-02 ppm1 3.227 ppm2 7.615 CV 1
ASSI { 527}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HN ))
3.400 1.400 1.400 peak 527 spectrum 1 weight 0.10000E+01 volume 0.99570E-03 ppm1 3.224 ppm2 7.050 CV 1
ASSI { 531}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HB ))
2.800 1.000 1.000 peak 531 spectrum 1 weight 0.10000E+01 volume 0.24411E-02 ppm1 3.224 ppm2 1.986 CV 1
ASSI { 535}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 66 and name HD1%)
2.600 0.900 0.900 peak 535 spectrum 1 weight 0.10000E+01 volume 0.32430E-02 ppm1 3.224 ppm2 0.395 CV 1
ASSI { 536}
(( segid " " and resid 63 and name HB ))
( segid " " and resid 58 and name HG2%)
4.000 2.000 2.000 peak 536 spectrum 1 weight 0.10000E+01 volume 0.73661E-03 ppm1 1.979 ppm2 0.343 CV 1
ASSI { 540}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 63 and name HN ))
3.700 1.700 1.700 peak 540 spectrum 1 weight 0.10000E+01 volume 0.15458E-02 ppm1 0.823 ppm2 7.617 CV 1
ASSI { 541}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 63 and name HA ))
2.900 1.000 1.000 peak 541 spectrum 1 weight 0.10000E+01 volume 0.21666E-02 ppm1 0.824 ppm2 3.222 CV 1
ASSI { 542}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 40 and name H2A ))
3.300 1.400 1.400 peak 542 spectrum 1 weight 0.10000E+01 volume 0.15466E-02 ppm1 0.824 ppm2 2.466 CV 1
OR { 542}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 40 and name H2B ))
ASSI { 543}
( segid " " and resid 63 and name HG1%)
(( segid " " and resid 63 and name HB ))
2.400 0.800 0.800 peak 543 spectrum 1 weight 0.10000E+01 volume 0.36535E-02 ppm1 0.825 ppm2 1.983 CV 1
ASSI { 546}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 66 and name HB1 ))
2.700 0.900 0.900 peak 546 spectrum 1 weight 0.10000E+01 volume 0.24083E-02 ppm1 0.405 ppm2 2.199 CV 1
ASSI { 550}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 66 and name HA ))
4.600 2.600 1.400 peak 550 spectrum 1 weight 0.10000E+01 volume 0.72685E-03 ppm1 0.402 ppm2 4.455 CV 1
ASSI { 552}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 66 and name HG ))
2.200 0.600 0.600 peak 552 spectrum 1 weight 0.10000E+01 volume 0.57732E-02 ppm1 0.405 ppm2 1.796 CV 1
ASSI { 554}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 66 and name HN ))
4.000 2.000 2.000 peak 554 spectrum 1 weight 0.10000E+01 volume 0.11302E-02 ppm1 0.406 ppm2 7.721 CV 1
ASSI { 557}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HN ))
2.400 0.700 0.700 peak 557 spectrum 1 weight 0.10000E+01 volume 0.40248E-02 ppm1 4.451 ppm2 8.228 CV 1
ASSI { 558}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 68 and name HN ))
4.200 2.200 1.800 peak 558 spectrum 1 weight 0.10000E+01 volume 0.10692E-02 ppm1 4.469 ppm2 8.578 CV 1
ASSI { 562}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 66 and name HG ))
3.200 1.300 1.300 peak 562 spectrum 1 weight 0.10000E+01 volume 0.12734E-02 ppm1 2.195 ppm2 1.791 CV 1
ASSI { 563}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB1 ))
2.800 1.000 1.000 peak 563 spectrum 1 weight 0.10000E+01 volume 0.11267E-02 ppm1 4.454 ppm2 2.198 CV 1
ASSI { 564}
( segid " " and resid 66 and name HD1%)
( segid " " and resid 63 and name HG1%)
2.500 2.500 3.500 peak 564 spectrum 1 weight 0.10000E+01 volume 0.17184E-02 ppm1 0.404 ppm2 0.821 CV 1
ASSI { 567}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 66 and name HA ))
2.500 0.800 0.800 peak 567 spectrum 1 weight 0.10000E+01 volume 0.39670E-02 ppm1 0.606 ppm2 4.462 CV 1
ASSI { 569}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 67 and name HN ))
3.900 1.900 1.900 peak 569 spectrum 1 weight 0.10000E+01 volume 0.13801E-02 ppm1 0.606 ppm2 8.229 CV 1
ASSI { 570}
( segid " " and resid 66 and name HD2%)
( segid " " and resid 75 and name HD% )
3.500 1.500 1.500 peak 570 spectrum 1 weight 0.10000E+01 volume 0.10188E-02 ppm1 0.606 ppm2 6.819 CV 1
ASSI { 571}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 72 and name HA ))
3.000 1.100 1.100 peak 571 spectrum 1 weight 0.10000E+01 volume 0.18217E-02 ppm1 0.604 ppm2 4.101 CV 1
ASSI { 572}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 71 and name HB2 ))
3.600 1.600 1.600 peak 572 spectrum 1 weight 0.10000E+01 volume 0.16013E-02 ppm1 0.606 ppm2 2.895 CV 1
ASSI { 574}
( segid " " and resid 66 and name HD2%)
( segid " " and resid 72 and name HB% )
4.600 2.700 1.400 peak 574 spectrum 1 weight 0.10000E+01 volume 0.45691E-03 ppm1 0.606 ppm2 1.575 CV 1
ASSI { 575}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 66 and name HG ))
2.400 0.700 0.700 peak 575 spectrum 1 weight 0.10000E+01 volume 0.42772E-02 ppm1 0.606 ppm2 1.792 CV 1
ASSI { 576}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 66 and name HB1 ))
2.900 1.000 1.000 peak 576 spectrum 1 weight 0.10000E+01 volume 0.14027E-02 ppm1 0.607 ppm2 2.200 CV 1
ASSI { 579}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HN ))
2.900 1.000 1.000 peak 579 spectrum 1 weight 0.10000E+01 volume 0.11743E-02 ppm1 4.497 ppm2 9.871 CV 1
ASSI { 583}
(( segid " " and resid 58 and name HA ))
( segid " " and resid 58 and name HG2%)
2.600 0.800 0.800 peak 583 spectrum 1 weight 0.10000E+01 volume 0.26999E-02 ppm1 4.501 ppm2 0.339 CV 1
ASSI { 584}
(( segid " " and resid 58 and name HA ))
( segid " " and resid 58 and name HD1%)
4.100 2.100 1.900 peak 584 spectrum 1 weight 0.10000E+01 volume 0.12227E-02 ppm1 4.490 ppm2 0.590 CV 1
ASSI { 586}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HG12))
2.600 0.900 0.900 peak 586 spectrum 1 weight 0.10000E+01 volume 0.16273E-02 ppm1 4.494 ppm2 0.841 CV 1
ASSI { 588}
(( segid " " and resid 58 and name HG11))
(( segid " " and resid 58 and name HA ))
3.100 1.200 1.200 peak 588 spectrum 1 weight 0.10000E+01 volume 0.96202E-03 ppm1 1.542 ppm2 4.496 CV 1
ASSI { 591}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 58 and name HN ))
4.000 2.000 2.000 peak 591 spectrum 1 weight 0.10000E+01 volume 0.11517E-02 ppm1 0.339 ppm2 9.880 CV 1
ASSI { 592}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 63 and name HN ))
3.300 1.400 1.400 peak 592 spectrum 1 weight 0.10000E+01 volume 0.10922E-02 ppm1 0.339 ppm2 7.620 CV 1
ASSI { 594}
( segid " " and resid 58 and name HG2%)
( segid " " and resid 75 and name HD% )
4.100 2.100 1.900 peak 594 spectrum 1 weight 0.10000E+01 volume 0.46503E-03 ppm1 0.336 ppm2 6.825 CV 1
ASSI { 597}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 62 and name HA ))
4.200 2.200 1.800 peak 597 spectrum 1 weight 0.10000E+01 volume 0.57230E-03 ppm1 0.337 ppm2 4.654 CV 1
ASSI { 598}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 59 and name HD1 ))
3.200 1.200 1.200 peak 598 spectrum 1 weight 0.10000E+01 volume 0.16997E-02 ppm1 0.336 ppm2 3.816 CV 1
OR { 598}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 59 and name HD2 ))
ASSI { 599}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 63 and name HA ))
3.000 1.100 1.100 peak 599 spectrum 1 weight 0.10000E+01 volume 0.17839E-02 ppm1 0.339 ppm2 3.226 CV 1
ASSI { 600}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 58 and name HB ))
2.300 0.700 0.700 peak 600 spectrum 1 weight 0.10000E+01 volume 0.45703E-02 ppm1 0.338 ppm2 1.688 CV 1
ASSI { 603}
( segid " " and resid 58 and name HG2%)
( segid " " and resid 66 and name HD1%)
2.700 0.900 0.900 peak 603 spectrum 1 weight 0.10000E+01 volume 0.28837E-02 ppm1 0.337 ppm2 0.443 CV 1
ASSI { 607}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HN ))
4.000 2.000 2.000 peak 607 spectrum 1 weight 0.10000E+01 volume 0.11398E-02 ppm1 0.587 ppm2 9.889 CV 1
ASSI { 608}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 76 and name HA ))
4.200 2.200 1.800 peak 608 spectrum 1 weight 0.10000E+01 volume 0.12193E-02 ppm1 0.589 ppm2 3.477 CV 1
ASSI { 609}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 73 and name HA ))
2.800 1.000 1.000 peak 609 spectrum 1 weight 0.10000E+01 volume 0.14333E-02 ppm1 0.588 ppm2 3.668 CV 1
ASSI { 610}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 51 and name HG1 ))
3.400 1.500 1.500 peak 610 spectrum 1 weight 0.10000E+01 volume 0.93237E-03 ppm1 0.581 ppm2 2.830 CV 1
ASSI { 611}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 51 and name HG2 ))
3.200 1.300 1.300 peak 611 spectrum 1 weight 0.10000E+01 volume 0.84316E-03 ppm1 0.582 ppm2 2.299 CV 1
ASSI { 613}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HB ))
2.600 0.900 0.900 peak 613 spectrum 1 weight 0.10000E+01 volume 0.30419E-02 ppm1 0.585 ppm2 1.700 CV 1
ASSI { 618}
( segid " " and resid 58 and name HD1%)
( segid " " and resid 58 and name HG2%)
2.500 0.800 0.800 peak 618 spectrum 1 weight 0.10000E+01 volume 0.43601E-02 ppm1 0.586 ppm2 0.345 CV 1
ASSI { 619}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 57 and name HA ))
3.400 3.400 2.600 peak 619 spectrum 1 weight 0.10000E+01 volume 0.27411E-03 ppm1 0.582 ppm2 4.733 CV 1
ASSI { 620}
( segid " " and resid 58 and name HD1%)
( segid " " and resid 75 and name HE% )
4.300 2.300 1.700 peak 620 spectrum 1 weight 0.10000E+01 volume 0.97999E-03 ppm1 0.588 ppm2 6.527 CV 1
ASSI { 621}
( segid " " and resid 58 and name HD1%)
( segid " " and resid 75 and name HD% )
3.600 1.600 1.600 peak 621 spectrum 1 weight 0.10000E+01 volume 0.11379E-02 ppm1 0.589 ppm2 6.815 CV 1
ASSI { 622}
( segid " " and resid 76 and name HD1%)
( segid " " and resid 54 and name HE% )
3.600 1.600 1.600 peak 622 spectrum 1 weight 0.10000E+01 volume 0.72417E-03 ppm1 0.585 ppm2 7.115 CV 1
ASSI { 623}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 76 and name HN ))
3.900 1.900 1.900 peak 623 spectrum 1 weight 0.10000E+01 volume 0.14749E-02 ppm1 0.590 ppm2 8.521 CV 1
ASSI { 625}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HN ))
2.800 0.900 0.900 peak 625 spectrum 1 weight 0.10000E+01 volume 0.20799E-02 ppm1 3.485 ppm2 8.514 CV 1
ASSI { 626}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 76 and name HA ))
2.500 0.800 0.800 peak 626 spectrum 1 weight 0.10000E+01 volume 0.33590E-02 ppm1 0.513 ppm2 3.479 CV 1
ASSI { 627}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 54 and name HD% )
3.400 1.500 1.500 peak 627 spectrum 1 weight 0.10000E+01 volume 0.83022E-03 ppm1 0.519 ppm2 7.465 CV 1
ASSI { 630}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 80 and name HN ))
4.000 2.000 2.000 peak 630 spectrum 1 weight 0.10000E+01 volume 0.41657E-03 ppm1 0.511 ppm2 7.877 CV 1
ASSI { 631}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 76 and name HN ))
3.900 1.900 1.900 peak 631 spectrum 1 weight 0.10000E+01 volume 0.15686E-02 ppm1 0.515 ppm2 8.511 CV 1
ASSI { 632}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 75 and name HD% )
3.300 1.300 1.300 peak 632 spectrum 1 weight 0.10000E+01 volume 0.78222E-03 ppm1 3.480 ppm2 6.823 CV 1
ASSI { 636}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 80 and name HG2 ))
3.500 1.600 1.600 peak 636 spectrum 1 weight 0.10000E+01 volume 0.53661E-03 ppm1 0.516 ppm2 2.577 CV 1
ASSI { 638}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HB ))
3.000 1.200 1.200 peak 638 spectrum 1 weight 0.10000E+01 volume 0.12617E-02 ppm1 3.482 ppm2 1.776 CV 1
ASSI { 641}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 77 and name HB1 ))
3.000 1.100 1.100 peak 641 spectrum 1 weight 0.10000E+01 volume 0.34765E-02 ppm1 0.515 ppm2 1.769 CV 1
ASSI { 642}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 76 and name HG11))
3.600 1.600 1.600 peak 642 spectrum 1 weight 0.10000E+01 volume 0.17498E-02 ppm1 0.513 ppm2 1.964 CV 1
ASSI { 644}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 76 and name HG12))
2.300 0.700 0.700 peak 644 spectrum 1 weight 0.10000E+01 volume 0.41747E-02 ppm1 0.513 ppm2 0.929 CV 1
ASSI { 648}
(( segid " " and resid 76 and name HG11))
(( segid " " and resid 76 and name HA ))
3.100 1.200 1.200 peak 648 spectrum 1 weight 0.10000E+01 volume 0.13529E-02 ppm1 1.950 ppm2 3.481 CV 1
ASSI { 649}
(( segid " " and resid 76 and name HG11))
(( segid " " and resid 76 and name HN ))
2.300 0.700 0.700 peak 649 spectrum 1 weight 0.10000E+01 volume 0.22259E-02 ppm1 1.954 ppm2 8.519 CV 1
ASSI { 656}
(( segid " " and resid 76 and name HB ))
(( segid " " and resid 76 and name HN ))
2.400 0.700 0.700 peak 656 spectrum 1 weight 0.10000E+01 volume 0.27071E-02 ppm1 1.770 ppm2 8.513 CV 1
ASSI { 660}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HB2 ))
2.700 0.900 0.900 peak 660 spectrum 1 weight 0.10000E+01 volume 0.29499E-02 ppm1 4.479 ppm2 2.900 CV 1
ASSI { 662}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HB1 ))
3.100 1.200 1.200 peak 662 spectrum 1 weight 0.10000E+01 volume 0.19385E-02 ppm1 4.483 ppm2 3.126 CV 1
ASSI { 663}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB1 ))
2.500 0.800 0.800 peak 663 spectrum 1 weight 0.10000E+01 volume 0.42001E-02 ppm1 4.478 ppm2 2.041 CV 1
OR { 663}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 664}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HG2 ))
3.400 1.400 1.400 peak 664 spectrum 1 weight 0.10000E+01 volume 0.15129E-02 ppm1 4.476 ppm2 1.441 CV 1
ASSI { 665}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HD2 ))
4.100 2.100 1.900 peak 665 spectrum 1 weight 0.10000E+01 volume 0.14689E-02 ppm1 4.476 ppm2 1.739 CV 1
OR { 665}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HD1 ))
ASSI { 667}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 72 and name HN ))
3.300 1.400 1.400 peak 667 spectrum 1 weight 0.10000E+01 volume 0.20689E-02 ppm1 2.896 ppm2 8.222 CV 1
ASSI { 668}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 68 and name HN ))
3.000 1.100 1.100 peak 668 spectrum 1 weight 0.10000E+01 volume 0.12602E-02 ppm1 2.894 ppm2 8.568 CV 1
ASSI { 671}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HN ))
2.500 0.800 0.800 peak 671 spectrum 1 weight 0.10000E+01 volume 0.41688E-02 ppm1 4.050 ppm2 7.034 CV 1
ASSI { 672}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 64 and name HN ))
3.900 1.900 1.900 peak 672 spectrum 1 weight 0.10000E+01 volume 0.13096E-02 ppm1 1.814 ppm2 7.043 CV 1
ASSI { 674}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HN ))
2.800 1.000 1.000 peak 674 spectrum 1 weight 0.10000E+01 volume 0.11743E-02 ppm1 1.748 ppm2 7.043 CV 1
ASSI { 675}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 64 and name HA ))
2.700 0.900 0.900 peak 675 spectrum 1 weight 0.10000E+01 volume 0.18305E-02 ppm1 1.822 ppm2 4.050 CV 1
ASSI { 676}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HA ))
3.200 1.300 1.300 peak 676 spectrum 1 weight 0.10000E+01 volume 0.20337E-02 ppm1 1.749 ppm2 4.048 CV 1
ASSI { 677}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HG2 ))
2.800 1.000 1.000 peak 677 spectrum 1 weight 0.10000E+01 volume 0.20822E-02 ppm1 4.049 ppm2 1.386 CV 1
OR { 677}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HG1 ))
ASSI { 681}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 65 and name HN ))
3.200 1.300 1.300 peak 681 spectrum 1 weight 0.10000E+01 volume 0.11517E-02 ppm1 4.047 ppm2 7.279 CV 1
ASSI { 683}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 46 and name HN ))
3.300 1.400 1.400 peak 683 spectrum 1 weight 0.10000E+01 volume 0.10955E-02 ppm1 4.050 ppm2 8.057 CV 1
ASSI { 686}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 40 and name H41A))
3.600 1.600 1.600 peak 686 spectrum 1 weight 0.10000E+01 volume 0.61271E-03 ppm1 4.043 ppm2 8.192 CV 1
ASSI { 687}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 40 and name H41A))
3.600 1.600 1.600 peak 687 spectrum 1 weight 0.10000E+01 volume 0.51550E-03 ppm1 1.383 ppm2 8.200 CV 1
OR { 687}
(( segid " " and resid 64 and name HG1 ))
(( segid " " and resid 40 and name H41A))
ASSI { 688}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 63 and name HG1%)
3.200 1.200 1.200 peak 688 spectrum 1 weight 0.10000E+01 volume 0.13046E-02 ppm1 4.049 ppm2 0.840 CV 1
ASSI { 689}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HA ))
3.100 1.200 1.200 peak 689 spectrum 1 weight 0.10000E+01 volume 0.18410E-02 ppm1 3.040 ppm2 4.881 CV 1
ASSI { 690}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HA ))
2.900 1.100 1.100 peak 690 spectrum 1 weight 0.10000E+01 volume 0.18081E-02 ppm1 2.722 ppm2 4.864 CV 1
ASSI { 691}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HN ))
3.200 1.300 1.300 peak 691 spectrum 1 weight 0.10000E+01 volume 0.13114E-02 ppm1 3.040 ppm2 7.271 CV 1
ASSI { 692}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 66 and name HN ))
3.000 1.100 1.100 peak 692 spectrum 1 weight 0.10000E+01 volume 0.16828E-02 ppm1 3.038 ppm2 7.729 CV 1
ASSI { 693}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 64 and name HN ))
4.500 2.500 1.500 peak 693 spectrum 1 weight 0.10000E+01 volume 0.63554E-03 ppm1 3.039 ppm2 6.996 CV 1
ASSI { 694}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 64 and name HN ))
4.000 2.000 2.000 peak 694 spectrum 1 weight 0.10000E+01 volume 0.73271E-03 ppm1 2.718 ppm2 7.006 CV 1
ASSI { 696}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 69 and name HN ))
2.200 0.600 0.600 peak 696 spectrum 1 weight 0.10000E+01 volume 0.49209E-02 ppm1 5.250 ppm2 8.170 CV 1
ASSI { 697}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HN ))
2.800 1.000 1.000 peak 697 spectrum 1 weight 0.10000E+01 volume 0.12346E-02 ppm1 5.254 ppm2 8.580 CV 1
ASSI { 698}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HB ))
2.400 0.700 0.700 peak 698 spectrum 1 weight 0.10000E+01 volume 0.30276E-02 ppm1 5.249 ppm2 4.355 CV 1
ASSI { 699}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 31 and name HA ))
2.400 0.700 0.700 peak 699 spectrum 1 weight 0.10000E+01 volume 0.31520E-02 ppm1 5.249 ppm2 4.916 CV 1
ASSI { 701}
(( segid " " and resid 68 and name HB ))
( segid " " and resid 68 and name HG2%)
2.400 0.700 0.700 peak 701 spectrum 1 weight 0.10000E+01 volume 0.35875E-02 ppm1 4.350 ppm2 1.050 CV 1
ASSI { 704}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 31 and name HB1 ))
3.300 1.300 1.300 peak 704 spectrum 1 weight 0.10000E+01 volume 0.11672E-02 ppm1 5.243 ppm2 4.063 CV 1
ASSI { 705}
(( segid " " and resid 68 and name HB ))
( segid " " and resid 69 and name HG1%)
4.800 2.800 1.200 peak 705 spectrum 1 weight 0.10000E+01 volume 0.61988E-03 ppm1 4.358 ppm2 0.438 CV 1
ASSI { 706}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 68 and name HA ))
2.600 0.800 0.800 peak 706 spectrum 1 weight 0.10000E+01 volume 0.33492E-02 ppm1 1.052 ppm2 5.255 CV 1
ASSI { 707}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 31 and name HA ))
3.600 1.600 1.600 peak 707 spectrum 1 weight 0.10000E+01 volume 0.17632E-02 ppm1 1.052 ppm2 4.912 CV 1
ASSI { 708}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 68 and name HG1 ))
3.000 1.200 1.200 peak 708 spectrum 1 weight 0.10000E+01 volume 0.17275E-02 ppm1 1.054 ppm2 5.387 CV 1
ASSI { 711}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 31 and name HB1 ))
3.100 1.200 1.200 peak 711 spectrum 1 weight 0.10000E+01 volume 0.16651E-02 ppm1 1.051 ppm2 4.097 CV 1
ASSI { 713}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 68 and name HN ))
2.700 0.900 0.900 peak 713 spectrum 1 weight 0.10000E+01 volume 0.26251E-02 ppm1 1.054 ppm2 8.582 CV 1
ASSI { 714}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HG1 ))
3.500 1.500 1.500 peak 714 spectrum 1 weight 0.10000E+01 volume 0.12267E-02 ppm1 5.250 ppm2 5.381 CV 1
ASSI { 715}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 21 and name HA ))
2.500 0.800 0.800 peak 715 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 0.997 ppm2 4.319 CV 1
ASSI { 717}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 25 and name HN ))
4.200 2.200 1.800 peak 717 spectrum 1 weight 0.10000E+01 volume 0.84412E-03 ppm1 0.992 ppm2 7.726 CV 1
ASSI { 719}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 22 and name HD1 ))
3.300 1.400 1.400 peak 719 spectrum 1 weight 0.10000E+01 volume 0.20324E-02 ppm1 0.997 ppm2 4.039 CV 1
ASSI { 720}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 22 and name HD2 ))
2.800 1.000 1.000 peak 720 spectrum 1 weight 0.10000E+01 volume 0.26194E-02 ppm1 0.997 ppm2 3.690 CV 1
ASSI { 721}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 25 and name HB1 ))
3.100 1.200 1.200 peak 721 spectrum 1 weight 0.10000E+01 volume 0.22455E-02 ppm1 0.997 ppm2 2.683 CV 1
ASSI { 722}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 25 and name HB2 ))
3.800 1.800 1.800 peak 722 spectrum 1 weight 0.10000E+01 volume 0.16872E-02 ppm1 0.998 ppm2 2.574 CV 1
ASSI { 723}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 21 and name HG12))
2.400 0.700 0.700 peak 723 spectrum 1 weight 0.10000E+01 volume 0.35951E-02 ppm1 0.995 ppm2 1.301 CV 1
OR { 723}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 21 and name HG11))
ASSI { 724}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 21 and name HB ))
2.300 0.700 0.700 peak 724 spectrum 1 weight 0.10000E+01 volume 0.51936E-02 ppm1 0.996 ppm2 1.597 CV 1
ASSI { 725}
( segid " " and resid 21 and name HG2%)
( segid " " and resid 21 and name HD1%)
3.400 1.500 1.500 peak 725 spectrum 1 weight 0.10000E+01 volume 0.31189E-02 ppm1 0.996 ppm2 0.792 CV 1
ASSI { 726}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 22 and name HB2 ))
4.800 2.800 1.200 peak 726 spectrum 1 weight 0.10000E+01 volume 0.64794E-03 ppm1 1.002 ppm2 1.734 CV 1
ASSI { 727}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 18 and name HA ))
2.500 0.800 0.800 peak 727 spectrum 1 weight 0.10000E+01 volume 0.49058E-02 ppm1 0.938 ppm2 3.941 CV 1
ASSI { 728}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 18 and name HN ))
3.900 1.900 1.900 peak 728 spectrum 1 weight 0.10000E+01 volume 0.15652E-02 ppm1 0.937 ppm2 8.216 CV 1
ASSI { 729}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 19 and name HN ))
3.200 1.200 1.200 peak 729 spectrum 1 weight 0.10000E+01 volume 0.12486E-02 ppm1 0.944 ppm2 8.473 CV 1
ASSI { 730}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 46 and name HN ))
3.400 1.500 1.500 peak 730 spectrum 1 weight 0.10000E+01 volume 0.11585E-02 ppm1 0.945 ppm2 8.058 CV 1
ASSI { 731}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 19 and name HA ))
3.600 1.600 1.600 peak 731 spectrum 1 weight 0.10000E+01 volume 0.82749E-03 ppm1 0.944 ppm2 4.812 CV 1
ASSI { 732}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 42 and name HA ))
3.300 1.300 1.300 peak 732 spectrum 1 weight 0.10000E+01 volume 0.17472E-02 ppm1 0.940 ppm2 4.289 CV 1
ASSI { 733}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 45 and name HA ))
4.400 2.400 1.600 peak 733 spectrum 1 weight 0.10000E+01 volume 0.10125E-02 ppm1 0.937 ppm2 4.059 CV 1
ASSI { 734}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 42 and name HB2 ))
3.400 1.400 1.400 peak 734 spectrum 1 weight 0.10000E+01 volume 0.22734E-02 ppm1 0.938 ppm2 3.660 CV 1
ASSI { 735}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 45 and name HB2 ))
3.100 1.200 1.200 peak 735 spectrum 1 weight 0.10000E+01 volume 0.15849E-02 ppm1 0.939 ppm2 2.149 CV 1
ASSI { 736}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 45 and name HB1 ))
3.700 1.700 1.700 peak 736 spectrum 1 weight 0.10000E+01 volume 0.26714E-02 ppm1 0.939 ppm2 2.292 CV 1
ASSI { 737}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 17 and name HG1 ))
4.100 2.100 1.900 peak 737 spectrum 1 weight 0.10000E+01 volume 0.81761E-03 ppm1 0.937 ppm2 2.431 CV 1
ASSI { 738}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 21 and name HG11))
3.300 3.300 2.700 peak 738 spectrum 1 weight 0.10000E+01 volume 0.31558E-02 ppm1 0.941 ppm2 1.298 CV 1
OR { 738}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 21 and name HG12))
ASSI { 739}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 18 and name HB ))
2.200 0.600 0.600 peak 739 spectrum 1 weight 0.10000E+01 volume 0.71855E-02 ppm1 0.942 ppm2 1.631 CV 1
OR { 739}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 18 and name HG11))
ASSI { 740}
( segid " " and resid 18 and name HG2%)
( segid " " and resid 19 and name HB% )
2.300 0.700 0.700 peak 740 spectrum 1 weight 0.10000E+01 volume 0.90695E-02 ppm1 0.936 ppm2 1.549 CV 1
ASSI { 742}
( segid " " and resid 18 and name HG2%)
( segid " " and resid 18 and name HD1%)
2.500 0.800 0.800 peak 742 spectrum 1 weight 0.10000E+01 volume 0.42160E-02 ppm1 0.936 ppm2 0.785 CV 1
ASSI { 743}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HB ))
2.300 0.600 0.600 peak 743 spectrum 1 weight 0.10000E+01 volume 0.61368E-02 ppm1 1.102 ppm2 4.174 CV 1
ASSI { 744}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 8 and name HN ))
2.900 1.100 1.100 peak 744 spectrum 1 weight 0.10000E+01 volume 0.22769E-02 ppm1 1.102 ppm2 8.385 CV 1
ASSI { 746}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HN ))
2.600 0.900 0.900 peak 746 spectrum 1 weight 0.10000E+01 volume 0.21645E-02 ppm1 1.102 ppm2 8.648 CV 1
ASSI { 747}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HA ))
2.200 0.600 0.600 peak 747 spectrum 1 weight 0.10000E+01 volume 0.77648E-02 ppm1 1.102 ppm2 3.680 CV 1
ASSI { 749}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HN ))
2.100 0.600 0.600 peak 749 spectrum 1 weight 0.10000E+01 volume 0.92052E-02 ppm1 4.473 ppm2 7.829 CV 1
ASSI { 753}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB1 ))
3.000 1.100 1.100 peak 753 spectrum 1 weight 0.10000E+01 volume 0.18277E-02 ppm1 4.476 ppm2 3.246 CV 1
ASSI { 758}
(( segid " " and resid 56 and name HB ))
( segid " " and resid 56 and name HG1%)
2.600 0.900 0.900 peak 758 spectrum 1 weight 0.10000E+01 volume 0.27358E-02 ppm1 2.002 ppm2 0.945 CV 1
OR { 758}
(( segid " " and resid 56 and name HB ))
( segid " " and resid 56 and name HG2%)
ASSI { 760}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 56 and name HA ))
2.900 1.000 1.000 peak 760 spectrum 1 weight 0.10000E+01 volume 0.25684E-02 ppm1 0.960 ppm2 4.669 CV 1
ASSI { 761}
( segid " " and resid 56 and name HG1%)
(( segid " " and resid 56 and name HA ))
3.000 1.100 1.100 peak 761 spectrum 1 weight 0.10000E+01 volume 0.25535E-02 ppm1 0.911 ppm2 4.666 CV 1
ASSI { 763}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 26 and name HN ))
2.400 0.700 0.700 peak 763 spectrum 1 weight 0.10000E+01 volume 0.47161E-02 ppm1 0.910 ppm2 7.484 CV 1
ASSI { 768}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 27 and name HN ))
3.900 1.900 1.900 peak 768 spectrum 1 weight 0.10000E+01 volume 0.12596E-02 ppm1 0.914 ppm2 6.358 CV 1
ASSI { 769}
( segid " " and resid 56 and name HG1%)
( segid " " and resid 75 and name HE% )
3.400 1.500 1.500 peak 769 spectrum 1 weight 0.10000E+01 volume 0.14022E-02 ppm1 0.912 ppm2 6.526 CV 1
ASSI { 770}
( segid " " and resid 56 and name HG1%)
(( segid " " and resid 57 and name HN ))
3.100 1.200 1.200 peak 770 spectrum 1 weight 0.10000E+01 volume 0.25823E-02 ppm1 0.914 ppm2 8.187 CV 1
ASSI { 777}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 26 and name HB ))
2.200 0.600 0.600 peak 777 spectrum 1 weight 0.10000E+01 volume 0.81753E-02 ppm1 0.912 ppm2 2.327 CV 1
ASSI { 780}
( segid " " and resid 56 and name HG1%)
( segid " " and resid 58 and name HD1%)
2.700 0.900 0.900 peak 780 spectrum 1 weight 0.10000E+01 volume 0.33434E-02 ppm1 0.912 ppm2 0.583 CV 1
ASSI { 781}
( segid " " and resid 56 and name HG2%)
(( segid " " and resid 56 and name HB ))
2.100 0.600 0.600 peak 781 spectrum 1 weight 0.10000E+01 volume 0.10150E-01 ppm1 0.959 ppm2 2.009 CV 1
ASSI { 783}
( segid " " and resid 56 and name HG2%)
( segid " " and resid 75 and name HE% )
3.200 1.300 1.300 peak 783 spectrum 1 weight 0.10000E+01 volume 0.13930E-02 ppm1 0.963 ppm2 6.526 CV 1
ASSI { 785}
( segid " " and resid 56 and name HG2%)
( segid " " and resid 75 and name HD% )
3.200 1.300 1.300 peak 785 spectrum 1 weight 0.10000E+01 volume 0.11855E-02 ppm1 0.959 ppm2 6.837 CV 1
ASSI { 786}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 44 and name HN ))
2.200 0.600 0.600 peak 786 spectrum 1 weight 0.10000E+01 volume 0.59843E-02 ppm1 1.115 ppm2 7.298 CV 1
ASSI { 787}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HN ))
2.700 0.900 0.900 peak 787 spectrum 1 weight 0.10000E+01 volume 0.23362E-02 ppm1 3.591 ppm2 7.296 CV 1
ASSI { 788}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 45 and name HN ))
2.900 1.100 1.100 peak 788 spectrum 1 weight 0.10000E+01 volume 0.14036E-02 ppm1 2.210 ppm2 6.998 CV 1
ASSI { 790}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 47 and name HN ))
3.400 1.400 1.400 peak 790 spectrum 1 weight 0.10000E+01 volume 0.13096E-02 ppm1 3.587 ppm2 7.944 CV 1
ASSI { 791}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 46 and name HN ))
3.800 1.800 1.800 peak 791 spectrum 1 weight 0.10000E+01 volume 0.61946E-03 ppm1 3.591 ppm2 8.066 CV 1
ASSI { 792}
( segid " " and resid 44 and name HG1%)
(( segid " " and resid 44 and name HN ))
3.900 1.900 1.900 peak 792 spectrum 1 weight 0.10000E+01 volume 0.22852E-02 ppm1 0.968 ppm2 7.299 CV 1
ASSI { 793}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 45 and name HN ))
4.000 2.000 2.000 peak 793 spectrum 1 weight 0.10000E+01 volume 0.13379E-02 ppm1 1.114 ppm2 6.979 CV 1
ASSI { 794}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 42 and name HA ))
3.200 1.300 1.300 peak 794 spectrum 1 weight 0.10000E+01 volume 0.25980E-02 ppm1 1.112 ppm2 4.303 CV 1
ASSI { 795}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 40 and name H43A))
2.700 2.700 3.300 peak 795 spectrum 1 weight 0.10000E+01 volume 0.11033E-02 ppm1 1.116 ppm2 2.830 CV 1
OR { 795}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 40 and name H43B))
ASSI { 796}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 43 and name HB2 ))
2.500 2.500 3.500 peak 796 spectrum 1 weight 0.10000E+01 volume 0.14746E-02 ppm1 1.110 ppm2 1.903 CV 1
ASSI { 797}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 44 and name HB ))
2.100 0.600 0.600 peak 797 spectrum 1 weight 0.10000E+01 volume 0.10457E-01 ppm1 1.111 ppm2 2.202 CV 1
ASSI { 798}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 40 and name H38B))
3.100 1.200 1.200 peak 798 spectrum 1 weight 0.10000E+01 volume 0.15543E-02 ppm1 1.112 ppm2 2.450 CV 1
OR { 798}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 40 and name H38A))
ASSI { 801}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 33 and name HB ))
2.300 0.700 0.700 peak 801 spectrum 1 weight 0.10000E+01 volume 0.62624E-02 ppm1 1.261 ppm2 4.187 CV 1
ASSI { 806}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 32 and name HB2 ))
3.100 1.200 1.200 peak 806 spectrum 1 weight 0.10000E+01 volume 0.14643E-02 ppm1 1.258 ppm2 3.148 CV 1
OR { 806}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 32 and name HB1 ))
ASSI { 807}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 40 and name H43B))
3.400 1.500 1.500 peak 807 spectrum 1 weight 0.10000E+01 volume 0.86749E-03 ppm1 1.263 ppm2 2.830 CV 1
OR { 807}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 40 and name H43A))
ASSI { 809}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 34 and name HN ))
3.400 1.500 1.500 peak 809 spectrum 1 weight 0.10000E+01 volume 0.86000E-03 ppm1 1.265 ppm2 8.009 CV 1
ASSI { 812}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 26 and name HN ))
3.700 1.700 1.700 peak 812 spectrum 1 weight 0.10000E+01 volume 0.14623E-02 ppm1 0.725 ppm2 7.483 CV 1
ASSI { 813}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 12 and name HN ))
3.400 1.500 1.500 peak 813 spectrum 1 weight 0.10000E+01 volume 0.97132E-03 ppm1 0.729 ppm2 8.929 CV 1
ASSI { 814}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 27 and name HN ))
3.500 1.500 1.500 peak 814 spectrum 1 weight 0.10000E+01 volume 0.13477E-02 ppm1 0.727 ppm2 6.363 CV 1
ASSI { 815}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 26 and name HA ))
2.500 0.800 0.800 peak 815 spectrum 1 weight 0.10000E+01 volume 0.40309E-02 ppm1 0.726 ppm2 3.532 CV 1
ASSI { 816}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 36 and name HA ))
2.200 0.600 0.600 peak 816 spectrum 1 weight 0.10000E+01 volume 0.55642E-02 ppm1 0.761 ppm2 4.372 CV 1
ASSI { 817}
( segid " " and resid 26 and name HG1%)
(( segid " " and resid 26 and name HB ))
2.300 0.700 0.700 peak 817 spectrum 1 weight 0.10000E+01 volume 0.60735E-02 ppm1 0.726 ppm2 2.328 CV 1
ASSI { 818}
( segid " " and resid 26 and name HG1%)
( segid " " and resid 12 and name HB% )
2.800 1.000 1.000 peak 818 spectrum 1 weight 0.10000E+01 volume 0.34151E-02 ppm1 0.725 ppm2 1.674 CV 1
ASSI { 819}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 69 and name HN ))
2.300 0.600 0.600 peak 819 spectrum 1 weight 0.10000E+01 volume 0.48866E-02 ppm1 0.437 ppm2 8.158 CV 1
ASSI { 820}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 69 and name HB ))
2.300 0.700 0.700 peak 820 spectrum 1 weight 0.10000E+01 volume 0.49661E-02 ppm1 0.435 ppm2 2.284 CV 1
ASSI { 821}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 69 and name HA ))
2.500 0.800 0.800 peak 821 spectrum 1 weight 0.10000E+01 volume 0.36944E-02 ppm1 0.436 ppm2 3.403 CV 1
ASSI { 822}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 28 and name HA ))
3.700 1.700 1.700 peak 822 spectrum 1 weight 0.10000E+01 volume 0.15057E-02 ppm1 0.435 ppm2 3.552 CV 1
ASSI { 823}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 70 and name HN ))
4.500 2.500 1.500 peak 823 spectrum 1 weight 0.10000E+01 volume 0.69175E-03 ppm1 0.436 ppm2 9.425 CV 1
ASSI { 824}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 30 and name HN ))
3.700 1.700 1.700 peak 824 spectrum 1 weight 0.10000E+01 volume 0.83466E-03 ppm1 0.433 ppm2 7.518 CV 1
ASSI { 825}
( segid " " and resid 69 and name HG1%)
( segid " " and resid 32 and name HE% )
3.100 1.200 1.200 peak 825 spectrum 1 weight 0.10000E+01 volume 0.12540E-02 ppm1 0.436 ppm2 6.989 CV 1
ASSI { 826}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 32 and name HZ ))
3.100 1.200 1.200 peak 826 spectrum 1 weight 0.10000E+01 volume 0.10521E-02 ppm1 0.437 ppm2 6.867 CV 1
ASSI { 828}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 68 and name HA ))
4.100 2.100 1.900 peak 828 spectrum 1 weight 0.10000E+01 volume 0.87553E-03 ppm1 0.439 ppm2 5.246 CV 1
ASSI { 829}
( segid " " and resid 69 and name HG2%)
( segid " " and resid 69 and name HG1%)
2.300 0.700 0.700 peak 829 spectrum 1 weight 0.10000E+01 volume 0.65724E-02 ppm1 0.644 ppm2 0.436 CV 1
ASSI { 832}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 70 and name HA2 ))
3.600 1.600 1.600 peak 832 spectrum 1 weight 0.10000E+01 volume 0.81229E-03 ppm1 0.647 ppm2 3.803 CV 1
ASSI { 834}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 69 and name HN ))
2.600 0.800 0.800 peak 834 spectrum 1 weight 0.10000E+01 volume 0.14395E-02 ppm1 0.644 ppm2 8.164 CV 1
ASSI { 835}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 28 and name HN ))
3.900 1.900 1.900 peak 835 spectrum 1 weight 0.10000E+01 volume 0.68614E-03 ppm1 0.646 ppm2 8.477 CV 1
ASSI { 836}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 73 and name HN ))
3.800 1.800 1.800 peak 836 spectrum 1 weight 0.10000E+01 volume 0.76651E-03 ppm1 0.646 ppm2 8.658 CV 1
ASSI { 837}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 70 and name HN ))
2.800 1.000 1.000 peak 837 spectrum 1 weight 0.10000E+01 volume 0.12480E-02 ppm1 0.646 ppm2 9.423 CV 1
ASSI { 843}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 32 and name HZ ))
3.000 1.100 1.100 peak 843 spectrum 1 weight 0.10000E+01 volume 0.20461E-02 ppm1 3.410 ppm2 6.868 CV 1
ASSI { 844}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 45 and name HN ))
3.600 1.600 1.600 peak 844 spectrum 1 weight 0.10000E+01 volume 0.19556E-02 ppm1 3.415 ppm2 6.986 CV 1
ASSI { 849}
( segid " " and resid 69 and name HG1%)
( segid " " and resid 26 and name HG1%)
2.400 0.700 0.700 peak 849 spectrum 1 weight 0.10000E+01 volume 0.45100E-02 ppm1 0.436 ppm2 0.736 CV 1
ASSI { 860}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 70 and name HA2 ))
2.800 1.000 1.000 peak 860 spectrum 1 weight 0.10000E+01 volume 0.14761E-02 ppm1 1.102 ppm2 3.803 CV 1
ASSI { 861}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 76 and name HB ))
3.100 1.200 1.200 peak 861 spectrum 1 weight 0.10000E+01 volume 0.40421E-02 ppm1 1.103 ppm2 1.783 CV 1
ASSI { 862}
( segid " " and resid 23 and name HG1%)
(( segid " " and resid 23 and name HN ))
2.700 0.900 0.900 peak 862 spectrum 1 weight 0.10000E+01 volume 0.56036E-02 ppm1 0.992 ppm2 8.521 CV 1
ASSI { 866}
( segid " " and resid 48 and name HG1%)
(( segid " " and resid 49 and name HA ))
3.100 1.200 1.200 peak 866 spectrum 1 weight 0.10000E+01 volume 0.21381E-02 ppm1 0.992 ppm2 4.253 CV 1
ASSI { 868}
( segid " " and resid 23 and name HG1%)
(( segid " " and resid 24 and name HN ))
3.200 1.300 1.300 peak 868 spectrum 1 weight 0.10000E+01 volume 0.30771E-02 ppm1 0.993 ppm2 9.248 CV 1
OR { 868}
( segid " " and resid 23 and name HG2%)
(( segid " " and resid 24 and name HN ))
ASSI { 871}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 17 and name HB2 ))
2.400 2.400 3.600 peak 871 spectrum 1 weight 0.10000E+01 volume 0.23750E-02 ppm1 0.769 ppm2 2.142 CV 1
ASSI { 872}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name HB ))
2.700 0.900 0.900 peak 872 spectrum 1 weight 0.10000E+01 volume 0.60710E-02 ppm1 0.769 ppm2 1.629 CV 1
ASSI { 874}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name HG12))
2.400 0.700 0.700 peak 874 spectrum 1 weight 0.10000E+01 volume 0.38627E-02 ppm1 0.769 ppm2 1.302 CV 1
ASSI { 875}
( segid " " and resid 18 and name HD1%)
( segid " " and resid 19 and name HB% )
3.600 1.600 1.600 peak 875 spectrum 1 weight 0.10000E+01 volume 0.35446E-02 ppm1 0.767 ppm2 1.514 CV 1
ASSI { 878}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 48 and name HB ))
2.200 0.600 0.600 peak 878 spectrum 1 weight 0.10000E+01 volume 0.88772E-02 ppm1 1.104 ppm2 2.052 CV 1
ASSI { 879}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 44 and name HA ))
2.500 0.800 0.800 peak 879 spectrum 1 weight 0.10000E+01 volume 0.52061E-02 ppm1 1.114 ppm2 3.589 CV 1
ASSI { 882}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 80 and name HE21))
3.500 1.500 1.500 peak 882 spectrum 1 weight 0.10000E+01 volume 0.13416E-02 ppm1 0.815 ppm2 7.647 CV 1
ASSI { 883}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 80 and name HE22))
3.400 1.400 1.400 peak 883 spectrum 1 weight 0.10000E+01 volume 0.15050E-02 ppm1 0.812 ppm2 7.757 CV 1
ASSI { 884}
( segid " " and resid 77 and name HD2%)
(( segid " " and resid 4 and name HN ))
2.800 1.000 1.000 peak 884 spectrum 1 weight 0.10000E+01 volume 0.18799E-02 ppm1 0.815 ppm2 9.241 CV 1
OR { 884}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 4 and name HN ))
ASSI { 887}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 70 and name HN ))
3.000 1.100 1.100 peak 887 spectrum 1 weight 0.10000E+01 volume 0.22530E-02 ppm1 3.792 ppm2 9.422 CV 1
ASSI { 888}
(( segid " " and resid 70 and name HA1 ))
(( segid " " and resid 70 and name HN ))
2.400 0.700 0.700 peak 888 spectrum 1 weight 0.10000E+01 volume 0.29074E-02 ppm1 4.001 ppm2 9.422 CV 1
ASSI { 889}
(( segid " " and resid 70 and name HA2 ))
(( segid " " and resid 71 and name HN ))
3.600 1.600 1.600 peak 889 spectrum 1 weight 0.10000E+01 volume 0.84823E-03 ppm1 3.789 ppm2 8.354 CV 1
ASSI { 898}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HG2 ))
2.900 1.000 1.000 peak 898 spectrum 1 weight 0.10000E+01 volume 0.16286E-02 ppm1 2.031 ppm2 1.436 CV 1
OR { 898}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 67 and name HG2 ))
ASSI { 902}
(( segid " " and resid 67 and name HG1 ))
(( segid " " and resid 67 and name HA ))
3.900 1.900 1.900 peak 902 spectrum 1 weight 0.10000E+01 volume 0.84098E-03 ppm1 1.570 ppm2 4.474 CV 1
ASSI { 903}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 67 and name HE2 ))
3.200 1.300 1.300 peak 903 spectrum 1 weight 0.10000E+01 volume 0.11599E-02 ppm1 1.440 ppm2 3.059 CV 1
OR { 903}
(( segid " " and resid 67 and name HG2 ))
(( segid " " and resid 67 and name HE1 ))
ASSI { 907}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB1 ))
2.300 0.600 0.600 peak 907 spectrum 1 weight 0.10000E+01 volume 0.51810E-02 ppm1 4.399 ppm2 2.383 CV 1
ASSI { 908}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 61 and name HN ))
3.100 1.200 1.200 peak 908 spectrum 1 weight 0.10000E+01 volume 0.49230E-02 ppm1 4.399 ppm2 8.650 CV 1
ASSI { 909}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB2 ))
2.900 1.000 1.000 peak 909 spectrum 1 weight 0.10000E+01 volume 0.34164E-02 ppm1 4.399 ppm2 1.937 CV 1
ASSI { 910}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HD1 ))
3.400 1.500 1.500 peak 910 spectrum 1 weight 0.10000E+01 volume 0.15161E-02 ppm1 1.924 ppm2 3.816 CV 1
OR { 910}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HD2 ))
ASSI { 911}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 59 and name HD1 ))
2.400 0.700 0.700 peak 911 spectrum 1 weight 0.10000E+01 volume 0.41141E-02 ppm1 1.981 ppm2 3.813 CV 1
OR { 911}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 59 and name HD2 ))
ASSI { 912}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HD2 ))
2.500 0.800 0.800 peak 912 spectrum 1 weight 0.10000E+01 volume 0.33873E-02 ppm1 1.927 ppm2 3.814 CV 1
OR { 912}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HD1 ))
ASSI { 913}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 61 and name HN ))
2.900 1.000 1.000 peak 913 spectrum 1 weight 0.10000E+01 volume 0.10185E-02 ppm1 1.934 ppm2 8.667 CV 1
ASSI { 914}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 61 and name HN ))
4.000 2.000 2.000 peak 914 spectrum 1 weight 0.10000E+01 volume 0.97982E-03 ppm1 2.381 ppm2 8.665 CV 1
ASSI { 915}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 58 and name HA ))
2.100 0.500 0.500 peak 915 spectrum 1 weight 0.10000E+01 volume 0.66243E-02 ppm1 3.809 ppm2 4.505 CV 1
OR { 915}
(( segid " " and resid 59 and name HD1 ))
(( segid " " and resid 58 and name HA ))
ASSI { 916}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HB1 ))
3.300 1.300 1.300 peak 916 spectrum 1 weight 0.10000E+01 volume 0.27485E-02 ppm1 3.809 ppm2 2.403 CV 1
OR { 916}
(( segid " " and resid 59 and name HD1 ))
(( segid " " and resid 59 and name HB1 ))
ASSI { 921}
(( segid " " and resid 59 and name HD1 ))
(( segid " " and resid 58 and name HG12))
4.500 2.500 1.500 peak 921 spectrum 1 weight 0.10000E+01 volume 0.53443E-03 ppm1 3.812 ppm2 0.865 CV 1
OR { 921}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 58 and name HG12))
ASSI { 923}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HN ))
2.900 1.100 1.100 peak 923 spectrum 1 weight 0.10000E+01 volume 0.20017E-02 ppm1 4.199 ppm2 8.658 CV 1
ASSI { 924}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HN ))
2.700 0.900 0.900 peak 924 spectrum 1 weight 0.10000E+01 volume 0.32865E-02 ppm1 2.605 ppm2 8.661 CV 1
OR { 924}
(( segid " " and resid 60 and name HB1 ))
(( segid " " and resid 60 and name HN ))
ASSI { 925}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 63 and name HN ))
3.400 1.500 1.500 peak 925 spectrum 1 weight 0.10000E+01 volume 0.88973E-03 ppm1 4.200 ppm2 7.613 CV 1
ASSI { 926}
(( segid " " and resid 60 and name HB1 ))
(( segid " " and resid 60 and name HA ))
2.700 0.900 0.900 peak 926 spectrum 1 weight 0.10000E+01 volume 0.34621E-02 ppm1 2.601 ppm2 4.195 CV 1
OR { 926}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HA ))
ASSI { 928}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HN ))
3.000 1.100 1.100 peak 928 spectrum 1 weight 0.10000E+01 volume 0.19798E-02 ppm1 4.617 ppm2 7.713 CV 1
ASSI { 934}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB1 ))
2.800 1.000 1.000 peak 934 spectrum 1 weight 0.10000E+01 volume 0.28412E-02 ppm1 4.602 ppm2 2.768 CV 1
ASSI { 937}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB1 ))
2.900 1.100 1.100 peak 937 spectrum 1 weight 0.10000E+01 volume 0.22409E-02 ppm1 4.613 ppm2 3.573 CV 1
ASSI { 941}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HD2 ))
3.600 1.600 1.600 peak 941 spectrum 1 weight 0.10000E+01 volume 0.83202E-03 ppm1 4.614 ppm2 7.014 CV 1
ASSI { 942}
(( segid " " and resid 79 and name HB1 ))
(( segid " " and resid 79 and name HB2 ))
2.000 0.500 0.500 peak 942 spectrum 1 weight 0.10000E+01 volume 0.53682E-02 ppm1 3.570 ppm2 2.497 CV 1
ASSI { 943}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HN ))
2.900 1.000 1.000 peak 943 spectrum 1 weight 0.10000E+01 volume 0.22740E-02 ppm1 4.168 ppm2 8.311 CV 1
ASSI { 944}
( segid " " and resid 81 and name HB% )
(( segid " " and resid 81 and name HN ))
2.600 0.800 0.800 peak 944 spectrum 1 weight 0.10000E+01 volume 0.49456E-02 ppm1 1.421 ppm2 8.312 CV 1
ASSI { 945}
( segid " " and resid 81 and name HB% )
(( segid " " and resid 55 and name HB1 ))
2.800 2.800 3.200 peak 945 spectrum 1 weight 0.10000E+01 volume 0.78243E-03 ppm1 1.430 ppm2 3.253 CV 1
ASSI { 948}
( segid " " and resid 81 and name HB% )
(( segid " " and resid 81 and name HA ))
2.600 0.800 0.800 peak 948 spectrum 1 weight 0.10000E+01 volume 0.47802E-02 ppm1 1.426 ppm2 4.172 CV 1
ASSI { 949}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 81 and name HN ))
2.200 0.600 0.600 peak 949 spectrum 1 weight 0.10000E+01 volume 0.84333E-02 ppm1 4.401 ppm2 8.310 CV 1
ASSI { 950}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HN ))
2.700 0.900 0.900 peak 950 spectrum 1 weight 0.10000E+01 volume 0.24892E-02 ppm1 4.406 ppm2 7.886 CV 1
ASSI { 951}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HA ))
3.100 1.200 1.200 peak 951 spectrum 1 weight 0.10000E+01 volume 0.17770E-02 ppm1 2.135 ppm2 4.414 CV 1
ASSI { 954}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HB1 ))
2.500 0.800 0.800 peak 954 spectrum 1 weight 0.10000E+01 volume 0.35347E-02 ppm1 4.406 ppm2 2.328 CV 1
ASSI { 955}
(( segid " " and resid 80 and name HA ))
( segid " " and resid 56 and name HG2%)
2.600 0.800 0.800 peak 955 spectrum 1 weight 0.10000E+01 volume 0.33153E-02 ppm1 4.405 ppm2 0.948 CV 1
OR { 955}
(( segid " " and resid 80 and name HA ))
( segid " " and resid 56 and name HG1%)
ASSI { 958}
(( segid " " and resid 80 and name HG1 ))
(( segid " " and resid 77 and name HA ))
3.100 1.200 1.200 peak 958 spectrum 1 weight 0.10000E+01 volume 0.66289E-03 ppm1 2.704 ppm2 3.893 CV 1
ASSI { 959}
(( segid " " and resid 80 and name HG2 ))
(( segid " " and resid 77 and name HA ))
3.900 1.900 1.900 peak 959 spectrum 1 weight 0.10000E+01 volume 0.62323E-03 ppm1 2.580 ppm2 3.893 CV 1
ASSI { 960}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HN ))
3.100 1.200 1.200 peak 960 spectrum 1 weight 0.10000E+01 volume 0.11878E-02 ppm1 5.011 ppm2 7.698 CV 1
ASSI { 961}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB2 ))
2.800 1.000 1.000 peak 961 spectrum 1 weight 0.10000E+01 volume 0.30441E-02 ppm1 5.012 ppm2 2.717 CV 1
ASSI { 963}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB1 ))
2.900 1.000 1.000 peak 963 spectrum 1 weight 0.10000E+01 volume 0.18378E-02 ppm1 5.017 ppm2 3.027 CV 1
ASSI { 965}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 36 and name HG ))
3.100 1.200 1.200 peak 965 spectrum 1 weight 0.10000E+01 volume 0.15581E-02 ppm1 2.714 ppm2 1.452 CV 1
ASSI { 966}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 30 and name HB2 ))
4.000 2.000 2.000 peak 966 spectrum 1 weight 0.10000E+01 volume 0.97899E-03 ppm1 2.712 ppm2 1.375 CV 1
ASSI { 967}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 36 and name HN ))
3.100 1.200 1.200 peak 967 spectrum 1 weight 0.10000E+01 volume 0.96952E-03 ppm1 2.713 ppm2 7.480 CV 1
ASSI { 969}
(( segid " " and resid 35 and name HB1 ))
(( segid " " and resid 35 and name HN ))
3.500 1.600 1.600 peak 969 spectrum 1 weight 0.10000E+01 volume 0.12719E-02 ppm1 3.031 ppm2 7.698 CV 1
ASSI { 970}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 31 and name HN ))
2.600 0.900 0.900 peak 970 spectrum 1 weight 0.10000E+01 volume 0.12054E-02 ppm1 2.706 ppm2 10.176 CV 1
ASSI { 971}
(( segid " " and resid 35 and name HB1 ))
(( segid " " and resid 31 and name HN ))
3.300 1.400 1.400 peak 971 spectrum 1 weight 0.10000E+01 volume 0.18949E-02 ppm1 3.036 ppm2 10.174 CV 1
ASSI { 972}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HN ))
2.300 0.700 0.700 peak 972 spectrum 1 weight 0.10000E+01 volume 0.63965E-02 ppm1 4.397 ppm2 7.341 CV 1
ASSI { 973}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HN ))
2.900 1.000 1.000 peak 973 spectrum 1 weight 0.10000E+01 volume 0.25017E-02 ppm1 4.403 ppm2 8.028 CV 1
ASSI { 974}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HA ))
3.100 1.200 1.200 peak 974 spectrum 1 weight 0.10000E+01 volume 0.16683E-02 ppm1 2.439 ppm2 4.406 CV 1
ASSI { 975}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 37 and name HA ))
3.100 1.200 1.200 peak 975 spectrum 1 weight 0.10000E+01 volume 0.17281E-02 ppm1 3.073 ppm2 4.407 CV 1
ASSI { 976}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HN ))
2.400 0.700 0.700 peak 976 spectrum 1 weight 0.10000E+01 volume 0.55136E-02 ppm1 4.387 ppm2 10.172 CV 1
ASSI { 977}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HN ))
2.700 0.900 0.900 peak 977 spectrum 1 weight 0.10000E+01 volume 0.23449E-02 ppm1 4.380 ppm2 7.492 CV 1
ASSI { 979}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 51 and name HG2 ))
3.400 1.400 1.400 peak 979 spectrum 1 weight 0.10000E+01 volume 0.14328E-02 ppm1 4.705 ppm2 2.293 CV 1
ASSI { 980}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 58 and name HN ))
2.200 0.600 0.600 peak 980 spectrum 1 weight 0.10000E+01 volume 0.56652E-02 ppm1 4.704 ppm2 9.871 CV 1
ASSI { 982}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HG2 ))
3.200 1.300 1.300 peak 982 spectrum 1 weight 0.10000E+01 volume 0.12879E-02 ppm1 4.697 ppm2 1.348 CV 1
OR { 982}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HG1 ))
ASSI { 983}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HN ))
2.900 1.000 1.000 peak 983 spectrum 1 weight 0.10000E+01 volume 0.20483E-02 ppm1 4.584 ppm2 7.731 CV 1
ASSI { 984}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
2.600 0.900 0.900 peak 984 spectrum 1 weight 0.10000E+01 volume 0.31864E-02 ppm1 4.589 ppm2 2.588 CV 1
ASSI { 985}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB1 ))
3.100 1.200 1.200 peak 985 spectrum 1 weight 0.10000E+01 volume 0.20252E-02 ppm1 4.592 ppm2 2.694 CV 1
ASSI { 986}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 27 and name HE1 ))
3.500 1.600 1.600 peak 986 spectrum 1 weight 0.10000E+01 volume 0.86523E-03 ppm1 4.586 ppm2 3.042 CV 1
OR { 986}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 27 and name HE2 ))
ASSI { 987}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 26 and name HN ))
3.300 1.300 1.300 peak 987 spectrum 1 weight 0.10000E+01 volume 0.14050E-02 ppm1 4.598 ppm2 7.485 CV 1
ASSI { 988}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HN ))
2.600 0.800 0.800 peak 988 spectrum 1 weight 0.10000E+01 volume 0.23209E-02 ppm1 2.584 ppm2 7.734 CV 1
ASSI { 989}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 23 and name HG2%)
2.500 2.500 3.500 peak 989 spectrum 1 weight 0.10000E+01 volume 0.15801E-02 ppm1 2.583 ppm2 0.997 CV 1
ASSI { 990}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HN ))
2.500 0.800 0.800 peak 990 spectrum 1 weight 0.10000E+01 volume 0.41824E-02 ppm1 4.625 ppm2 8.467 CV 1
ASSI { 993}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HN ))
2.800 1.000 1.000 peak 993 spectrum 1 weight 0.10000E+01 volume 0.15071E-02 ppm1 4.625 ppm2 6.360 CV 1
ASSI { 994}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB1 ))
2.500 0.800 0.800 peak 994 spectrum 1 weight 0.10000E+01 volume 0.24090E-02 ppm1 4.630 ppm2 2.056 CV 1
ASSI { 996}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HD1 ))
3.600 1.600 1.600 peak 996 spectrum 1 weight 0.10000E+01 volume 0.13197E-02 ppm1 4.629 ppm2 1.745 CV 1
ASSI { 997}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB2 ))
3.200 1.300 1.300 peak 997 spectrum 1 weight 0.10000E+01 volume 0.16068E-02 ppm1 4.625 ppm2 1.534 CV 1
ASSI { 998}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HG2 ))
2.700 0.900 0.900 peak 998 spectrum 1 weight 0.10000E+01 volume 0.31297E-02 ppm1 4.628 ppm2 1.327 CV 1
OR { 998}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HG1 ))
ASSI { 999}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 28 and name HD2%)
3.500 1.500 1.500 peak 999 spectrum 1 weight 0.10000E+01 volume 0.85807E-03 ppm1 4.625 ppm2 0.892 CV 1
ASSI { 1000}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HN ))
2.600 0.800 0.800 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.45440E-02 ppm1 4.663 ppm2 8.988 CV 1
ASSI { 1001}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HN ))
2.900 1.100 1.100 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.20644E-02 ppm1 4.665 ppm2 8.257 CV 1
ASSI { 1002}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 41 and name HN ))
3.900 1.900 1.900 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.66704E-03 ppm1 4.659 ppm2 8.140 CV 1
ASSI { 1003}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB1 ))
2.500 0.800 0.800 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.51039E-02 ppm1 4.664 ppm2 3.082 CV 1
ASSI { 1004}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB2 ))
2.700 0.900 0.900 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.47153E-02 ppm1 4.664 ppm2 2.753 CV 1
ASSI { 1005}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 40 and name HN ))
3.300 1.400 1.400 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.13953E-02 ppm1 2.746 ppm2 8.984 CV 1
ASSI { 1008}
(( segid " " and resid 39 and name HB1 ))
(( segid " " and resid 38 and name HA ))
4.100 2.100 1.900 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.19356E-02 ppm1 3.085 ppm2 3.948 CV 1
ASSI { 1010}
(( segid " " and resid 39 and name HB1 ))
( segid " " and resid 38 and name HG1%)
3.600 1.600 1.600 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.15319E-02 ppm1 3.096 ppm2 0.963 CV 1
ASSI { 1011}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB2 ))
2.600 0.900 0.900 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.56271E-02 ppm1 4.478 ppm2 2.585 CV 1
ASSI { 1012}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HN ))
2.700 0.900 0.900 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.29289E-02 ppm1 4.479 ppm2 8.383 CV 1
ASSI { 1015}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB1 ))
2.500 0.800 0.800 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.51890E-02 ppm1 4.476 ppm2 2.774 CV 1
ASSI { 1017}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HN ))
3.200 1.300 1.300 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.17046E-02 ppm1 2.769 ppm2 8.398 CV 1
ASSI { 1020}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB2 ))
3.000 1.200 1.200 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.19968E-02 ppm1 4.452 ppm2 0.917 CV 1
ASSI { 1021}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 18 and name HN ))
2.500 0.800 0.800 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.23274E-02 ppm1 1.612 ppm2 8.213 CV 1
ASSI { 1027}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 15 and name HA ))
2.800 1.000 1.000 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.90720E-03 ppm1 1.604 ppm2 3.584 CV 1
ASSI { 1037}
(( segid " " and resid 32 and name HB2 ))
( segid " " and resid 43 and name HE% )
3.800 1.800 1.800 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.76530E-03 ppm1 3.133 ppm2 1.550 CV 1
OR { 1037}
(( segid " " and resid 32 and name HB1 ))
( segid " " and resid 43 and name HE% )
ASSI { 1040}
(( segid " " and resid 75 and name HB1 ))
(( segid " " and resid 76 and name HG12))
3.600 1.600 1.600 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.12665E-02 ppm1 3.132 ppm2 0.928 CV 1
ASSI { 1041}
(( segid " " and resid 75 and name HB1 ))
( segid " " and resid 76 and name HD1%)
3.700 1.700 1.700 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.14233E-02 ppm1 3.148 ppm2 0.593 CV 1
ASSI { 1043}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 58 and name HN ))
4.000 2.000 2.000 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.91369E-03 ppm1 1.681 ppm2 9.870 CV 1
OR { 1043}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 58 and name HN ))
ASSI { 1044}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 57 and name HA ))
2.800 1.000 1.000 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.21232E-02 ppm1 1.674 ppm2 4.700 CV 1
OR { 1044}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HA ))
ASSI { 1045}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 57 and name HG2 ))
2.600 0.800 0.800 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.35766E-02 ppm1 1.677 ppm2 1.355 CV 1
OR { 1045}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HG1 ))
OR { 1045}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HG2 ))
OR { 1045}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 57 and name HG1 ))
ASSI { 1051}
(( segid " " and resid 21 and name HG11))
(( segid " " and resid 21 and name HA ))
3.700 1.800 1.800 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.76366E-03 ppm1 1.307 ppm2 4.327 CV 1
OR { 1051}
(( segid " " and resid 21 and name HG12))
(( segid " " and resid 21 and name HA ))
ASSI { 1052}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 19 and name HA ))
2.400 0.700 0.700 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.59244E-02 ppm1 1.533 ppm2 4.809 CV 1
ASSI { 1053}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 19 and name HN ))
2.600 0.800 0.800 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.33612E-02 ppm1 1.536 ppm2 8.474 CV 1
ASSI { 1055}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 21 and name HN ))
3.500 1.600 1.600 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.90624E-03 ppm1 1.533 ppm2 6.473 CV 1
ASSI { 1059}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 36 and name HN ))
3.400 1.500 1.500 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.14564E-02 ppm1 0.762 ppm2 7.474 CV 1
ASSI { 1060}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 37 and name HN ))
4.300 2.300 1.700 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.73238E-03 ppm1 0.764 ppm2 7.339 CV 1
ASSI { 1061}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 27 and name HN ))
2.700 2.700 3.300 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.10149E-02 ppm1 0.761 ppm2 6.375 CV 1
ASSI { 1062}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 26 and name HA ))
2.700 0.900 0.900 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.19469E-02 ppm1 0.759 ppm2 3.537 CV 1
ASSI { 1064}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 35 and name HB2 ))
3.700 1.700 1.700 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.10318E-02 ppm1 0.764 ppm2 2.709 CV 1
ASSI { 1065}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 25 and name HB2 ))
2.800 2.800 3.200 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.92969E-03 ppm1 0.761 ppm2 2.583 CV 1
ASSI { 1066}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 36 and name HB1 ))
2.700 0.900 0.900 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.20070E-02 ppm1 0.759 ppm2 2.269 CV 1
ASSI { 1067}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 30 and name HB1 ))
3.000 1.100 1.100 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.11597E-02 ppm1 0.763 ppm2 2.053 CV 1
ASSI { 1068}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 30 and name HG1 ))
2.900 1.100 1.100 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.13252E-02 ppm1 0.762 ppm2 1.808 CV 1
ASSI { 1069}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 36 and name HB2 ))
3.200 1.300 1.300 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.34649E-02 ppm1 0.761 ppm2 1.595 CV 1
ASSI { 1070}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 36 and name HG ))
2.300 0.700 0.700 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.43898E-02 ppm1 0.761 ppm2 1.458 CV 1
ASSI { 1073}
( segid " " and resid 36 and name HD2%)
( segid " " and resid 26 and name HG2%)
2.000 0.500 0.500 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.13672E-01 ppm1 0.764 ppm2 0.883 CV 1
ASSI { 1074}
( segid " " and resid 36 and name HD2%)
( segid " " and resid 36 and name HD1%)
2.300 0.700 0.700 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.60915E-02 ppm1 0.761 ppm2 0.596 CV 1
ASSI { 1075}
( segid " " and resid 36 and name HD2%)
( segid " " and resid 69 and name HG1%)
2.700 2.700 3.300 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.98623E-03 ppm1 0.759 ppm2 0.437 CV 1
ASSI { 1077}
( segid " " and resid 28 and name HD1%)
(( segid " " and resid 70 and name HA2 ))
2.600 0.800 0.800 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.33193E-02 ppm1 0.799 ppm2 3.792 CV 1
ASSI { 1078}
( segid " " and resid 28 and name HD1%)
(( segid " " and resid 28 and name HG ))
2.200 0.600 0.600 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.75893E-02 ppm1 0.801 ppm2 1.755 CV 1
ASSI { 1079}
( segid " " and resid 28 and name HD1%)
(( segid " " and resid 28 and name HB2 ))
3.100 1.200 1.200 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.34823E-02 ppm1 0.802 ppm2 1.452 CV 1
ASSI { 1080}
( segid " " and resid 28 and name HD1%)
( segid " " and resid 8 and name HG2%)
2.400 0.700 0.700 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.56371E-02 ppm1 0.802 ppm2 1.039 CV 1
ASSI { 1081}
( segid " " and resid 28 and name HD1%)
( segid " " and resid 69 and name HG2%)
3.000 1.100 1.100 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.28271E-02 ppm1 0.801 ppm2 0.673 CV 1
ASSI { 1082}
( segid " " and resid 28 and name HD1%)
(( segid " " and resid 28 and name HA ))
2.500 0.800 0.800 peak 1082 spectrum 1 weight 0.10000E+01 volume 0.39935E-02 ppm1 0.798 ppm2 3.578 CV 1
ASSI { 1083}
( segid " " and resid 28 and name HD1%)
(( segid " " and resid 70 and name HA1 ))
3.100 1.200 1.200 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.26233E-02 ppm1 0.802 ppm2 4.005 CV 1
ASSI { 1084}
( segid " " and resid 28 and name HD1%)
(( segid " " and resid 73 and name HB ))
3.500 1.600 1.600 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.13718E-02 ppm1 0.805 ppm2 4.162 CV 1
ASSI { 1085}
( segid " " and resid 28 and name HD1%)
(( segid " " and resid 4 and name HE21))
3.300 1.300 1.300 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.94695E-03 ppm1 0.800 ppm2 6.831 CV 1
ASSI { 1086}
( segid " " and resid 28 and name HD1%)
( segid " " and resid 73 and name HG2%)
2.600 0.900 0.900 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.31207E-02 ppm1 0.803 ppm2 1.120 CV 1
ASSI { 1090}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HB1 ))
2.500 0.800 0.800 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.26211E-02 ppm1 0.582 ppm2 2.277 CV 1
ASSI { 1092}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 21 and name HG12))
2.700 0.900 0.900 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.11383E-02 ppm1 0.584 ppm2 1.311 CV 1
OR { 1092}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 21 and name HG11))
ASSI { 1093}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 26 and name HA ))
3.900 1.900 1.900 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.63613E-03 ppm1 0.582 ppm2 3.547 CV 1
ASSI { 1095}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 47 and name HB ))
2.200 0.600 0.600 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.67211E-02 ppm1 0.912 ppm2 2.212 CV 1
ASSI { 1096}
( segid " " and resid 47 and name HG2%)
( segid " " and resid 40 and name H8% )
2.800 1.000 1.000 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.31380E-02 ppm1 0.914 ppm2 0.661 CV 1
OR { 1096}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 40 and name H5B ))
OR { 1096}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 40 and name H6A ))
OR { 1096}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 40 and name H5A ))
OR { 1096}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 40 and name H6B ))
ASSI { 1098}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 12 and name HB% )
2.700 0.900 0.900 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.35163E-02 ppm1 4.214 ppm2 1.669 CV 1
ASSI { 1099}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 12 and name HN ))
3.100 1.200 1.200 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.11980E-02 ppm1 4.211 ppm2 8.917 CV 1
ASSI { 1100}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HN ))
2.900 1.100 1.100 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.17060E-02 ppm1 4.651 ppm2 7.483 CV 1
ASSI { 1101}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB1 ))
2.600 0.900 0.900 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.37136E-02 ppm1 4.654 ppm2 2.416 CV 1
OR { 1101}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 1104}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 63 and name HN ))
3.300 1.400 1.400 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.10564E-02 ppm1 4.656 ppm2 7.620 CV 1
ASSI { 1107}
(( segid " " and resid 62 and name HB2 ))
( segid " " and resid 58 and name HG2%)
3.100 1.200 1.200 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.15048E-02 ppm1 2.414 ppm2 0.342 CV 1
OR { 1107}
(( segid " " and resid 62 and name HB1 ))
( segid " " and resid 58 and name HG2%)
ASSI { 1108}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 59 and name HG1 ))
3.600 1.600 1.600 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.83621E-03 ppm1 2.407 ppm2 1.958 CV 1
OR { 1108}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 59 and name HB2 ))
OR { 1108}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 59 and name HG1 ))
OR { 1108}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 59 and name HG2 ))
OR { 1108}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 59 and name HB2 ))
OR { 1108}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 1111}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 59 and name HD1 ))
2.900 1.000 1.000 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.18321E-02 ppm1 2.417 ppm2 3.830 CV 1
OR { 1111}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 59 and name HD1 ))
OR { 1111}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 59 and name HD2 ))
OR { 1111}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 59 and name HD2 ))
ASSI { 1112}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 71 and name HB1 ))
2.800 2.800 3.200 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.20028E-02 ppm1 4.102 ppm2 3.115 CV 1
ASSI { 1114}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 78 and name HN ))
2.900 1.100 1.100 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.17063E-02 ppm1 2.524 ppm2 8.269 CV 1
ASSI { 1115}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HB2 ))
2.600 0.900 0.900 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.29557E-02 ppm1 4.368 ppm2 2.207 CV 1
ASSI { 1117}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HN ))
2.500 0.800 0.800 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.27016E-02 ppm1 3.891 ppm2 8.504 CV 1
ASSI { 1118}
(( segid " " and resid 77 and name HB1 ))
(( segid " " and resid 77 and name HN ))
2.600 0.800 0.800 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.17787E-02 ppm1 1.764 ppm2 8.501 CV 1
ASSI { 1120}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 77 and name HN ))
3.100 1.200 1.200 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.20990E-02 ppm1 1.638 ppm2 8.504 CV 1
ASSI { 1121}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 52 and name HN ))
3.800 1.800 1.800 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.20572E-02 ppm1 3.889 ppm2 7.754 CV 1
ASSI { 1123}
(( segid " " and resid 77 and name HB1 ))
(( segid " " and resid 78 and name HN ))
3.600 1.700 1.700 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.76961E-03 ppm1 1.753 ppm2 8.267 CV 1
ASSI { 1124}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 78 and name HN ))
3.600 1.600 1.600 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.84106E-03 ppm1 1.647 ppm2 8.273 CV 1
ASSI { 1127}
(( segid " " and resid 77 and name HB1 ))
( segid " " and resid 77 and name HD2%)
2.800 1.000 1.000 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.27539E-02 ppm1 1.769 ppm2 0.810 CV 1
OR { 1127}
(( segid " " and resid 77 and name HB1 ))
( segid " " and resid 77 and name HD1%)
ASSI { 1128}
(( segid " " and resid 77 and name HB2 ))
( segid " " and resid 77 and name HD1%)
2.800 1.000 1.000 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.24518E-02 ppm1 1.636 ppm2 0.813 CV 1
OR { 1128}
(( segid " " and resid 77 and name HB2 ))
( segid " " and resid 77 and name HD2%)
ASSI { 1130}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HG2 ))
3.300 1.400 1.400 peak 1130 spectrum 1 weight 0.10000E+01 volume 0.12705E-02 ppm1 3.892 ppm2 0.671 CV 1
ASSI { 1131}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 76 and name HG2%)
2.600 0.800 0.800 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.28500E-02 ppm1 3.889 ppm2 0.525 CV 1
ASSI { 1132}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HB1 ))
2.600 0.800 0.800 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.23827E-02 ppm1 3.883 ppm2 1.769 CV 1
ASSI { 1133}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HB2 ))
2.200 0.600 0.600 peak 1133 spectrum 1 weight 0.10000E+01 volume 0.62004E-02 ppm1 3.893 ppm2 1.627 CV 1
ASSI { 1136}
( segid " " and resid 77 and name HD2%)
(( segid " " and resid 4 and name HA ))
2.800 1.000 1.000 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.24111E-02 ppm1 0.814 ppm2 3.697 CV 1
OR { 1136}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 4 and name HA ))
ASSI { 1141}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HN ))
2.800 1.000 1.000 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.17312E-02 ppm1 4.513 ppm2 8.629 CV 1
ASSI { 1142}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HN ))
2.200 0.600 0.600 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.73765E-02 ppm1 4.293 ppm2 8.521 CV 1
ASSI { 1143}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 16 and name HD22))
3.000 1.100 1.100 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.18608E-02 ppm1 4.292 ppm2 8.065 CV 1
ASSI { 1149}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name HA ))
2.900 1.000 1.000 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.13833E-02 ppm1 3.086 ppm2 4.213 CV 1
ASSI { 1152}
(( segid " " and resid 75 and name HB1 ))
(( segid " " and resid 76 and name HN ))
3.100 1.200 1.200 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.72337E-03 ppm1 3.147 ppm2 8.513 CV 1
ASSI { 1154}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 76 and name HN ))
3.800 1.800 1.800 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.14129E-02 ppm1 3.093 ppm2 8.513 CV 1
ASSI { 1155}
(( segid " " and resid 75 and name HB2 ))
( segid " " and resid 75 and name HD% )
2.900 1.100 1.100 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.15792E-02 ppm1 3.084 ppm2 6.813 CV 1
ASSI { 1157}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 78 and name HB1 ))
3.300 1.400 1.400 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.74540E-03 ppm1 4.209 ppm2 2.528 CV 1
ASSI { 1158}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HB1 ))
1.900 0.500 0.500 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.52409E-02 ppm1 2.734 ppm2 3.433 CV 1
ASSI { 1160}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 27 and name HA ))
4.200 2.300 1.800 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.32059E-03 ppm1 1.035 ppm2 4.643 CV 1
ASSI { 1161}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 70 and name HA2 ))
3.900 1.900 1.900 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.56283E-03 ppm1 1.032 ppm2 3.809 CV 1
ASSI { 1162}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 69 and name HG1%)
4.400 2.400 1.600 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.42503E-03 ppm1 1.036 ppm2 0.424 CV 1
ASSI { 1168}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 69 and name HN ))
6.000 5.400 0.000 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.76802E-04 ppm1 1.035 ppm2 8.158 CV 1
ASSI { 1170}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 73 and name HN ))
4.500 2.600 1.500 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.64568E-03 ppm1 1.030 ppm2 8.611 CV 1
ASSI { 1171}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 11 and name HN ))
4.500 2.600 1.500 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.61950E-03 ppm1 1.036 ppm2 9.262 CV 1
ASSI { 1172}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 12 and name HN ))
4.400 2.400 1.600 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.75952E-03 ppm1 1.031 ppm2 8.916 CV 1
ASSI { 1175}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 41 and name HG ))
2.400 0.700 0.700 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.57942E-02 ppm1 0.898 ppm2 1.715 CV 1
ASSI { 1176}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 41 and name HA ))
2.600 0.800 0.800 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.50386E-02 ppm1 0.898 ppm2 4.305 CV 1
ASSI { 1180}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 40 and name H42A))
2.700 2.700 3.300 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.10065E-02 ppm1 1.120 ppm2 3.171 CV 1
ASSI { 1181}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 40 and name H37A))
3.800 1.800 1.800 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.12414E-02 ppm1 1.108 ppm2 3.422 CV 1
ASSI { 1189}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 51 and name HG2 ))
3.400 1.500 1.500 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.20325E-02 ppm1 1.501 ppm2 2.289 CV 1
ASSI { 1190}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 51 and name HG1 ))
3.600 1.600 1.600 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.75311E-03 ppm1 1.497 ppm2 2.848 CV 1
ASSI { 1193}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 52 and name HG1 ))
4.300 2.300 1.700 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.11189E-02 ppm1 1.487 ppm2 2.447 CV 1
ASSI { 1195}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 49 and name HN ))
3.900 1.900 1.900 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.12996E-02 ppm1 1.484 ppm2 7.915 CV 1
ASSI { 1196}
( segid " " and resid 50 and name HB% )
( segid " " and resid 54 and name HE% )
3.400 1.400 1.400 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.58788E-03 ppm1 1.482 ppm2 7.126 CV 1
ASSI { 1197}
(( segid " " and resid 1 and name HA ))
(( segid " " and resid 80 and name HE21))
4.900 3.000 1.100 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.40668E-03 ppm1 4.028 ppm2 7.661 CV 1
ASSI { 1200}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 25 and name HB1 ))
3.300 1.300 1.300 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.60082E-03 ppm1 3.690 ppm2 2.682 CV 1
ASSI { 1203}
(( segid " " and resid 22 and name HD2 ))
( segid " " and resid 21 and name HD1%)
4.400 2.400 1.600 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.46168E-03 ppm1 3.686 ppm2 0.858 CV 1
ASSI { 1205}
(( segid " " and resid 22 and name HD1 ))
(( segid " " and resid 21 and name HB ))
4.200 2.200 1.800 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.49955E-03 ppm1 4.040 ppm2 1.618 CV 1
ASSI { 1206}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 21 and name HB ))
3.700 1.700 1.700 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.20985E-03 ppm1 3.698 ppm2 1.596 CV 1
ASSI { 1208}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 22 and name HB2 ))
3.700 1.700 1.700 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.55203E-03 ppm1 3.679 ppm2 1.738 CV 1
ASSI { 1209}
(( segid " " and resid 22 and name HD1 ))
(( segid " " and resid 22 and name HB2 ))
4.200 2.200 1.800 peak 1209 spectrum 1 weight 0.10000E+01 volume 0.77024E-03 ppm1 4.031 ppm2 1.753 CV 1
ASSI { 1210}
(( segid " " and resid 22 and name HD1 ))
(( segid " " and resid 22 and name HG2 ))
2.900 1.100 1.100 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.20942E-02 ppm1 4.033 ppm2 1.934 CV 1
ASSI { 1211}
(( segid " " and resid 22 and name HD1 ))
(( segid " " and resid 22 and name HG1 ))
2.500 0.800 0.800 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.22319E-02 ppm1 4.031 ppm2 2.127 CV 1
ASSI { 1212}
(( segid " " and resid 22 and name HD1 ))
(( segid " " and resid 22 and name HB1 ))
3.900 1.900 1.900 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.99968E-03 ppm1 4.032 ppm2 2.353 CV 1
ASSI { 1214}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 22 and name HG1 ))
3.300 1.300 1.300 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.16619E-02 ppm1 3.682 ppm2 2.134 CV 1
ASSI { 1215}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 22 and name HG2 ))
2.600 0.800 0.800 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.15655E-02 ppm1 3.685 ppm2 1.936 CV 1
ASSI { 1216}
(( segid " " and resid 1 and name HA ))
( segid " " and resid 81 and name HB% )
4.600 2.600 1.400 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.27481E-03 ppm1 4.022 ppm2 1.386 CV 1
ASSI { 1218}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 4 and name HA ))
5.100 3.300 0.900 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.42344E-03 ppm1 1.351 ppm2 3.711 CV 1
ASSI { 1221}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 4 and name HB1 ))
4.000 2.000 2.000 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.75520E-03 ppm1 1.356 ppm2 2.196 CV 1
OR { 1221}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 4 and name HG1 ))
OR { 1221}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 4 and name HG2 ))
ASSI { 1223}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 7 and name HN ))
5.000 3.100 1.000 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.37249E-03 ppm1 1.361 ppm2 8.406 CV 1
ASSI { 1224}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 2 and name HN ))
4.400 2.400 1.600 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.48087E-03 ppm1 1.355 ppm2 8.794 CV 1
ASSI { 1229}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 2 and name HA ))
3.500 1.500 1.500 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.13569E-02 ppm1 4.427 ppm2 4.852 CV 1
ASSI { 1230}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HG1 ))
3.800 1.800 1.800 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.51496E-03 ppm1 4.431 ppm2 4.954 CV 1
ASSI { 1232}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 2 and name HB% )
4.800 2.800 1.200 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.25485E-03 ppm1 4.429 ppm2 1.578 CV 1
ASSI { 1233}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HB2 ))
4.700 2.800 1.300 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.62231E-03 ppm1 4.424 ppm2 2.023 CV 1
ASSI { 1234}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HB1 ))
5.000 3.100 1.000 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.46348E-03 ppm1 4.426 ppm2 2.188 CV 1
ASSI { 1236}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 4 and name HN ))
2.400 0.700 0.700 peak 1236 spectrum 1 weight 0.10000E+01 volume 0.39810E-02 ppm1 1.989 ppm2 9.245 CV 1
ASSI { 1237}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 1 and name HA ))
3.700 1.700 1.700 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.71860E-03 ppm1 1.557 ppm2 4.014 CV 1
ASSI { 1238}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 6 and name HA ))
4.700 2.800 1.300 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.65439E-03 ppm1 1.559 ppm2 4.154 CV 1
ASSI { 1247}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 4 and name HA ))
4.600 2.700 1.400 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.59269E-03 ppm1 1.556 ppm2 3.668 CV 1
ASSI { 1248}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 3 and name HG1 ))
4.500 2.500 1.500 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.66566E-03 ppm1 1.557 ppm2 4.930 CV 1
ASSI { 1253}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB1 ))
2.700 0.900 0.900 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.20776E-02 ppm1 4.174 ppm2 2.455 CV 1
ASSI { 1255}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 43 and name HB2 ))
3.100 1.200 1.200 peak 1255 spectrum 1 weight 0.10000E+01 volume 0.96240E-03 ppm1 4.158 ppm2 1.934 CV 1
ASSI { 1256}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 41 and name HD1%)
3.400 1.500 1.500 peak 1256 spectrum 1 weight 0.10000E+01 volume 0.20380E-02 ppm1 4.159 ppm2 0.906 CV 1
ASSI { 1259}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 43 and name HN ))
3.100 1.200 1.200 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.12810E-02 ppm1 4.153 ppm2 8.324 CV 1
ASSI { 1260}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HN ))
3.300 1.400 1.400 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.11077E-02 ppm1 4.160 ppm2 8.139 CV 1
ASSI { 1261}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HN ))
2.800 1.000 1.000 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.24738E-02 ppm1 4.154 ppm2 8.983 CV 1
ASSI { 1264}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 39 and name HA ))
3.800 1.800 1.800 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.11777E-02 ppm1 4.154 ppm2 4.682 CV 1
ASSI { 1265}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 33 and name HA ))
4.000 2.000 2.000 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.75562E-03 ppm1 4.154 ppm2 4.534 CV 1
ASSI { 1283}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 11 and name HN ))
4.000 2.000 2.000 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.52794E-03 ppm1 0.547 ppm2 9.237 CV 1
ASSI { 1284}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 73 and name HN ))
4.500 2.500 1.500 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.58113E-03 ppm1 0.551 ppm2 8.631 CV 1
ASSI { 1286}
( segid " " and resid 7 and name HG2%)
(( segid " " and resid 11 and name HB2 ))
4.600 2.600 1.400 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.40286E-03 ppm1 0.558 ppm2 1.258 CV 1
ASSI { 1289}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 2 and name HN ))
4.000 2.000 2.000 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.36966E-03 ppm1 0.528 ppm2 8.837 CV 1
ASSI { 1294}
( segid " " and resid 7 and name HD1%)
(( segid " " and resid 55 and name HB1 ))
4.600 2.600 1.400 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.26888E-03 ppm1 0.525 ppm2 3.241 CV 1
ASSI { 1300}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 11 and name HN ))
3.300 1.300 1.300 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.76693E-03 ppm1 3.368 ppm2 9.237 CV 1
ASSI { 1301}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 5 and name HA ))
2.900 1.000 1.000 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.16611E-02 ppm1 2.011 ppm2 3.935 CV 1
ASSI { 1307}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 28 and name HA ))
3.300 1.400 1.400 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.81761E-03 ppm1 1.036 ppm2 3.596 CV 1
ASSI { 1313}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 46 and name HN ))
2.700 2.700 3.300 peak 1313 spectrum 1 weight 0.10000E+01 volume 0.10585E-02 ppm1 1.503 ppm2 8.058 CV 1
ASSI { 1315}
( segid " " and resid 9 and name HB% )
(( segid " " and resid 11 and name HG ))
3.700 3.700 2.300 peak 1315 spectrum 1 weight 0.10000E+01 volume 0.24775E-02 ppm1 1.502 ppm2 1.987 CV 1
ASSI { 1316}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 12 and name HN ))
4.500 2.600 1.500 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.46922E-03 ppm1 4.047 ppm2 8.916 CV 1
ASSI { 1317}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 13 and name HN ))
4.100 2.100 1.900 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.98586E-03 ppm1 4.044 ppm2 7.938 CV 1
ASSI { 1318}
(( segid " " and resid 10 and name HA2 ))
(( segid " " and resid 13 and name HN ))
4.000 2.000 2.000 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.30374E-03 ppm1 3.857 ppm2 7.946 CV 1
ASSI { 1320}
(( segid " " and resid 10 and name HA2 ))
( segid " " and resid 54 and name HE% )
4.700 2.700 1.300 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.56333E-03 ppm1 3.856 ppm2 7.141 CV 1
ASSI { 1321}
(( segid " " and resid 10 and name HA1 ))
( segid " " and resid 54 and name HE% )
3.300 1.300 1.300 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.50817E-03 ppm1 4.046 ppm2 7.158 CV 1
ASSI { 1324}
(( segid " " and resid 10 and name HA1 ))
(( segid " " and resid 53 and name HB1 ))
4.000 2.000 2.000 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.24680E-03 ppm1 4.044 ppm2 1.635 CV 1
ASSI { 1325}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 12 and name HN ))
4.100 2.100 1.900 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.30638E-03 ppm1 4.240 ppm2 8.911 CV 1
ASSI { 1327}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 11 and name HA ))
3.300 1.400 1.400 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.43375E-03 ppm1 2.095 ppm2 4.249 CV 1
ASSI { 1330}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HG ))
2.800 1.000 1.000 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.95072E-03 ppm1 1.274 ppm2 1.980 CV 1
ASSI { 1336}
(( segid " " and resid 53 and name HG1 ))
(( segid " " and resid 52 and name HG2 ))
5.100 3.200 0.900 peak 1336 spectrum 1 weight 0.10000E+01 volume 0.14984E-03 ppm1 0.849 ppm2 2.227 CV 1
ASSI { 1338}
(( segid " " and resid 58 and name HG12))
( segid " " and resid 58 and name HG2%)
3.100 1.200 1.200 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.76601E-03 ppm1 0.842 ppm2 0.332 CV 1
ASSI { 1339}
(( segid " " and resid 53 and name HG2 ))
(( segid " " and resid 53 and name HD1 ))
3.500 1.600 1.600 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.52811E-03 ppm1 0.657 ppm2 2.875 CV 1
ASSI { 1340}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 10 and name HN ))
4.900 3.000 1.100 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.50847E-03 ppm1 0.838 ppm2 8.378 CV 1
ASSI { 1341}
( segid " " and resid 11 and name HD1%)
(( segid " " and resid 73 and name HN ))
4.000 2.000 2.000 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.43329E-03 ppm1 0.843 ppm2 8.633 CV 1
ASSI { 1343}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HN ))
4.200 2.200 1.800 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.87516E-03 ppm1 0.581 ppm2 7.467 CV 1
ASSI { 1352}
(( segid " " and resid 11 and name HG ))
( segid " " and resid 54 and name HE% )
4.200 2.200 1.800 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.36099E-03 ppm1 1.981 ppm2 7.149 CV 1
ASSI { 1355}
(( segid " " and resid 11 and name HG ))
( segid " " and resid 46 and name HG2%)
3.800 1.800 1.800 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.11339E-02 ppm1 1.989 ppm2 0.972 CV 1
ASSI { 1356}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 21 and name HB ))
4.900 3.000 1.100 peak 1356 spectrum 1 weight 0.10000E+01 volume 0.50704E-03 ppm1 4.043 ppm2 1.563 CV 1
ASSI { 1357}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 16 and name HN ))
4.300 2.300 1.700 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.24001E-03 ppm1 4.043 ppm2 8.674 CV 1
ASSI { 1358}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 11 and name HB1 ))
3.800 1.800 1.800 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.44711E-03 ppm1 4.046 ppm2 2.095 CV 1
ASSI { 1361}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 36 and name HD1%)
4.100 2.100 1.900 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.51152E-03 ppm1 4.042 ppm2 0.589 CV 1
ASSI { 1364}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 15 and name HN ))
5.600 3.900 0.400 peak 1364 spectrum 1 weight 0.10000E+01 volume 0.14917E-03 ppm1 1.672 ppm2 8.785 CV 1
ASSI { 1365}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 11 and name HN ))
4.400 2.400 1.600 peak 1365 spectrum 1 weight 0.10000E+01 volume 0.64635E-03 ppm1 1.672 ppm2 9.242 CV 1
ASSI { 1366}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 25 and name HN ))
4.300 2.300 1.700 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.35613E-03 ppm1 1.680 ppm2 7.706 CV 1
ASSI { 1371}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 11 and name HB1 ))
4.300 2.300 1.700 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.86201E-03 ppm1 1.678 ppm2 2.090 CV 1
ASSI { 1372}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HN ))
2.700 0.900 0.900 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.27892E-02 ppm1 3.934 ppm2 8.028 CV 1
ASSI { 1374}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 78 and name HN ))
2.900 2.900 3.100 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.19813E-02 ppm1 3.938 ppm2 8.255 CV 1
ASSI { 1377}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 69 and name HG2%)
2.400 0.700 0.700 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.26527E-02 ppm1 3.573 ppm2 0.653 CV 1
ASSI { 1380}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB2 ))
3.000 1.100 1.100 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.19188E-02 ppm1 3.581 ppm2 1.454 CV 1
ASSI { 1382}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 28 and name HD2%)
3.300 1.400 1.400 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.83897E-03 ppm1 3.575 ppm2 0.901 CV 1
ASSI { 1384}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB1 ))
2.700 0.900 0.900 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.22760E-02 ppm1 3.574 ppm2 1.741 CV 1
OR { 1384}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HG ))
ASSI { 1385}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 69 and name HB ))
3.100 1.200 1.200 peak 1385 spectrum 1 weight 0.10000E+01 volume 0.34685E-02 ppm1 3.577 ppm2 2.282 CV 1
ASSI { 1386}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 27 and name HA ))
4.300 2.300 1.700 peak 1386 spectrum 1 weight 0.10000E+01 volume 0.32289E-03 ppm1 3.574 ppm2 4.628 CV 1
ASSI { 1388}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HN ))
2.800 1.000 1.000 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.15724E-02 ppm1 3.574 ppm2 8.469 CV 1
ASSI { 1391}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 33 and name HG2%)
2.800 1.000 1.000 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.55902E-02 ppm1 4.515 ppm2 1.262 CV 1
ASSI { 1393}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 37 and name HN ))
4.400 2.400 1.600 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.51659E-03 ppm1 4.509 ppm2 7.327 CV 1
ASSI { 1394}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 35 and name HN ))
4.500 2.600 1.500 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.19170E-03 ppm1 4.512 ppm2 7.675 CV 1
ASSI { 1399}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 13 and name HN ))
4.900 3.000 1.100 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.31105E-03 ppm1 3.814 ppm2 7.934 CV 1
ASSI { 1402}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 49 and name HB% )
5.100 3.300 0.900 peak 1402 spectrum 1 weight 0.10000E+01 volume 0.52677E-03 ppm1 3.804 ppm2 1.513 CV 1
ASSI { 1407}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 11 and name HA ))
3.100 3.100 2.900 peak 1407 spectrum 1 weight 0.10000E+01 volume 0.12225E-02 ppm1 2.087 ppm2 4.247 CV 1
ASSI { 1409}
(( segid " " and resid 14 and name HB ))
( segid " " and resid 14 and name HG2%)
2.500 0.800 0.800 peak 1409 spectrum 1 weight 0.10000E+01 volume 0.24222E-02 ppm1 2.085 ppm2 1.051 CV 1
OR { 1409}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 14 and name HG12))
ASSI { 1417}
(( segid " " and resid 14 and name HG12))
( segid " " and resid 49 and name HB% )
3.000 1.100 1.100 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.10083E-02 ppm1 1.045 ppm2 1.517 CV 1
ASSI { 1419}
(( segid " " and resid 14 and name HG12))
( segid " " and resid 14 and name HD1%)
2.700 0.900 0.900 peak 1419 spectrum 1 weight 0.10000E+01 volume 0.18593E-02 ppm1 1.050 ppm2 0.727 CV 1
ASSI { 1420}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 47 and name HA ))
5.200 3.400 0.800 peak 1420 spectrum 1 weight 0.10000E+01 volume 0.20992E-03 ppm1 1.050 ppm2 3.291 CV 1
ASSI { 1421}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 14 and name HG11))
3.000 1.100 1.100 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.26326E-02 ppm1 1.049 ppm2 1.991 CV 1
ASSI { 1423}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 18 and name HG11))
3.000 1.100 1.100 peak 1423 spectrum 1 weight 0.10000E+01 volume 0.14993E-02 ppm1 1.048 ppm2 1.642 CV 1
OR { 1423}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 18 and name HB ))
ASSI { 1425}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 18 and name HG12))
3.000 1.100 1.100 peak 1425 spectrum 1 weight 0.10000E+01 volume 0.11500E-02 ppm1 1.046 ppm2 1.282 CV 1
ASSI { 1427}
( segid " " and resid 14 and name HG2%)
( segid " " and resid 46 and name HG1%)
2.800 1.000 1.000 peak 1427 spectrum 1 weight 0.10000E+01 volume 0.47559E-02 ppm1 1.049 ppm2 0.652 CV 1
ASSI { 1438}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 54 and name HZ ))
3.600 1.600 1.600 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.78582E-03 ppm1 0.730 ppm2 7.460 CV 1
OR { 1438}
( segid " " and resid 14 and name HD1%)
( segid " " and resid 54 and name HD% )
ASSI { 1440}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 13 and name HN ))
4.100 2.100 1.900 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.50633E-03 ppm1 0.725 ppm2 7.924 CV 1
ASSI { 1442}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 14 and name HG11))
2.400 0.700 0.700 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.37206E-02 ppm1 0.727 ppm2 1.975 CV 1
ASSI { 1447}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
3.300 1.300 1.300 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.90732E-03 ppm1 3.599 ppm2 9.244 CV 1
ASSI { 1448}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HN ))
2.600 0.900 0.900 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.29906E-02 ppm1 3.602 ppm2 8.511 CV 1
ASSI { 1449}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 16 and name HN ))
3.200 1.200 1.200 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.97794E-03 ppm1 3.600 ppm2 8.674 CV 1
ASSI { 1450}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 21 and name HN ))
4.900 3.000 1.100 peak 1450 spectrum 1 weight 0.10000E+01 volume 0.34809E-03 ppm1 3.600 ppm2 6.446 CV 1
ASSI { 1455}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 16 and name HA ))
4.100 2.100 1.900 peak 1455 spectrum 1 weight 0.10000E+01 volume 0.41494E-03 ppm1 3.589 ppm2 4.636 CV 1
ASSI { 1457}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB ))
2.700 0.900 0.900 peak 1457 spectrum 1 weight 0.10000E+01 volume 0.34752E-02 ppm1 3.604 ppm2 2.032 CV 1
ASSI { 1458}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 43 and name HG1 ))
4.100 2.100 1.900 peak 1458 spectrum 1 weight 0.10000E+01 volume 0.55022E-03 ppm1 3.610 ppm2 2.353 CV 1
ASSI { 1465}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 16 and name HA ))
4.900 3.000 1.100 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.48526E-03 ppm1 1.166 ppm2 4.680 CV 1
ASSI { 1468}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 14 and name HA ))
5.000 3.100 1.000 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.37346E-03 ppm1 1.162 ppm2 3.811 CV 1
ASSI { 1470}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 46 and name HA ))
5.100 3.200 0.900 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.49196E-03 ppm1 1.165 ppm2 3.434 CV 1
ASSI { 1472}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 12 and name HN ))
3.900 1.900 1.900 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.68115E-03 ppm1 1.165 ppm2 8.920 CV 1
ASSI { 1475}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 19 and name HN ))
5.200 3.300 0.800 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.27800E-03 ppm1 1.165 ppm2 8.460 CV 1
ASSI { 1477}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 54 and name HE% )
4.100 2.100 1.900 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.66821E-03 ppm1 1.165 ppm2 7.101 CV 1
ASSI { 1487}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 21 and name HG12))
2.500 0.800 0.800 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.25453E-02 ppm1 0.998 ppm2 1.293 CV 1
OR { 1487}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 21 and name HG11))
ASSI { 1488}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 21 and name HN ))
4.100 2.100 1.900 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.10422E-02 ppm1 0.997 ppm2 6.464 CV 1
ASSI { 1490}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 15 and name HN ))
3.800 1.800 1.800 peak 1490 spectrum 1 weight 0.10000E+01 volume 0.17427E-02 ppm1 1.000 ppm2 8.797 CV 1
ASSI { 1493}
( segid " " and resid 15 and name HG1%)
(( segid " " and resid 16 and name HA ))
4.000 2.000 2.000 peak 1493 spectrum 1 weight 0.10000E+01 volume 0.65887E-03 ppm1 0.998 ppm2 4.661 CV 1
ASSI { 1495}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HN ))
3.600 1.700 1.700 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.67495E-03 ppm1 4.670 ppm2 8.382 CV 1
ASSI { 1497}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 19 and name HA ))
3.600 3.600 2.400 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.18176E-02 ppm1 4.678 ppm2 4.833 CV 1
ASSI { 1498}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HD21))
3.000 1.100 1.100 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.12390E-02 ppm1 4.671 ppm2 6.860 CV 1
ASSI { 1504}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 37 and name HN ))
5.500 3.700 0.500 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.51387E-03 ppm1 4.090 ppm2 7.329 CV 1
ASSI { 1508}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HG12))
2.700 0.900 0.900 peak 1508 spectrum 1 weight 0.10000E+01 volume 0.28863E-02 ppm1 3.926 ppm2 1.303 CV 1
ASSI { 1513}
(( segid " " and resid 18 and name HG11))
(( segid " " and resid 18 and name HA ))
3.100 1.200 1.200 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.29938E-02 ppm1 1.639 ppm2 3.925 CV 1
ASSI { 1516}
(( segid " " and resid 18 and name HG11))
( segid " " and resid 18 and name HD1%)
2.700 0.900 0.900 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.20430E-02 ppm1 1.639 ppm2 0.773 CV 1
ASSI { 1517}
(( segid " " and resid 18 and name HG11))
(( segid " " and resid 18 and name HN ))
3.300 1.300 1.300 peak 1517 spectrum 1 weight 0.10000E+01 volume 0.26524E-02 ppm1 1.637 ppm2 8.212 CV 1
ASSI { 1519}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 46 and name HA ))
4.300 2.400 1.700 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.58549E-03 ppm1 0.934 ppm2 3.424 CV 1
ASSI { 1522}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 17 and name HN ))
5.200 3.400 0.800 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.44246E-03 ppm1 0.940 ppm2 8.337 CV 1
ASSI { 1523}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 20 and name HN ))
4.700 2.700 1.300 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.44392E-03 ppm1 0.936 ppm2 7.810 CV 1
ASSI { 1525}
( segid " " and resid 18 and name HG2%)
(( segid " " and resid 15 and name HA ))
3.800 1.800 1.800 peak 1525 spectrum 1 weight 0.10000E+01 volume 0.97237E-03 ppm1 0.939 ppm2 3.593 CV 1
ASSI { 1529}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 46 and name HN ))
3.700 1.700 1.700 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.92236E-03 ppm1 0.768 ppm2 8.059 CV 1
ASSI { 1531}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 16 and name HA ))
5.000 3.100 1.000 peak 1531 spectrum 1 weight 0.10000E+01 volume 0.21817E-03 ppm1 1.530 ppm2 4.679 CV 1
ASSI { 1533}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 16 and name HN ))
4.600 2.700 1.400 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.38336E-03 ppm1 1.535 ppm2 8.702 CV 1
ASSI { 1538}
( segid " " and resid 19 and name HB% )
(( segid " " and resid 38 and name HB ))
4.500 2.500 1.500 peak 1538 spectrum 1 weight 0.10000E+01 volume 0.28606E-03 ppm1 1.532 ppm2 1.865 CV 1
ASSI { 1539}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB1 ))
2.500 0.800 0.800 peak 1539 spectrum 1 weight 0.10000E+01 volume 0.32304E-02 ppm1 4.081 ppm2 3.136 CV 1
OR { 1539}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB2 ))
ASSI { 1541}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 36 and name HD1%)
2.500 0.800 0.800 peak 1541 spectrum 1 weight 0.10000E+01 volume 0.26491E-02 ppm1 4.080 ppm2 0.585 CV 1
ASSI { 1543}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 38 and name HG2%)
3.600 1.600 1.600 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.97358E-03 ppm1 4.086 ppm2 0.934 CV 1
ASSI { 1547}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB ))
3.400 1.400 1.400 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.77841E-03 ppm1 3.954 ppm2 1.873 CV 1
ASSI { 1548}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 34 and name HB2 ))
3.100 1.200 1.200 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.15046E-02 ppm1 3.853 ppm2 2.432 CV 1
ASSI { 1549}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 34 and name HB1 ))
4.000 2.000 2.000 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.68350E-03 ppm1 3.849 ppm2 2.764 CV 1
ASSI { 1550}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB1 ))
2.400 0.700 0.700 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.35704E-02 ppm1 4.295 ppm2 2.349 CV 1
ASSI { 1551}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
3.200 1.300 1.300 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.16421E-02 ppm1 4.300 ppm2 1.749 CV 1
ASSI { 1555}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 40 and name H28A))
2.900 1.100 1.100 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.14756E-02 ppm1 0.901 ppm2 3.730 CV 1
ASSI { 1558}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 48 and name HB ))
3.600 1.600 1.600 peak 1558 spectrum 1 weight 0.10000E+01 volume 0.13782E-02 ppm1 0.906 ppm2 2.067 CV 1
ASSI { 1562}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 40 and name H38B))
4.200 2.200 1.800 peak 1562 spectrum 1 weight 0.10000E+01 volume 0.69631E-03 ppm1 1.264 ppm2 2.445 CV 1
OR { 1562}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 40 and name H38A))
ASSI { 1567}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H4A ))
3.000 1.100 1.100 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.12191E-02 ppm1 0.411 ppm2 0.735 CV 1
OR { 1567}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H4B ))
ASSI { 1570}
( segid " " and resid 66 and name HD1%)
( segid " " and resid 32 and name HE% )
4.300 2.300 1.700 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.35621E-03 ppm1 0.400 ppm2 7.003 CV 1
ASSI { 1572}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 67 and name HG2 ))
5.200 3.300 0.800 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.35455E-03 ppm1 0.404 ppm2 1.463 CV 1
ASSI { 1573}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 80 and name HB1 ))
4.000 2.000 2.000 peak 1573 spectrum 1 weight 0.10000E+01 volume 0.52112E-03 ppm1 0.520 ppm2 2.327 CV 1
ASSI { 1575}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 7 and name HG12))
4.500 2.600 1.500 peak 1575 spectrum 1 weight 0.10000E+01 volume 0.68375E-03 ppm1 0.514 ppm2 0.286 CV 1
ASSI { 1576}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 76 and name HD1%)
2.300 0.600 0.600 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.56455E-02 ppm1 0.511 ppm2 0.608 CV 1
ASSI { 1578}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 35 and name HN ))
4.400 2.400 1.600 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.76873E-03 ppm1 4.364 ppm2 7.690 CV 1
ASSI { 1580}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HA ))
2.900 1.100 1.100 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.94883E-03 ppm1 2.281 ppm2 4.370 CV 1
ASSI { 1583}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HG ))
3.300 1.300 1.300 peak 1583 spectrum 1 weight 0.10000E+01 volume 0.10818E-02 ppm1 2.285 ppm2 1.459 CV 1
ASSI { 1584}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 32 and name HA ))
3.100 1.200 1.200 peak 1584 spectrum 1 weight 0.10000E+01 volume 0.10094E-02 ppm1 1.594 ppm2 4.084 CV 1
ASSI { 1587}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 38 and name HN ))
4.200 2.200 1.800 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.27909E-03 ppm1 1.602 ppm2 7.998 CV 1
ASSI { 1588}
(( segid " " and resid 36 and name HB2 ))
( segid " " and resid 36 and name HD1%)
3.000 1.100 1.100 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.12312E-02 ppm1 1.592 ppm2 0.585 CV 1
ASSI { 1592}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 32 and name HD% )
3.600 1.600 1.600 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.64078E-03 ppm1 0.580 ppm2 7.181 CV 1
ASSI { 1594}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 32 and name HB1 ))
4.700 2.700 1.300 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.26141E-03 ppm1 0.573 ppm2 3.148 CV 1
ASSI { 1598}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 33 and name HA ))
5.000 3.100 1.000 peak 1598 spectrum 1 weight 0.10000E+01 volume 0.31073E-03 ppm1 0.764 ppm2 4.501 CV 1
ASSI { 1599}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 38 and name HA ))
5.300 3.600 0.700 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.15814E-03 ppm1 4.664 ppm2 3.973 CV 1
ASSI { 1614}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HB1 ))
1.900 0.500 0.500 peak 1614 spectrum 1 weight 0.10000E+01 volume 0.58030E-02 ppm1 3.655 ppm2 3.964 CV 1
ASSI { 1619}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 47 and name HN ))
3.000 1.100 1.100 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.21362E-02 ppm1 3.946 ppm2 7.933 CV 1
ASSI { 1621}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 45 and name HN ))
3.600 1.600 1.600 peak 1621 spectrum 1 weight 0.10000E+01 volume 0.57485E-03 ppm1 3.941 ppm2 7.002 CV 1
ASSI { 1626}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HB1 ))
2.800 1.000 1.000 peak 1626 spectrum 1 weight 0.10000E+01 volume 0.29943E-02 ppm1 3.945 ppm2 2.088 CV 1
ASSI { 1629}
( segid " " and resid 1 and name HB% )
(( segid " " and resid 2 and name HA ))
3.900 1.900 1.900 peak 1629 spectrum 1 weight 0.10000E+01 volume 0.12673E-02 ppm1 1.503 ppm2 4.838 CV 1
ASSI { 1630}
( segid " " and resid 49 and name HB% )
(( segid " " and resid 53 and name HN ))
3.500 1.500 1.500 peak 1630 spectrum 1 weight 0.10000E+01 volume 0.14216E-02 ppm1 1.510 ppm2 8.178 CV 1
ASSI { 1631}
( segid " " and resid 1 and name HB% )
(( segid " " and resid 81 and name HN ))
3.500 1.500 1.500 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.88320E-03 ppm1 1.512 ppm2 8.295 CV 1
ASSI { 1636}
( segid " " and resid 9 and name HB% )
( segid " " and resid 8 and name HG1%)
3.600 1.600 1.600 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.20900E-02 ppm1 1.517 ppm2 0.893 CV 1
ASSI { 1637}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 43 and name HA ))
3.700 1.700 1.700 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.25333E-02 ppm1 1.538 ppm2 3.946 CV 1
ASSI { 1642}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H28A))
2.900 2.900 3.100 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.64333E-03 ppm1 1.537 ppm2 3.721 CV 1
ASSI { 1643}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 44 and name HA ))
3.500 1.500 1.500 peak 1643 spectrum 1 weight 0.10000E+01 volume 0.73116E-03 ppm1 1.539 ppm2 3.592 CV 1
ASSI { 1646}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H42A))
2.600 0.800 0.800 peak 1646 spectrum 1 weight 0.10000E+01 volume 0.23801E-02 ppm1 1.539 ppm2 3.141 CV 1
ASSI { 1647}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H43A))
3.500 1.500 1.500 peak 1647 spectrum 1 weight 0.10000E+01 volume 0.11002E-02 ppm1 1.537 ppm2 2.827 CV 1
OR { 1647}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H43B))
ASSI { 1650}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H38A))
3.000 1.100 1.100 peak 1650 spectrum 1 weight 0.10000E+01 volume 0.25010E-02 ppm1 1.539 ppm2 2.461 CV 1
OR { 1650}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H38B))
OR { 1650}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H2A ))
OR { 1650}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H2B ))
ASSI { 1651}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 43 and name HG2 ))
2.500 0.800 0.800 peak 1651 spectrum 1 weight 0.10000E+01 volume 0.44468E-02 ppm1 1.538 ppm2 2.275 CV 1
ASSI { 1652}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 43 and name HB2 ))
3.300 1.400 1.400 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.49000E-02 ppm1 1.538 ppm2 1.918 CV 1
ASSI { 1653}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 43 and name HB1 ))
2.400 0.700 0.700 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.30490E-02 ppm1 1.538 ppm2 2.079 CV 1
ASSI { 1654}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H4A ))
3.000 1.100 1.100 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.30657E-02 ppm1 1.538 ppm2 0.759 CV 1
OR { 1654}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H4B ))
ASSI { 1655}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H5B ))
2.500 0.800 0.800 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.54545E-02 ppm1 1.539 ppm2 0.680 CV 1
OR { 1655}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H5A ))
OR { 1655}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H6A ))
OR { 1655}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H6B ))
ASSI { 1657}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H3B ))
2.800 1.000 1.000 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.19183E-02 ppm1 1.538 ppm2 1.235 CV 1
OR { 1657}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H3A ))
ASSI { 1658}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 44 and name HN ))
3.700 1.700 1.700 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.84500E-03 ppm1 1.536 ppm2 7.319 CV 1
ASSI { 1659}
( segid " " and resid 43 and name HE% )
( segid " " and resid 32 and name HD% )
2.500 2.500 3.500 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.15600E-02 ppm1 1.538 ppm2 7.189 CV 1
ASSI { 1664}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 47 and name HN ))
3.600 1.600 1.600 peak 1664 spectrum 1 weight 0.10000E+01 volume 0.12816E-02 ppm1 1.537 ppm2 7.931 CV 1
ASSI { 1665}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 43 and name HN ))
4.400 2.400 1.600 peak 1665 spectrum 1 weight 0.10000E+01 volume 0.13301E-02 ppm1 1.540 ppm2 8.319 CV 1
ASSI { 1666}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 66 and name HN ))
3.600 3.600 2.400 peak 1666 spectrum 1 weight 0.10000E+01 volume 0.13434E-02 ppm1 1.539 ppm2 7.722 CV 1
ASSI { 1667}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 43 and name HG1 ))
3.000 1.100 1.100 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.37138E-02 ppm1 1.538 ppm2 2.351 CV 1
ASSI { 1668}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H41A))
3.400 1.400 1.400 peak 1668 spectrum 1 weight 0.10000E+01 volume 0.10510E-02 ppm1 1.539 ppm2 8.182 CV 1
ASSI { 1669}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HN ))
3.400 1.500 1.500 peak 1669 spectrum 1 weight 0.10000E+01 volume 0.18469E-02 ppm1 4.148 ppm2 8.988 CV 1
ASSI { 1670}
(( segid " " and resid 40 and name HB1 ))
(( segid " " and resid 40 and name HN ))
3.200 1.300 1.300 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.14124E-02 ppm1 4.117 ppm2 8.986 CV 1
ASSI { 1671}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 40 and name H31%)
3.500 1.500 1.500 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.13814E-02 ppm1 4.148 ppm2 0.874 CV 1
ASSI { 1672}
(( segid " " and resid 40 and name HB1 ))
( segid " " and resid 40 and name H31%)
4.000 2.000 2.000 peak 1672 spectrum 1 weight 0.10000E+01 volume 0.96165E-03 ppm1 4.116 ppm2 0.875 CV 1
ASSI { 1673}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 41 and name HN ))
3.600 1.700 1.700 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.63483E-03 ppm1 4.149 ppm2 8.143 CV 1
ASSI { 1674}
(( segid " " and resid 40 and name HB1 ))
(( segid " " and resid 41 and name HN ))
3.800 1.800 1.800 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.40498E-03 ppm1 4.115 ppm2 8.141 CV 1
ASSI { 1675}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 39 and name HA ))
4.500 2.500 1.500 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.52183E-03 ppm1 4.150 ppm2 4.696 CV 1
ASSI { 1680}
(( segid " " and resid 56 and name HB ))
(( segid " " and resid 80 and name HA ))
3.900 1.900 1.900 peak 1680 spectrum 1 weight 0.10000E+01 volume 0.31090E-03 ppm1 1.995 ppm2 4.418 CV 1
ASSI { 1684}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 14 and name HN ))
3.900 1.900 1.900 peak 1684 spectrum 1 weight 0.10000E+01 volume 0.78138E-03 ppm1 2.289 ppm2 8.173 CV 1
ASSI { 1687}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 70 and name HN ))
4.800 2.900 1.200 peak 1687 spectrum 1 weight 0.10000E+01 volume 0.36646E-03 ppm1 5.251 ppm2 9.445 CV 1
ASSI { 1688}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 30 and name HN ))
4.400 2.400 1.600 peak 1688 spectrum 1 weight 0.10000E+01 volume 0.41233E-03 ppm1 5.252 ppm2 7.480 CV 1
ASSI { 1689}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 67 and name HB2 ))
4.300 2.300 1.700 peak 1689 spectrum 1 weight 0.10000E+01 volume 0.31284E-03 ppm1 5.249 ppm2 2.045 CV 1
OR { 1689}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 67 and name HB1 ))
ASSI { 1693}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 74 and name HN ))
3.600 1.600 1.600 peak 1693 spectrum 1 weight 0.10000E+01 volume 0.61653E-03 ppm1 4.497 ppm2 8.007 CV 1
ASSI { 1695}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HN ))
2.600 0.900 0.900 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.30866E-02 ppm1 4.031 ppm2 9.246 CV 1
ASSI { 1697}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HN ))
3.000 1.100 1.100 peak 1697 spectrum 1 weight 0.10000E+01 volume 0.16786E-02 ppm1 4.040 ppm2 7.729 CV 1
ASSI { 1698}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HN ))
3.400 1.400 1.400 peak 1698 spectrum 1 weight 0.10000E+01 volume 0.10729E-02 ppm1 4.317 ppm2 7.488 CV 1
ASSI { 1702}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 63 and name HN ))
3.800 1.800 1.800 peak 1702 spectrum 1 weight 0.10000E+01 volume 0.50223E-03 ppm1 4.316 ppm2 7.615 CV 1
ASSI { 1703}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 64 and name HN ))
3.400 1.400 1.400 peak 1703 spectrum 1 weight 0.10000E+01 volume 0.81246E-03 ppm1 4.317 ppm2 7.027 CV 1
ASSI { 1705}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HG1 ))
4.700 2.800 1.300 peak 1705 spectrum 1 weight 0.10000E+01 volume 0.68501E-03 ppm1 4.317 ppm2 2.112 CV 1
ASSI { 1707}
(( segid " " and resid 67 and name HA ))
( segid " " and resid 32 and name HD% )
3.600 1.600 1.600 peak 1707 spectrum 1 weight 0.10000E+01 volume 0.57029E-03 ppm1 4.476 ppm2 7.182 CV 1
ASSI { 1711}
(( segid " " and resid 68 and name HB ))
(( segid " " and resid 68 and name HG1 ))
3.000 1.100 1.100 peak 1711 spectrum 1 weight 0.10000E+01 volume 0.87382E-03 ppm1 4.354 ppm2 5.391 CV 1
ASSI { 1717}
(( segid " " and resid 68 and name HB ))
(( segid " " and resid 69 and name HB ))
5.600 3.900 0.400 peak 1717 spectrum 1 weight 0.10000E+01 volume 0.36081E-03 ppm1 4.350 ppm2 2.289 CV 1
ASSI { 1718}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 67 and name HB2 ))
2.700 0.900 0.900 peak 1718 spectrum 1 weight 0.10000E+01 volume 0.38682E-02 ppm1 1.052 ppm2 2.039 CV 1
OR { 1718}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 67 and name HB1 ))
ASSI { 1722}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 71 and name HN ))
4.000 2.000 2.000 peak 1722 spectrum 1 weight 0.10000E+01 volume 0.15324E-02 ppm1 1.050 ppm2 8.356 CV 1
ASSI { 1724}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 31 and name HN ))
3.600 1.700 1.700 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.10255E-02 ppm1 1.051 ppm2 10.168 CV 1
ASSI { 1725}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 67 and name HN ))
3.900 1.900 1.900 peak 1725 spectrum 1 weight 0.10000E+01 volume 0.16746E-02 ppm1 1.054 ppm2 8.206 CV 1
ASSI { 1727}
(( segid " " and resid 69 and name HA ))
( segid " " and resid 32 and name HD% )
4.200 2.200 1.800 peak 1727 spectrum 1 weight 0.10000E+01 volume 0.58206E-03 ppm1 3.403 ppm2 7.214 CV 1
ASSI { 1728}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 70 and name HN ))
3.700 1.700 1.700 peak 1728 spectrum 1 weight 0.10000E+01 volume 0.47412E-03 ppm1 3.402 ppm2 9.412 CV 1
ASSI { 1730}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HN ))
2.700 0.900 0.900 peak 1730 spectrum 1 weight 0.10000E+01 volume 0.17363E-02 ppm1 3.395 ppm2 8.171 CV 1
ASSI { 1732}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 73 and name HN ))
3.800 1.800 1.800 peak 1732 spectrum 1 weight 0.10000E+01 volume 0.59483E-03 ppm1 3.394 ppm2 8.665 CV 1
ASSI { 1736}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 68 and name HA ))
4.400 2.400 1.600 peak 1736 spectrum 1 weight 0.10000E+01 volume 0.30283E-03 ppm1 3.398 ppm2 5.273 CV 1
ASSI { 1740}
(( segid " " and resid 43 and name HG2 ))
(( segid " " and resid 44 and name HA ))
2.800 2.800 3.200 peak 1740 spectrum 1 weight 0.10000E+01 volume 0.30414E-02 ppm1 2.272 ppm2 3.577 CV 1
ASSI { 1743}
(( segid " " and resid 46 and name HB ))
( segid " " and resid 46 and name HG1%)
2.400 0.700 0.700 peak 1743 spectrum 1 weight 0.10000E+01 volume 0.37085E-02 ppm1 2.276 ppm2 0.661 CV 1
ASSI { 1745}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 70 and name HA1 ))
5.600 3.900 0.400 peak 1745 spectrum 1 weight 0.10000E+01 volume 0.42416E-03 ppm1 0.437 ppm2 3.995 CV 1
ASSI { 1748}
( segid " " and resid 69 and name HG1%)
( segid " " and resid 72 and name HB% )
4.000 2.000 2.000 peak 1748 spectrum 1 weight 0.10000E+01 volume 0.88232E-03 ppm1 0.435 ppm2 1.597 CV 1
ASSI { 1749}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 36 and name HG ))
2.900 2.900 3.100 peak 1749 spectrum 1 weight 0.10000E+01 volume 0.74871E-03 ppm1 0.437 ppm2 1.489 CV 1
ASSI { 1750}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 30 and name HB2 ))
2.900 1.100 1.100 peak 1750 spectrum 1 weight 0.10000E+01 volume 0.93396E-03 ppm1 0.438 ppm2 1.377 CV 1
ASSI { 1751}
( segid " " and resid 69 and name HG1%)
( segid " " and resid 32 and name HD% )
3.900 1.900 1.900 peak 1751 spectrum 1 weight 0.10000E+01 volume 0.45180E-03 ppm1 0.432 ppm2 7.204 CV 1
ASSI { 1753}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 68 and name HG1 ))
5.900 4.400 0.100 peak 1753 spectrum 1 weight 0.10000E+01 volume 0.21544E-03 ppm1 0.435 ppm2 5.367 CV 1
ASSI { 1755}
( segid " " and resid 69 and name HG1%)
(( segid " " and resid 31 and name HA ))
3.600 1.600 1.600 peak 1755 spectrum 1 weight 0.10000E+01 volume 0.33875E-03 ppm1 0.440 ppm2 4.940 CV 1
ASSI { 1757}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 65 and name HB2 ))
3.600 1.600 1.600 peak 1757 spectrum 1 weight 0.10000E+01 volume 0.18833E-03 ppm1 0.601 ppm2 2.746 CV 1
ASSI { 1758}
( segid " " and resid 66 and name HD2%)
(( segid " " and resid 63 and name HA ))
2.900 2.900 3.100 peak 1758 spectrum 1 weight 0.10000E+01 volume 0.73045E-03 ppm1 0.608 ppm2 3.232 CV 1
ASSI { 1761}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 70 and name HA1 ))
4.300 2.300 1.700 peak 1761 spectrum 1 weight 0.10000E+01 volume 0.56208E-03 ppm1 0.642 ppm2 4.007 CV 1
ASSI { 1764}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 7 and name HG12))
5.400 3.600 0.600 peak 1764 spectrum 1 weight 0.10000E+01 volume 0.24089E-03 ppm1 1.103 ppm2 0.276 CV 1
ASSI { 1765}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 69 and name HG2%)
3.200 1.300 1.300 peak 1765 spectrum 1 weight 0.10000E+01 volume 0.11416E-02 ppm1 1.103 ppm2 0.665 CV 1
ASSI { 1769}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 70 and name HN ))
2.800 2.800 3.200 peak 1769 spectrum 1 weight 0.10000E+01 volume 0.88362E-03 ppm1 1.100 ppm2 9.429 CV 1
ASSI { 1772}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 73 and name HN ))
3.900 1.900 1.900 peak 1772 spectrum 1 weight 0.10000E+01 volume 0.59801E-03 ppm1 0.584 ppm2 8.645 CV 1
ASSI { 1773}
( segid " " and resid 76 and name HD1%)
(( segid " " and resid 78 and name HN ))
5.700 4.100 0.300 peak 1773 spectrum 1 weight 0.10000E+01 volume 0.24585E-03 ppm1 0.588 ppm2 8.275 CV 1
ASSI { 1777}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 59 and name HD1 ))
5.200 3.400 0.800 peak 1777 spectrum 1 weight 0.10000E+01 volume 0.61460E-03 ppm1 0.588 ppm2 3.831 CV 1
OR { 1777}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 59 and name HD2 ))
ASSI { 1780}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 11 and name HD1%)
4.000 2.000 2.000 peak 1780 spectrum 1 weight 0.10000E+01 volume 0.52752E-03 ppm1 3.679 ppm2 0.864 CV 1
OR { 1780}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 11 and name HD2%)
ASSI { 1781}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 76 and name HN ))
3.600 1.600 1.600 peak 1781 spectrum 1 weight 0.10000E+01 volume 0.54239E-03 ppm1 3.677 ppm2 8.513 CV 1
ASSI { 1784}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 34 and name HN ))
3.800 1.800 1.800 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.82666E-03 ppm1 4.176 ppm2 7.993 CV 1
ASSI { 1785}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 32 and name HN ))
4.700 2.700 1.300 peak 1785 spectrum 1 weight 0.10000E+01 volume 0.37116E-03 ppm1 4.194 ppm2 8.203 CV 1
ASSI { 1789}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 40 and name H4B ))
4.600 2.600 1.400 peak 1789 spectrum 1 weight 0.10000E+01 volume 0.55651E-03 ppm1 4.099 ppm2 0.736 CV 1
OR { 1789}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 40 and name H4A ))
ASSI { 1794}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 75 and name HD% )
3.800 1.800 1.800 peak 1794 spectrum 1 weight 0.10000E+01 volume 0.13139E-03 ppm1 0.514 ppm2 6.811 CV 1
ASSI { 1796}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 4 and name HA ))
4.800 2.900 1.200 peak 1796 spectrum 1 weight 0.10000E+01 volume 0.30949E-03 ppm1 0.516 ppm2 3.738 CV 1
ASSI { 1801}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 57 and name HA ))
3.100 3.100 2.900 peak 1801 spectrum 1 weight 0.10000E+01 volume 0.44719E-03 ppm1 0.339 ppm2 4.723 CV 1
ASSI { 1805}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 51 and name HG1 ))
5.100 3.300 0.900 peak 1805 spectrum 1 weight 0.10000E+01 volume 0.40724E-03 ppm1 0.338 ppm2 2.865 CV 1
ASSI { 1810}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 47 and name HN ))
4.300 2.300 1.700 peak 1810 spectrum 1 weight 0.10000E+01 volume 0.84827E-03 ppm1 3.924 ppm2 7.931 CV 1
ASSI { 1812}
(( segid " " and resid 48 and name HB ))
(( segid " " and resid 47 and name HN ))
3.900 1.900 1.900 peak 1812 spectrum 1 weight 0.10000E+01 volume 0.17191E-02 ppm1 2.059 ppm2 7.927 CV 1
ASSI { 1815}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 30 and name HA ))
2.800 1.000 1.000 peak 1815 spectrum 1 weight 0.10000E+01 volume 0.12942E-02 ppm1 2.054 ppm2 4.383 CV 1
ASSI { 1817}
( segid " " and resid 48 and name HG1%)
(( segid " " and resid 48 and name HN ))
2.600 0.900 0.900 peak 1817 spectrum 1 weight 0.10000E+01 volume 0.24535E-02 ppm1 0.988 ppm2 7.809 CV 1
ASSI { 1818}
( segid " " and resid 48 and name HG1%)
(( segid " " and resid 47 and name HN ))
3.400 1.500 1.500 peak 1818 spectrum 1 weight 0.10000E+01 volume 0.24658E-02 ppm1 0.987 ppm2 7.934 CV 1
ASSI { 1824}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 46 and name HN ))
5.500 3.800 0.500 peak 1824 spectrum 1 weight 0.10000E+01 volume 0.18187E-03 ppm1 3.304 ppm2 8.071 CV 1
ASSI { 1825}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 47 and name HN ))
3.100 1.200 1.200 peak 1825 spectrum 1 weight 0.10000E+01 volume 0.11672E-02 ppm1 3.416 ppm2 7.927 CV 1
ASSI { 1827}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 47 and name HA ))
3.900 1.900 1.900 peak 1827 spectrum 1 weight 0.10000E+01 volume 0.61142E-03 ppm1 0.978 ppm2 3.283 CV 1
ASSI { 1828}
( segid " " and resid 46 and name HG2%)
(( segid " " and resid 47 and name HN ))
3.400 1.400 1.400 peak 1828 spectrum 1 weight 0.10000E+01 volume 0.15588E-02 ppm1 0.976 ppm2 7.933 CV 1
ASSI { 1839}
(( segid " " and resid 63 and name HB ))
(( segid " " and resid 62 and name HN ))
4.800 2.900 1.200 peak 1839 spectrum 1 weight 0.10000E+01 volume 0.43819E-03 ppm1 1.985 ppm2 7.483 CV 1
ASSI { 1841}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 65 and name HN ))
3.800 1.800 1.800 peak 1841 spectrum 1 weight 0.10000E+01 volume 0.44970E-03 ppm1 3.234 ppm2 7.276 CV 1
ASSI { 1843}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 59 and name HD1 ))
3.900 3.900 2.100 peak 1843 spectrum 1 weight 0.10000E+01 volume 0.72852E-03 ppm1 3.225 ppm2 3.806 CV 1
OR { 1843}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 59 and name HD2 ))
ASSI { 1848}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 51 and name HG1 ))
3.100 1.200 1.200 peak 1848 spectrum 1 weight 0.10000E+01 volume 0.93622E-03 ppm1 0.914 ppm2 2.842 CV 1
ASSI { 1853}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 74 and name HA ))
3.600 1.600 1.600 peak 1853 spectrum 1 weight 0.10000E+01 volume 0.57577E-03 ppm1 1.467 ppm2 3.948 CV 1
OR { 1853}
(( segid " " and resid 74 and name HG1 ))
(( segid " " and resid 74 and name HA ))
ASSI { 2}
(( segid " " and resid 2 and name HN ))
(( segid " " and resid 2 and name HA ))
3.100 1.200 1.200 peak 2 spectrum 1 weight 0.10000E+01 volume 0.10151E-02 ppm1 8.826 ppm2 4.818 CV 1
ASSI { 3}
(( segid " " and resid 2 and name HN ))
(( segid " " and resid 80 and name HE22))
3.400 1.500 1.500 peak 3 spectrum 1 weight 0.10000E+01 volume 0.42013E-03 ppm1 8.829 ppm2 7.735 CV 1
ASSI { 4}
(( segid " " and resid 2 and name HN ))
(( segid " " and resid 80 and name HE21))
3.700 1.700 1.700 peak 4 spectrum 1 weight 0.10000E+01 volume 0.96290E-03 ppm1 8.825 ppm2 7.633 CV 1
ASSI { 8}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 6 and name HB1 ))
3.700 1.700 1.700 peak 8 spectrum 1 weight 0.10000E+01 volume 0.23420E-02 ppm1 8.529 ppm2 2.484 CV 1
ASSI { 9}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 6 and name HG2 ))
4.200 2.200 1.800 peak 9 spectrum 1 weight 0.10000E+01 volume 0.79859E-03 ppm1 8.530 ppm2 2.375 CV 1
OR { 9}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 6 and name HG1 ))
ASSI { 10}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 6 and name HB2 ))
2.400 0.700 0.700 peak 10 spectrum 1 weight 0.10000E+01 volume 0.12375E-02 ppm1 8.533 ppm2 2.112 CV 1
ASSI { 11}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 2 and name HA ))
2.300 0.600 0.600 peak 11 spectrum 1 weight 0.10000E+01 volume 0.58691E-02 ppm1 8.531 ppm2 4.821 CV 1
ASSI { 12}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HB ))
3.300 1.400 1.400 peak 12 spectrum 1 weight 0.10000E+01 volume 0.49963E-03 ppm1 8.531 ppm2 4.721 CV 1
ASSI { 14}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 6 and name HN ))
3.400 1.400 1.400 peak 14 spectrum 1 weight 0.10000E+01 volume 0.82326E-03 ppm1 8.532 ppm2 7.694 CV 1
ASSI { 15}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 5 and name HN ))
3.000 1.100 1.100 peak 15 spectrum 1 weight 0.10000E+01 volume 0.12102E-02 ppm1 9.227 ppm2 8.861 CV 1
ASSI { 17}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HN ))
4.200 2.200 1.800 peak 17 spectrum 1 weight 0.10000E+01 volume 0.42093E-03 ppm1 9.224 ppm2 8.524 CV 1
ASSI { 18}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 6 and name HN ))
5.100 3.300 0.900 peak 18 spectrum 1 weight 0.10000E+01 volume 0.14942E-03 ppm1 9.223 ppm2 7.691 CV 1
ASSI { 26}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 4 and name HB1 ))
2.600 0.800 0.800 peak 26 spectrum 1 weight 0.10000E+01 volume 0.28831E-02 ppm1 9.228 ppm2 2.174 CV 1
OR { 26}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 4 and name HG2 ))
ASSI { 28}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HG1 ))
3.700 1.700 1.700 peak 28 spectrum 1 weight 0.10000E+01 volume 0.11774E-02 ppm1 8.855 ppm2 2.480 CV 1
ASSI { 31}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HB1 ))
2.900 1.100 1.100 peak 31 spectrum 1 weight 0.10000E+01 volume 0.15712E-02 ppm1 8.856 ppm2 2.169 CV 1
OR { 31}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HG2 ))
ASSI { 32}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HB1 ))
2.600 0.800 0.800 peak 32 spectrum 1 weight 0.10000E+01 volume 0.41905E-02 ppm1 8.857 ppm2 2.069 CV 1
ASSI { 33}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HB2 ))
2.700 0.900 0.900 peak 33 spectrum 1 weight 0.10000E+01 volume 0.27339E-02 ppm1 8.856 ppm2 1.996 CV 1
ASSI { 35}
(( segid " " and resid 5 and name HN ))
( segid " " and resid 8 and name HG2%)
5.300 3.500 0.700 peak 35 spectrum 1 weight 0.10000E+01 volume 0.11642E-03 ppm1 8.859 ppm2 1.047 CV 1
ASSI { 37}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
3.300 1.400 1.400 peak 37 spectrum 1 weight 0.10000E+01 volume 0.92370E-03 ppm1 8.856 ppm2 3.701 CV 1
ASSI { 41}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 6 and name HN ))
2.600 0.800 0.800 peak 41 spectrum 1 weight 0.10000E+01 volume 0.25487E-02 ppm1 8.856 ppm2 7.689 CV 1
ASSI { 46}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HA ))
2.800 1.000 1.000 peak 46 spectrum 1 weight 0.10000E+01 volume 0.22032E-02 ppm1 7.686 ppm2 4.131 CV 1
ASSI { 50}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HG1 ))
2.900 1.000 1.000 peak 50 spectrum 1 weight 0.10000E+01 volume 0.25389E-02 ppm1 7.686 ppm2 2.415 CV 1
OR { 50}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HG2 ))
ASSI { 53}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 7 and name HB ))
5.100 3.200 0.900 peak 53 spectrum 1 weight 0.10000E+01 volume 0.26944E-03 ppm1 7.684 ppm2 1.786 CV 1
ASSI { 56}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 7 and name HN ))
2.400 0.700 0.700 peak 56 spectrum 1 weight 0.10000E+01 volume 0.37359E-02 ppm1 7.686 ppm2 8.397 CV 1
ASSI { 59}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 5 and name HA ))
3.100 1.200 1.200 peak 59 spectrum 1 weight 0.10000E+01 volume 0.15767E-02 ppm1 8.394 ppm2 3.885 CV 1
ASSI { 60}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 4 and name HA ))
3.700 1.700 1.700 peak 60 spectrum 1 weight 0.10000E+01 volume 0.70670E-03 ppm1 8.395 ppm2 3.705 CV 1
ASSI { 61}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 5 and name HG1 ))
2.700 2.700 3.300 peak 61 spectrum 1 weight 0.10000E+01 volume 0.11602E-02 ppm1 8.398 ppm2 2.480 CV 1
ASSI { 62}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HG2 ))
4.600 2.700 1.400 peak 62 spectrum 1 weight 0.10000E+01 volume 0.35263E-03 ppm1 8.391 ppm2 2.374 CV 1
ASSI { 63}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HB2 ))
3.200 1.300 1.300 peak 63 spectrum 1 weight 0.10000E+01 volume 0.90770E-03 ppm1 8.399 ppm2 2.112 CV 1
ASSI { 65}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HG11))
3.400 1.400 1.400 peak 65 spectrum 1 weight 0.10000E+01 volume 0.33584E-02 ppm1 8.397 ppm2 1.549 CV 1
ASSI { 66}
(( segid " " and resid 7 and name HN ))
( segid " " and resid 73 and name HG2%)
4.700 2.700 1.300 peak 66 spectrum 1 weight 0.10000E+01 volume 0.48660E-03 ppm1 8.400 ppm2 1.105 CV 1
ASSI { 67}
(( segid " " and resid 7 and name HN ))
( segid " " and resid 7 and name HD1%)
3.600 1.600 1.600 peak 67 spectrum 1 weight 0.10000E+01 volume 0.19656E-02 ppm1 8.395 ppm2 0.537 CV 1
ASSI { 68}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HG12))
2.800 1.000 1.000 peak 68 spectrum 1 weight 0.10000E+01 volume 0.13092E-02 ppm1 8.396 ppm2 0.273 CV 1
ASSI { 69}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HB ))
2.400 0.700 0.700 peak 69 spectrum 1 weight 0.10000E+01 volume 0.35501E-02 ppm1 8.381 ppm2 2.018 CV 1
ASSI { 70}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HB ))
2.400 0.700 0.700 peak 70 spectrum 1 weight 0.10000E+01 volume 0.23666E-02 ppm1 8.377 ppm2 1.789 CV 1
ASSI { 71}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HG11))
4.500 2.500 1.500 peak 71 spectrum 1 weight 0.10000E+01 volume 0.85505E-03 ppm1 8.377 ppm2 1.528 CV 1
ASSI { 75}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 7 and name HG2%)
3.000 1.100 1.100 peak 75 spectrum 1 weight 0.10000E+01 volume 0.13101E-02 ppm1 8.383 ppm2 0.548 CV 1
ASSI { 77}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HA ))
2.600 0.800 0.800 peak 77 spectrum 1 weight 0.10000E+01 volume 0.21603E-02 ppm1 8.379 ppm2 3.378 CV 1
ASSI { 81}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 8 and name HG1%)
3.300 1.400 1.400 peak 81 spectrum 1 weight 0.10000E+01 volume 0.15316E-02 ppm1 7.727 ppm2 0.887 CV 1
ASSI { 82}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 9 and name HB% )
2.300 0.700 0.700 peak 82 spectrum 1 weight 0.10000E+01 volume 0.78347E-02 ppm1 7.727 ppm2 1.516 CV 1
ASSI { 83}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HB ))
2.500 0.800 0.800 peak 83 spectrum 1 weight 0.10000E+01 volume 0.29408E-02 ppm1 7.728 ppm2 2.012 CV 1
ASSI { 84}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 12 and name HB% )
4.400 2.500 1.600 peak 84 spectrum 1 weight 0.10000E+01 volume 0.43559E-03 ppm1 7.724 ppm2 1.678 CV 1
ASSI { 85}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HA ))
2.800 1.000 1.000 peak 85 spectrum 1 weight 0.10000E+01 volume 0.28663E-02 ppm1 7.728 ppm2 4.220 CV 1
ASSI { 86}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 6 and name HA ))
3.400 1.400 1.400 peak 86 spectrum 1 weight 0.10000E+01 volume 0.96718E-03 ppm1 7.728 ppm2 4.130 CV 1
ASSI { 87}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 7 and name HA ))
3.700 1.700 1.700 peak 87 spectrum 1 weight 0.10000E+01 volume 0.50440E-03 ppm1 7.723 ppm2 3.897 CV 1
ASSI { 90}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 11 and name HN ))
3.900 1.900 1.900 peak 90 spectrum 1 weight 0.10000E+01 volume 0.56145E-03 ppm1 7.729 ppm2 9.243 CV 1
ASSI { 93}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 6 and name HA ))
3.800 1.800 1.800 peak 93 spectrum 1 weight 0.10000E+01 volume 0.51751E-03 ppm1 8.386 ppm2 4.130 CV 1
ASSI { 95}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA2 ))
2.700 0.900 0.900 peak 95 spectrum 1 weight 0.10000E+01 volume 0.44120E-02 ppm1 8.388 ppm2 3.868 CV 1
ASSI { 96}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 54 and name HZ ))
3.900 1.900 1.900 peak 96 spectrum 1 weight 0.10000E+01 volume 0.69234E-03 ppm1 8.387 ppm2 7.453 CV 1
OR { 96}
(( segid " " and resid 10 and name HN ))
( segid " " and resid 54 and name HD% )
ASSI { 97}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
2.600 0.900 0.900 peak 97 spectrum 1 weight 0.10000E+01 volume 0.26297E-02 ppm1 8.388 ppm2 7.729 CV 1
ASSI { 99}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 12 and name HN ))
4.100 2.100 1.900 peak 99 spectrum 1 weight 0.10000E+01 volume 0.61204E-03 ppm1 8.391 ppm2 8.901 CV 1
ASSI { 102}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 11 and name HB1 ))
5.200 3.300 0.800 peak 102 spectrum 1 weight 0.10000E+01 volume 0.37623E-03 ppm1 8.386 ppm2 2.103 CV 1
ASSI { 103}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 8 and name HA ))
3.900 1.900 1.900 peak 103 spectrum 1 weight 0.10000E+01 volume 0.38883E-03 ppm1 8.385 ppm2 3.379 CV 1
ASSI { 111}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 15 and name HG2%)
5.100 3.200 0.900 peak 111 spectrum 1 weight 0.10000E+01 volume 0.21035E-03 ppm1 9.223 ppm2 1.186 CV 1
ASSI { 121}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA2 ))
3.300 1.300 1.300 peak 121 spectrum 1 weight 0.10000E+01 volume 0.15073E-02 ppm1 9.224 ppm2 3.871 CV 1
ASSI { 123}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 11 and name HN ))
2.500 0.800 0.800 peak 123 spectrum 1 weight 0.10000E+01 volume 0.27441E-02 ppm1 8.388 ppm2 9.227 CV 1
ASSI { 124}
(( segid " " and resid 10 and name HN ))
( segid " " and resid 54 and name HE% )
4.000 2.000 2.000 peak 124 spectrum 1 weight 0.10000E+01 volume 0.35826E-03 ppm1 8.388 ppm2 7.133 CV 1
ASSI { 125}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HB1 ))
3.200 1.300 1.300 peak 125 spectrum 1 weight 0.10000E+01 volume 0.31914E-02 ppm1 9.225 ppm2 2.110 CV 1
ASSI { 126}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HG ))
2.400 0.700 0.700 peak 126 spectrum 1 weight 0.10000E+01 volume 0.25908E-02 ppm1 9.227 ppm2 1.993 CV 1
ASSI { 127}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HB2 ))
2.600 0.800 0.800 peak 127 spectrum 1 weight 0.10000E+01 volume 0.16361E-02 ppm1 9.225 ppm2 1.282 CV 1
ASSI { 129}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 9 and name HB% )
3.100 3.100 2.900 peak 129 spectrum 1 weight 0.10000E+01 volume 0.45251E-03 ppm1 9.228 ppm2 1.505 CV 1
ASSI { 130}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 54 and name HE% )
4.400 2.400 1.600 peak 130 spectrum 1 weight 0.10000E+01 volume 0.39225E-03 ppm1 9.229 ppm2 7.136 CV 1
ASSI { 131}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 54 and name HZ ))
3.000 1.100 1.100 peak 131 spectrum 1 weight 0.10000E+01 volume 0.85116E-03 ppm1 9.224 ppm2 7.463 CV 1
ASSI { 132}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 13 and name HN ))
4.100 2.100 1.900 peak 132 spectrum 1 weight 0.10000E+01 volume 0.30996E-03 ppm1 9.224 ppm2 7.939 CV 1
ASSI { 135}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HN ))
2.500 0.800 0.800 peak 135 spectrum 1 weight 0.10000E+01 volume 0.29787E-02 ppm1 9.225 ppm2 8.919 CV 1
ASSI { 138}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HB2 ))
2.900 1.000 1.000 peak 138 spectrum 1 weight 0.10000E+01 volume 0.85480E-03 ppm1 8.917 ppm2 1.284 CV 1
ASSI { 141}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HB1 ))
3.300 1.400 1.400 peak 141 spectrum 1 weight 0.10000E+01 volume 0.19976E-02 ppm1 8.917 ppm2 2.109 CV 1
ASSI { 143}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 8 and name HA ))
4.300 2.300 1.700 peak 143 spectrum 1 weight 0.10000E+01 volume 0.44334E-03 ppm1 8.912 ppm2 3.391 CV 1
ASSI { 146}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 10 and name HA2 ))
4.600 2.600 1.400 peak 146 spectrum 1 weight 0.10000E+01 volume 0.24823E-03 ppm1 8.918 ppm2 3.860 CV 1
ASSI { 152}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HG1 ))
3.400 1.500 1.500 peak 152 spectrum 1 weight 0.10000E+01 volume 0.20663E-02 ppm1 7.936 ppm2 2.612 CV 1
ASSI { 153}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HG2 ))
2.500 0.800 0.800 peak 153 spectrum 1 weight 0.10000E+01 volume 0.44669E-02 ppm1 7.936 ppm2 2.294 CV 1
OR { 153}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HB1 ))
ASSI { 154}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HB2 ))
2.700 0.900 0.900 peak 154 spectrum 1 weight 0.10000E+01 volume 0.22793E-02 ppm1 7.936 ppm2 2.214 CV 1
ASSI { 155}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
2.600 0.800 0.800 peak 155 spectrum 1 weight 0.10000E+01 volume 0.24510E-02 ppm1 7.935 ppm2 8.918 CV 1
ASSI { 156}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 12 and name HB% )
2.700 0.900 0.900 peak 156 spectrum 1 weight 0.10000E+01 volume 0.33607E-02 ppm1 7.935 ppm2 1.678 CV 1
ASSI { 161}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HN ))
2.400 0.700 0.700 peak 161 spectrum 1 weight 0.10000E+01 volume 0.22005E-02 ppm1 8.157 ppm2 8.791 CV 1
ASSI { 162}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HN ))
2.600 0.900 0.900 peak 162 spectrum 1 weight 0.10000E+01 volume 0.19442E-02 ppm1 8.157 ppm2 7.939 CV 1
ASSI { 168}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HB ))
2.300 0.600 0.600 peak 168 spectrum 1 weight 0.10000E+01 volume 0.46105E-02 ppm1 8.158 ppm2 2.090 CV 1
ASSI { 169}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HG11))
2.800 1.000 1.000 peak 169 spectrum 1 weight 0.10000E+01 volume 0.31985E-02 ppm1 8.158 ppm2 1.985 CV 1
ASSI { 170}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HG12))
3.400 1.400 1.400 peak 170 spectrum 1 weight 0.10000E+01 volume 0.33544E-02 ppm1 8.160 ppm2 1.051 CV 1
OR { 170}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 14 and name HG2%)
ASSI { 173}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HB1 ))
2.400 0.700 0.700 peak 173 spectrum 1 weight 0.10000E+01 volume 0.48396E-02 ppm1 8.372 ppm2 2.257 CV 1
OR { 173}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HG2 ))
ASSI { 174}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HB2 ))
3.000 1.200 1.200 peak 174 spectrum 1 weight 0.10000E+01 volume 0.29845E-02 ppm1 8.372 ppm2 2.131 CV 1
ASSI { 175}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HG1 ))
3.800 1.800 1.800 peak 175 spectrum 1 weight 0.10000E+01 volume 0.11122E-02 ppm1 8.372 ppm2 2.418 CV 1
ASSI { 176}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HB2 ))
3.500 1.500 1.500 peak 176 spectrum 1 weight 0.10000E+01 volume 0.21374E-02 ppm1 8.372 ppm2 2.741 CV 1
ASSI { 177}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HB1 ))
2.800 1.000 1.000 peak 177 spectrum 1 weight 0.10000E+01 volume 0.13058E-02 ppm1 8.374 ppm2 3.103 CV 1
ASSI { 178}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 15 and name HA ))
4.500 2.500 1.500 peak 178 spectrum 1 weight 0.10000E+01 volume 0.34693E-03 ppm1 8.373 ppm2 3.611 CV 1
ASSI { 179}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HA ))
3.200 3.200 2.800 peak 179 spectrum 1 weight 0.10000E+01 volume 0.43429E-02 ppm1 8.372 ppm2 3.926 CV 1
ASSI { 180}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 14 and name HA ))
3.200 1.300 1.300 peak 180 spectrum 1 weight 0.10000E+01 volume 0.97882E-03 ppm1 8.372 ppm2 3.822 CV 1
ASSI { 182}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
2.700 0.900 0.900 peak 182 spectrum 1 weight 0.10000E+01 volume 0.23677E-02 ppm1 8.373 ppm2 8.689 CV 1
ASSI { 194}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HA ))
2.700 0.900 0.900 peak 194 spectrum 1 weight 0.10000E+01 volume 0.27113E-02 ppm1 8.205 ppm2 3.929 CV 1
ASSI { 195}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 15 and name HA ))
3.600 1.600 1.600 peak 195 spectrum 1 weight 0.10000E+01 volume 0.90092E-03 ppm1 8.203 ppm2 3.593 CV 1
ASSI { 196}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HG2 ))
3.300 1.400 1.400 peak 196 spectrum 1 weight 0.10000E+01 volume 0.14955E-02 ppm1 8.202 ppm2 2.260 CV 1
OR { 196}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HB1 ))
ASSI { 197}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HB2 ))
3.400 1.500 1.500 peak 197 spectrum 1 weight 0.10000E+01 volume 0.17124E-02 ppm1 8.206 ppm2 2.126 CV 1
ASSI { 198}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HG1 ))
3.700 1.700 1.700 peak 198 spectrum 1 weight 0.10000E+01 volume 0.49858E-03 ppm1 8.208 ppm2 2.420 CV 1
ASSI { 199}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HB ))
2.100 0.600 0.600 peak 199 spectrum 1 weight 0.10000E+01 volume 0.68894E-02 ppm1 8.206 ppm2 1.629 CV 1
OR { 199}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HG11))
ASSI { 200}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 19 and name HB% )
5.100 3.200 0.900 peak 200 spectrum 1 weight 0.10000E+01 volume 0.38893E-03 ppm1 8.209 ppm2 1.538 CV 1
ASSI { 201}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HG12))
2.900 1.000 1.000 peak 201 spectrum 1 weight 0.10000E+01 volume 0.14795E-02 ppm1 8.209 ppm2 1.312 CV 1
ASSI { 203}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 18 and name HD1%)
4.000 2.000 2.000 peak 203 spectrum 1 weight 0.10000E+01 volume 0.85560E-03 ppm1 8.209 ppm2 0.766 CV 1
ASSI { 204}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HN ))
2.500 0.800 0.800 peak 204 spectrum 1 weight 0.10000E+01 volume 0.34056E-02 ppm1 8.203 ppm2 8.471 CV 1
ASSI { 205}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HN ))
2.600 0.800 0.800 peak 205 spectrum 1 weight 0.10000E+01 volume 0.23416E-02 ppm1 8.208 ppm2 8.373 CV 1
ASSI { 207}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA ))
3.000 1.100 1.100 peak 207 spectrum 1 weight 0.10000E+01 volume 0.15731E-02 ppm1 8.467 ppm2 4.811 CV 1
ASSI { 208}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
3.300 1.300 1.300 peak 208 spectrum 1 weight 0.10000E+01 volume 0.12413E-02 ppm1 8.468 ppm2 3.933 CV 1
ASSI { 209}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 15 and name HA ))
3.500 1.600 1.600 peak 209 spectrum 1 weight 0.10000E+01 volume 0.11276E-02 ppm1 8.469 ppm2 3.605 CV 1
ASSI { 210}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HB ))
2.300 0.700 0.700 peak 210 spectrum 1 weight 0.10000E+01 volume 0.27542E-02 ppm1 8.469 ppm2 1.626 CV 1
ASSI { 215}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 20 and name HN ))
2.300 0.600 0.600 peak 215 spectrum 1 weight 0.10000E+01 volume 0.39944E-02 ppm1 8.469 ppm2 7.810 CV 1
ASSI { 216}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 21 and name HN ))
4.500 2.500 1.500 peak 216 spectrum 1 weight 0.10000E+01 volume 0.41327E-03 ppm1 8.466 ppm2 6.463 CV 1
ASSI { 217}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 16 and name HN ))
3.800 1.800 1.800 peak 217 spectrum 1 weight 0.10000E+01 volume 0.67064E-03 ppm1 8.466 ppm2 8.652 CV 1
ASSI { 221}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA1 ))
3.400 1.500 1.500 peak 221 spectrum 1 weight 0.10000E+01 volume 0.11095E-02 ppm1 6.462 ppm2 4.052 CV 1
ASSI { 222}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA2 ))
3.100 1.200 1.200 peak 222 spectrum 1 weight 0.10000E+01 volume 0.93911E-03 ppm1 6.462 ppm2 3.940 CV 1
ASSI { 227}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HG11))
1.900 0.500 0.500 peak 227 spectrum 1 weight 0.10000E+01 volume 0.44438E-02 ppm1 6.462 ppm2 1.304 CV 1
OR { 227}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HG12))
ASSI { 228}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HB ))
2.900 1.000 1.000 peak 228 spectrum 1 weight 0.10000E+01 volume 0.39701E-02 ppm1 6.462 ppm2 1.605 CV 1
ASSI { 229}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 21 and name HG2%)
3.200 1.300 1.300 peak 229 spectrum 1 weight 0.10000E+01 volume 0.21082E-02 ppm1 6.461 ppm2 1.003 CV 1
ASSI { 231}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 21 and name HD1%)
3.200 1.300 1.300 peak 231 spectrum 1 weight 0.10000E+01 volume 0.11352E-02 ppm1 6.463 ppm2 0.831 CV 1
ASSI { 232}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 16 and name HN ))
4.900 3.000 1.100 peak 232 spectrum 1 weight 0.10000E+01 volume 0.28006E-03 ppm1 6.463 ppm2 8.688 CV 1
ASSI { 236}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HN ))
2.600 0.800 0.800 peak 236 spectrum 1 weight 0.10000E+01 volume 0.20233E-02 ppm1 8.507 ppm2 9.244 CV 1
ASSI { 237}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 16 and name HD22))
3.200 3.200 2.800 peak 237 spectrum 1 weight 0.10000E+01 volume 0.34998E-03 ppm1 8.507 ppm2 8.064 CV 1
ASSI { 238}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 16 and name HD21))
3.300 3.300 2.700 peak 238 spectrum 1 weight 0.10000E+01 volume 0.64945E-03 ppm1 8.502 ppm2 6.851 CV 1
ASSI { 239}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 23 and name HG1%)
2.300 0.700 0.700 peak 239 spectrum 1 weight 0.10000E+01 volume 0.60572E-02 ppm1 8.506 ppm2 0.988 CV 1
OR { 239}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 23 and name HG2%)
ASSI { 240}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HB ))
3.000 1.100 1.100 peak 240 spectrum 1 weight 0.10000E+01 volume 0.31211E-02 ppm1 8.508 ppm2 2.029 CV 1
ASSI { 241}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HB1 ))
3.200 1.300 1.300 peak 241 spectrum 1 weight 0.10000E+01 volume 0.10792E-02 ppm1 8.508 ppm2 2.344 CV 1
ASSI { 244}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 26 and name HN ))
4.800 2.900 1.200 peak 244 spectrum 1 weight 0.10000E+01 volume 0.51471E-03 ppm1 9.243 ppm2 7.478 CV 1
ASSI { 245}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HA ))
4.500 2.600 1.500 peak 245 spectrum 1 weight 0.10000E+01 volume 0.51479E-03 ppm1 9.252 ppm2 4.303 CV 1
ASSI { 249}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HB1 ))
2.600 0.800 0.800 peak 249 spectrum 1 weight 0.10000E+01 volume 0.53691E-02 ppm1 9.246 ppm2 2.001 CV 1
OR { 249}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HB2 ))
ASSI { 250}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HB2 ))
3.000 1.100 1.100 peak 250 spectrum 1 weight 0.10000E+01 volume 0.75407E-03 ppm1 9.249 ppm2 1.755 CV 1
ASSI { 251}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HG2 ))
2.700 0.900 0.900 peak 251 spectrum 1 weight 0.10000E+01 volume 0.24434E-02 ppm1 9.245 ppm2 2.285 CV 1
OR { 251}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HG1 ))
ASSI { 253}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 26 and name HG2%)
3.600 1.600 1.600 peak 253 spectrum 1 weight 0.10000E+01 volume 0.10943E-02 ppm1 7.729 ppm2 0.922 CV 1
ASSI { 254}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 22 and name HB2 ))
3.000 1.100 1.100 peak 254 spectrum 1 weight 0.10000E+01 volume 0.11293E-02 ppm1 7.731 ppm2 1.742 CV 1
ASSI { 255}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HB2 ))
3.700 1.700 1.700 peak 255 spectrum 1 weight 0.10000E+01 volume 0.10995E-02 ppm1 7.729 ppm2 1.990 CV 1
OR { 255}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HB1 ))
ASSI { 256}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HB1 ))
2.700 0.900 0.900 peak 256 spectrum 1 weight 0.10000E+01 volume 0.30935E-02 ppm1 7.729 ppm2 2.683 CV 1
ASSI { 258}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HG1 ))
3.700 1.700 1.700 peak 258 spectrum 1 weight 0.10000E+01 volume 0.11900E-02 ppm1 7.730 ppm2 2.286 CV 1
OR { 258}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HG2 ))
ASSI { 261}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HN ))
2.400 0.700 0.700 peak 261 spectrum 1 weight 0.10000E+01 volume 0.24984E-02 ppm1 7.729 ppm2 9.247 CV 1
ASSI { 267}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 12 and name HB% )
4.000 2.000 2.000 peak 267 spectrum 1 weight 0.10000E+01 volume 0.90845E-03 ppm1 7.477 ppm2 1.678 CV 1
ASSI { 269}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB ))
2.400 0.700 0.700 peak 269 spectrum 1 weight 0.10000E+01 volume 0.47617E-02 ppm1 7.477 ppm2 2.332 CV 1
ASSI { 270}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB1 ))
3.600 1.600 1.600 peak 270 spectrum 1 weight 0.10000E+01 volume 0.66080E-03 ppm1 7.476 ppm2 2.680 CV 1
ASSI { 271}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB2 ))
4.800 2.900 1.200 peak 271 spectrum 1 weight 0.10000E+01 volume 0.27745E-03 ppm1 7.475 ppm2 2.577 CV 1
ASSI { 273}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 23 and name HA ))
3.700 1.700 1.700 peak 273 spectrum 1 weight 0.10000E+01 volume 0.71479E-03 ppm1 7.476 ppm2 3.607 CV 1
ASSI { 274}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HA ))
2.800 1.000 1.000 peak 274 spectrum 1 weight 0.10000E+01 volume 0.17741E-02 ppm1 7.476 ppm2 3.530 CV 1
ASSI { 275}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HA ))
3.400 1.500 1.500 peak 275 spectrum 1 weight 0.10000E+01 volume 0.10172E-02 ppm1 7.481 ppm2 4.042 CV 1
ASSI { 280}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HN ))
2.300 0.600 0.600 peak 280 spectrum 1 weight 0.10000E+01 volume 0.45770E-02 ppm1 7.477 ppm2 7.730 CV 1
ASSI { 283}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA ))
3.400 1.500 1.500 peak 283 spectrum 1 weight 0.10000E+01 volume 0.80500E-03 ppm1 8.384 ppm2 3.582 CV 1
ASSI { 285}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB2 ))
2.900 1.000 1.000 peak 285 spectrum 1 weight 0.10000E+01 volume 0.20361E-02 ppm1 8.389 ppm2 2.593 CV 1
ASSI { 286}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB1 ))
3.400 1.500 1.500 peak 286 spectrum 1 weight 0.10000E+01 volume 0.17423E-02 ppm1 8.387 ppm2 1.733 CV 1
ASSI { 287}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 27 and name HB2 ))
3.300 1.300 1.300 peak 287 spectrum 1 weight 0.10000E+01 volume 0.84923E-03 ppm1 8.389 ppm2 1.547 CV 1
ASSI { 288}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB2 ))
3.100 1.200 1.200 peak 288 spectrum 1 weight 0.10000E+01 volume 0.12237E-02 ppm1 8.389 ppm2 1.461 CV 1
ASSI { 289}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 27 and name HG1 ))
4.600 2.600 1.400 peak 289 spectrum 1 weight 0.10000E+01 volume 0.67977E-03 ppm1 8.393 ppm2 1.331 CV 1
OR { 289}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 27 and name HG2 ))
ASSI { 291}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 28 and name HD2%)
3.300 1.400 1.400 peak 291 spectrum 1 weight 0.10000E+01 volume 0.30850E-03 ppm1 8.388 ppm2 0.898 CV 1
ASSI { 292}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 28 and name HD1%)
5.600 3.900 0.400 peak 292 spectrum 1 weight 0.10000E+01 volume 0.17966E-03 ppm1 8.389 ppm2 0.796 CV 1
ASSI { 293}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 27 and name HB1 ))
3.200 1.300 1.300 peak 293 spectrum 1 weight 0.10000E+01 volume 0.12987E-02 ppm1 8.390 ppm2 2.054 CV 1
ASSI { 294}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HN ))
2.600 0.900 0.900 peak 294 spectrum 1 weight 0.10000E+01 volume 0.26285E-02 ppm1 8.388 ppm2 7.505 CV 1
ASSI { 295}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 27 and name HN ))
4.600 2.700 1.400 peak 295 spectrum 1 weight 0.10000E+01 volume 0.30375E-03 ppm1 8.389 ppm2 6.361 CV 1
ASSI { 297}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 69 and name HG2%)
3.600 1.600 1.600 peak 297 spectrum 1 weight 0.10000E+01 volume 0.39453E-03 ppm1 7.507 ppm2 0.653 CV 1
ASSI { 300}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HD1 ))
3.500 1.500 1.500 peak 300 spectrum 1 weight 0.10000E+01 volume 0.11556E-02 ppm1 7.501 ppm2 1.551 CV 1
ASSI { 301}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HD2 ))
4.000 2.000 2.000 peak 301 spectrum 1 weight 0.10000E+01 volume 0.93572E-03 ppm1 7.504 ppm2 1.463 CV 1
ASSI { 302}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HG2 ))
2.400 0.700 0.700 peak 302 spectrum 1 weight 0.10000E+01 volume 0.35494E-02 ppm1 7.504 ppm2 1.350 CV 1
ASSI { 303}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HG1 ))
3.400 1.400 1.400 peak 303 spectrum 1 weight 0.10000E+01 volume 0.13059E-02 ppm1 7.504 ppm2 1.802 CV 1
ASSI { 304}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB1 ))
2.900 1.100 1.100 peak 304 spectrum 1 weight 0.10000E+01 volume 0.36944E-02 ppm1 7.503 ppm2 2.047 CV 1
ASSI { 305}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 69 and name HB ))
4.400 2.400 1.600 peak 305 spectrum 1 weight 0.10000E+01 volume 0.72856E-03 ppm1 7.501 ppm2 2.283 CV 1
ASSI { 308}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB1 ))
4.400 2.400 1.600 peak 308 spectrum 1 weight 0.10000E+01 volume 0.42801E-03 ppm1 7.505 ppm2 2.771 CV 1
ASSI { 309}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 28 and name HA ))
3.700 1.700 1.700 peak 309 spectrum 1 weight 0.10000E+01 volume 0.53841E-03 ppm1 7.507 ppm2 3.585 CV 1
ASSI { 310}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
3.200 1.300 1.300 peak 310 spectrum 1 weight 0.10000E+01 volume 0.12077E-02 ppm1 7.503 ppm2 4.485 CV 1
ASSI { 312}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 27 and name HN ))
4.100 2.100 1.900 peak 312 spectrum 1 weight 0.10000E+01 volume 0.61753E-03 ppm1 7.506 ppm2 6.360 CV 1
ASSI { 317}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 36 and name HD1%)
4.400 2.400 1.600 peak 317 spectrum 1 weight 0.10000E+01 volume 0.35709E-03 ppm1 10.161 ppm2 0.591 CV 1
ASSI { 321}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 34 and name HB2 ))
4.900 3.000 1.100 peak 321 spectrum 1 weight 0.10000E+01 volume 0.17822E-03 ppm1 10.157 ppm2 2.447 CV 1
ASSI { 324}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB1 ))
3.100 1.200 1.200 peak 324 spectrum 1 weight 0.10000E+01 volume 0.46847E-03 ppm1 10.163 ppm2 2.060 CV 1
ASSI { 325}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HG1 ))
5.400 3.700 0.600 peak 325 spectrum 1 weight 0.10000E+01 volume 0.18098E-03 ppm1 10.155 ppm2 1.798 CV 1
ASSI { 326}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HD1 ))
4.300 2.300 1.700 peak 326 spectrum 1 weight 0.10000E+01 volume 0.47421E-03 ppm1 10.164 ppm2 1.560 CV 1
ASSI { 327}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HD2 ))
4.200 2.200 1.800 peak 327 spectrum 1 weight 0.10000E+01 volume 0.47115E-03 ppm1 10.158 ppm2 1.464 CV 1
ASSI { 328}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB2 ))
3.300 1.300 1.300 peak 328 spectrum 1 weight 0.10000E+01 volume 0.93807E-03 ppm1 10.162 ppm2 1.372 CV 1
ASSI { 329}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HB2 ))
2.800 1.000 1.000 peak 329 spectrum 1 weight 0.10000E+01 volume 0.23122E-02 ppm1 10.161 ppm2 3.857 CV 1
ASSI { 330}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HB1 ))
2.900 1.000 1.000 peak 330 spectrum 1 weight 0.10000E+01 volume 0.14287E-02 ppm1 10.161 ppm2 4.100 CV 1
ASSI { 332}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HA ))
3.100 1.200 1.200 peak 332 spectrum 1 weight 0.10000E+01 volume 0.61343E-03 ppm1 10.159 ppm2 4.915 CV 1
ASSI { 333}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 35 and name HN ))
4.300 2.400 1.700 peak 333 spectrum 1 weight 0.10000E+01 volume 0.30919E-03 ppm1 10.159 ppm2 7.696 CV 1
ASSI { 338}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 32 and name HB2 ))
2.500 0.800 0.800 peak 338 spectrum 1 weight 0.10000E+01 volume 0.35634E-02 ppm1 8.196 ppm2 3.138 CV 1
OR { 338}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 32 and name HB1 ))
ASSI { 339}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HB1 ))
2.800 1.000 1.000 peak 339 spectrum 1 weight 0.10000E+01 volume 0.21015E-02 ppm1 8.196 ppm2 4.092 CV 1
ASSI { 340}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HA ))
2.500 0.800 0.800 peak 340 spectrum 1 weight 0.10000E+01 volume 0.35641E-02 ppm1 8.195 ppm2 4.921 CV 1
ASSI { 341}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 68 and name HA ))
3.200 1.300 1.300 peak 341 spectrum 1 weight 0.10000E+01 volume 0.18538E-02 ppm1 8.196 ppm2 5.255 CV 1
ASSI { 342}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 68 and name HG2%)
4.600 2.700 1.400 peak 342 spectrum 1 weight 0.10000E+01 volume 0.54838E-03 ppm1 8.196 ppm2 1.062 CV 1
ASSI { 343}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 36 and name HD1%)
5.400 3.600 0.600 peak 343 spectrum 1 weight 0.10000E+01 volume 0.22228E-03 ppm1 8.196 ppm2 0.581 CV 1
ASSI { 344}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 33 and name HN ))
2.700 0.900 0.900 peak 344 spectrum 1 weight 0.10000E+01 volume 0.12573E-02 ppm1 8.194 ppm2 8.615 CV 1
ASSI { 345}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 32 and name HD% )
2.600 0.900 0.900 peak 345 spectrum 1 weight 0.10000E+01 volume 0.26054E-02 ppm1 8.195 ppm2 7.186 CV 1
ASSI { 346}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 32 and name HE% )
5.000 3.100 1.000 peak 346 spectrum 1 weight 0.10000E+01 volume 0.25341E-03 ppm1 8.195 ppm2 6.993 CV 1
ASSI { 347}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 33 and name HG2%)
2.700 0.900 0.900 peak 347 spectrum 1 weight 0.10000E+01 volume 0.29287E-02 ppm1 8.616 ppm2 1.266 CV 1
ASSI { 348}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HB2 ))
2.900 1.000 1.000 peak 348 spectrum 1 weight 0.10000E+01 volume 0.30273E-02 ppm1 8.616 ppm2 3.136 CV 1
OR { 348}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HB1 ))
ASSI { 349}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB ))
3.100 1.200 1.200 peak 349 spectrum 1 weight 0.10000E+01 volume 0.16232E-02 ppm1 8.615 ppm2 4.193 CV 1
ASSI { 355}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 32 and name HD% )
4.900 3.000 1.100 peak 355 spectrum 1 weight 0.10000E+01 volume 0.32609E-03 ppm1 8.615 ppm2 7.182 CV 1
ASSI { 356}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HB2 ))
3.000 1.100 1.100 peak 356 spectrum 1 weight 0.10000E+01 volume 0.98502E-03 ppm1 7.976 ppm2 2.436 CV 1
ASSI { 357}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HB1 ))
3.900 1.900 1.900 peak 357 spectrum 1 weight 0.10000E+01 volume 0.65908E-03 ppm1 7.966 ppm2 2.772 CV 1
ASSI { 359}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HA ))
3.300 1.300 1.300 peak 359 spectrum 1 weight 0.10000E+01 volume 0.89710E-03 ppm1 7.974 ppm2 4.611 CV 1
ASSI { 360}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HN ))
2.600 0.900 0.900 peak 360 spectrum 1 weight 0.10000E+01 volume 0.12006E-02 ppm1 7.971 ppm2 8.617 CV 1
ASSI { 363}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 30 and name HA ))
3.800 1.800 1.800 peak 363 spectrum 1 weight 0.10000E+01 volume 0.13753E-02 ppm1 7.704 ppm2 4.383 CV 1
ASSI { 366}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HB1 ))
3.600 1.600 1.600 peak 366 spectrum 1 weight 0.10000E+01 volume 0.10822E-02 ppm1 7.712 ppm2 3.575 CV 1
ASSI { 367}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 76 and name HA ))
3.400 1.400 1.400 peak 367 spectrum 1 weight 0.10000E+01 volume 0.70360E-03 ppm1 7.711 ppm2 3.494 CV 1
ASSI { 372}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 36 and name HN ))
2.000 0.500 0.500 peak 372 spectrum 1 weight 0.10000E+01 volume 0.44740E-02 ppm1 7.700 ppm2 7.464 CV 1
ASSI { 373}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HN ))
2.700 0.900 0.900 peak 373 spectrum 1 weight 0.10000E+01 volume 0.22337E-02 ppm1 7.705 ppm2 8.259 CV 1
ASSI { 374}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HN ))
2.600 0.900 0.900 peak 374 spectrum 1 weight 0.10000E+01 volume 0.14121E-02 ppm1 7.702 ppm2 7.988 CV 1
ASSI { 381}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HB2 ))
2.600 0.800 0.800 peak 381 spectrum 1 weight 0.10000E+01 volume 0.14214E-02 ppm1 7.462 ppm2 1.599 CV 1
ASSI { 382}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HG ))
2.600 0.800 0.800 peak 382 spectrum 1 weight 0.10000E+01 volume 0.18840E-02 ppm1 7.461 ppm2 1.446 CV 1
ASSI { 388}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HB1 ))
3.300 1.400 1.400 peak 388 spectrum 1 weight 0.10000E+01 volume 0.20747E-02 ppm1 7.462 ppm2 2.275 CV 1
ASSI { 389}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HB1 ))
3.200 1.300 1.300 peak 389 spectrum 1 weight 0.10000E+01 volume 0.14849E-02 ppm1 7.459 ppm2 3.038 CV 1
ASSI { 390}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 33 and name HB ))
5.500 3.800 0.500 peak 390 spectrum 1 weight 0.10000E+01 volume 0.12762E-03 ppm1 7.461 ppm2 4.188 CV 1
ASSI { 393}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HA ))
2.700 0.900 0.900 peak 393 spectrum 1 weight 0.10000E+01 volume 0.21088E-02 ppm1 7.463 ppm2 4.377 CV 1
ASSI { 394}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HA ))
3.900 1.900 1.900 peak 394 spectrum 1 weight 0.10000E+01 volume 0.64023E-03 ppm1 7.461 ppm2 5.007 CV 1
ASSI { 395}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 32 and name HN ))
4.500 2.500 1.500 peak 395 spectrum 1 weight 0.10000E+01 volume 0.39199E-03 ppm1 7.457 ppm2 8.197 CV 1
ASSI { 396}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 38 and name HN ))
4.300 2.300 1.700 peak 396 spectrum 1 weight 0.10000E+01 volume 0.52945E-03 ppm1 7.459 ppm2 8.030 CV 1
ASSI { 399}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
2.900 1.000 1.000 peak 399 spectrum 1 weight 0.10000E+01 volume 0.14366E-02 ppm1 7.336 ppm2 2.441 CV 1
ASSI { 400}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HB1 ))
2.500 0.800 0.800 peak 400 spectrum 1 weight 0.10000E+01 volume 0.75646E-03 ppm1 7.337 ppm2 2.279 CV 1
ASSI { 401}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB1 ))
3.200 1.300 1.300 peak 401 spectrum 1 weight 0.10000E+01 volume 0.12318E-02 ppm1 7.335 ppm2 3.082 CV 1
ASSI { 402}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HB2 ))
4.300 2.300 1.700 peak 402 spectrum 1 weight 0.10000E+01 volume 0.42399E-03 ppm1 7.332 ppm2 1.594 CV 1
ASSI { 403}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 21 and name HG12))
4.100 2.100 1.900 peak 403 spectrum 1 weight 0.10000E+01 volume 0.26751E-03 ppm1 7.332 ppm2 1.278 CV 1
OR { 403}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 21 and name HG11))
ASSI { 405}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 36 and name HD1%)
5.500 3.700 0.500 peak 405 spectrum 1 weight 0.10000E+01 volume 0.27249E-03 ppm1 7.333 ppm2 0.585 CV 1
ASSI { 406}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 38 and name HG1%)
4.500 2.500 1.500 peak 406 spectrum 1 weight 0.10000E+01 volume 0.36040E-03 ppm1 7.342 ppm2 0.936 CV 1
OR { 406}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 38 and name HG2%)
ASSI { 407}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 38 and name HN ))
2.500 0.800 0.800 peak 407 spectrum 1 weight 0.10000E+01 volume 0.23137E-02 ppm1 7.337 ppm2 8.029 CV 1
ASSI { 408}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB ))
2.600 0.900 0.900 peak 408 spectrum 1 weight 0.10000E+01 volume 0.36368E-02 ppm1 8.027 ppm2 1.874 CV 1
ASSI { 409}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 33 and name HA ))
3.000 1.100 1.100 peak 409 spectrum 1 weight 0.10000E+01 volume 0.17623E-02 ppm1 8.025 ppm2 4.513 CV 1
ASSI { 411}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HA ))
3.000 1.200 1.200 peak 411 spectrum 1 weight 0.10000E+01 volume 0.12563E-02 ppm1 8.025 ppm2 3.948 CV 1
ASSI { 412}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 38 and name HG1%)
2.600 0.900 0.900 peak 412 spectrum 1 weight 0.10000E+01 volume 0.40947E-02 ppm1 8.027 ppm2 0.942 CV 1
OR { 412}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 38 and name HG2%)
ASSI { 413}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB2 ))
4.600 2.600 1.400 peak 413 spectrum 1 weight 0.10000E+01 volume 0.28578E-03 ppm1 8.029 ppm2 2.450 CV 1
ASSI { 414}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 36 and name HB1 ))
3.800 1.800 1.800 peak 414 spectrum 1 weight 0.10000E+01 volume 0.53586E-03 ppm1 8.024 ppm2 2.281 CV 1
ASSI { 418}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB1 ))
3.200 1.300 1.300 peak 418 spectrum 1 weight 0.10000E+01 volume 0.39697E-02 ppm1 8.123 ppm2 1.888 CV 1
ASSI { 419}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HG ))
3.100 1.200 1.200 peak 419 spectrum 1 weight 0.10000E+01 volume 0.24199E-02 ppm1 8.122 ppm2 1.728 CV 1
ASSI { 420}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB2 ))
2.600 0.800 0.800 peak 420 spectrum 1 weight 0.10000E+01 volume 0.21356E-02 ppm1 8.124 ppm2 1.622 CV 1
ASSI { 421}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 39 and name HB1 ))
3.700 1.700 1.700 peak 421 spectrum 1 weight 0.10000E+01 volume 0.50235E-03 ppm1 8.123 ppm2 3.092 CV 1
ASSI { 422}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 39 and name HB2 ))
3.900 1.900 1.900 peak 422 spectrum 1 weight 0.10000E+01 volume 0.51198E-03 ppm1 8.126 ppm2 2.755 CV 1
ASSI { 424}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HA ))
2.700 0.900 0.900 peak 424 spectrum 1 weight 0.10000E+01 volume 0.26985E-02 ppm1 8.123 ppm2 4.306 CV 1
ASSI { 425}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB1 ))
3.100 1.200 1.200 peak 425 spectrum 1 weight 0.10000E+01 volume 0.15983E-02 ppm1 8.126 ppm2 4.148 CV 1
OR { 425}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HA ))
OR { 425}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 426}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HN ))
2.400 0.700 0.700 peak 426 spectrum 1 weight 0.10000E+01 volume 0.40615E-02 ppm1 8.122 ppm2 8.388 CV 1
ASSI { 429}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 41 and name HD1%)
3.600 1.600 1.600 peak 429 spectrum 1 weight 0.10000E+01 volume 0.82314E-03 ppm1 8.124 ppm2 0.896 CV 1
ASSI { 430}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 41 and name HD2%)
3.800 1.800 1.800 peak 430 spectrum 1 weight 0.10000E+01 volume 0.70913E-03 ppm1 8.121 ppm2 0.971 CV 1
ASSI { 432}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HG ))
3.100 3.100 2.900 peak 432 spectrum 1 weight 0.10000E+01 volume 0.44686E-03 ppm1 8.385 ppm2 1.726 CV 1
ASSI { 433}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB2 ))
3.200 1.300 1.300 peak 433 spectrum 1 weight 0.10000E+01 volume 0.98146E-03 ppm1 8.386 ppm2 1.626 CV 1
ASSI { 434}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB1 ))
3.300 1.400 1.400 peak 434 spectrum 1 weight 0.10000E+01 volume 0.18254E-02 ppm1 8.386 ppm2 1.885 CV 1
ASSI { 435}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 39 and name HB1 ))
4.200 2.200 1.800 peak 435 spectrum 1 weight 0.10000E+01 volume 0.31197E-03 ppm1 8.385 ppm2 3.072 CV 1
ASSI { 436}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB2 ))
2.900 1.000 1.000 peak 436 spectrum 1 weight 0.10000E+01 volume 0.12281E-02 ppm1 8.386 ppm2 3.666 CV 1
ASSI { 437}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB1 ))
3.300 1.300 1.300 peak 437 spectrum 1 weight 0.10000E+01 volume 0.23466E-02 ppm1 8.385 ppm2 3.971 CV 1
ASSI { 439}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 40 and name HA ))
3.800 1.800 1.800 peak 439 spectrum 1 weight 0.10000E+01 volume 0.36827E-03 ppm1 8.388 ppm2 4.149 CV 1
OR { 439}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 40 and name HB1 ))
ASSI { 440}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
2.800 1.000 1.000 peak 440 spectrum 1 weight 0.10000E+01 volume 0.27477E-02 ppm1 8.386 ppm2 4.299 CV 1
ASSI { 441}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 44 and name HN ))
4.900 3.000 1.100 peak 441 spectrum 1 weight 0.10000E+01 volume 0.14015E-03 ppm1 8.382 ppm2 7.301 CV 1
ASSI { 443}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
2.600 0.800 0.800 peak 443 spectrum 1 weight 0.10000E+01 volume 0.31295E-02 ppm1 8.310 ppm2 3.949 CV 1
ASSI { 445}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HA ))
3.500 1.500 1.500 peak 445 spectrum 1 weight 0.10000E+01 volume 0.95989E-03 ppm1 8.310 ppm2 4.300 CV 1
ASSI { 446}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HB2 ))
3.500 1.600 1.600 peak 446 spectrum 1 weight 0.10000E+01 volume 0.54813E-03 ppm1 8.308 ppm2 3.665 CV 1
ASSI { 447}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB1 ))
2.700 0.900 0.900 peak 447 spectrum 1 weight 0.10000E+01 volume 0.28132E-02 ppm1 8.310 ppm2 2.092 CV 1
ASSI { 448}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB2 ))
2.500 0.800 0.800 peak 448 spectrum 1 weight 0.10000E+01 volume 0.19756E-02 ppm1 8.311 ppm2 1.930 CV 1
ASSI { 450}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 44 and name HG2%)
4.500 2.500 1.500 peak 450 spectrum 1 weight 0.10000E+01 volume 0.46009E-03 ppm1 8.310 ppm2 1.115 CV 1
ASSI { 452}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HN ))
2.600 0.800 0.800 peak 452 spectrum 1 weight 0.10000E+01 volume 0.21857E-02 ppm1 8.311 ppm2 7.296 CV 1
ASSI { 454}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HA ))
3.200 1.300 1.300 peak 454 spectrum 1 weight 0.10000E+01 volume 0.88902E-03 ppm1 7.295 ppm2 3.947 CV 1
ASSI { 455}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 42 and name HA ))
3.200 1.300 1.300 peak 455 spectrum 1 weight 0.10000E+01 volume 0.97802E-03 ppm1 7.298 ppm2 4.296 CV 1
ASSI { 456}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HG2 ))
3.700 1.700 1.700 peak 456 spectrum 1 weight 0.10000E+01 volume 0.83001E-03 ppm1 7.296 ppm2 2.295 CV 1
ASSI { 457}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB ))
2.400 0.700 0.700 peak 457 spectrum 1 weight 0.10000E+01 volume 0.48300E-02 ppm1 7.296 ppm2 2.206 CV 1
ASSI { 458}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HB1 ))
3.000 1.100 1.100 peak 458 spectrum 1 weight 0.10000E+01 volume 0.96881E-03 ppm1 7.296 ppm2 2.092 CV 1
ASSI { 459}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HB2 ))
3.700 1.700 1.700 peak 459 spectrum 1 weight 0.10000E+01 volume 0.95553E-03 ppm1 7.295 ppm2 1.926 CV 1
ASSI { 463}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 47 and name HG1%)
4.300 2.400 1.700 peak 463 spectrum 1 weight 0.10000E+01 volume 0.50696E-03 ppm1 7.298 ppm2 0.891 CV 1
OR { 463}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 47 and name HG2%)
ASSI { 465}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 45 and name HN ))
2.400 0.700 0.700 peak 465 spectrum 1 weight 0.10000E+01 volume 0.32520E-02 ppm1 7.296 ppm2 7.001 CV 1
ASSI { 469}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HA ))
2.800 1.000 1.000 peak 469 spectrum 1 weight 0.10000E+01 volume 0.23031E-02 ppm1 6.996 ppm2 4.062 CV 1
ASSI { 470}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HG1 ))
2.800 1.000 1.000 peak 470 spectrum 1 weight 0.10000E+01 volume 0.22147E-02 ppm1 6.997 ppm2 2.440 CV 1
ASSI { 471}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 42 and name HA ))
3.200 1.300 1.300 peak 471 spectrum 1 weight 0.10000E+01 volume 0.10509E-02 ppm1 6.995 ppm2 4.300 CV 1
ASSI { 472}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
3.300 1.300 1.300 peak 472 spectrum 1 weight 0.10000E+01 volume 0.94845E-03 ppm1 6.994 ppm2 3.586 CV 1
ASSI { 476}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HN ))
2.400 0.700 0.700 peak 476 spectrum 1 weight 0.10000E+01 volume 0.37500E-02 ppm1 6.995 ppm2 8.047 CV 1
ASSI { 478}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 44 and name HG1%)
3.400 1.500 1.500 peak 478 spectrum 1 weight 0.10000E+01 volume 0.19790E-02 ppm1 6.996 ppm2 0.970 CV 1
ASSI { 480}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HB ))
2.200 0.600 0.600 peak 480 spectrum 1 weight 0.10000E+01 volume 0.56505E-02 ppm1 8.049 ppm2 2.274 CV 1
ASSI { 483}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 44 and name HB ))
2.700 2.700 3.300 peak 483 spectrum 1 weight 0.10000E+01 volume 0.97890E-03 ppm1 8.049 ppm2 2.181 CV 1
ASSI { 495}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 44 and name HA ))
4.500 2.600 1.500 peak 495 spectrum 1 weight 0.10000E+01 volume 0.48258E-03 ppm1 7.817 ppm2 3.585 CV 1
ASSI { 496}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 45 and name HA ))
3.400 1.400 1.400 peak 496 spectrum 1 weight 0.10000E+01 volume 0.90569E-03 ppm1 7.815 ppm2 4.054 CV 1
ASSI { 498}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HB ))
3.200 1.300 1.300 peak 498 spectrum 1 weight 0.10000E+01 volume 0.28716E-02 ppm1 7.814 ppm2 2.210 CV 1
ASSI { 499}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HB ))
2.400 0.700 0.700 peak 499 spectrum 1 weight 0.10000E+01 volume 0.39753E-02 ppm1 7.815 ppm2 2.060 CV 1
ASSI { 502}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 47 and name HG1%)
2.900 1.000 1.000 peak 502 spectrum 1 weight 0.10000E+01 volume 0.13234E-02 ppm1 7.814 ppm2 0.861 CV 1
OR { 502}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 47 and name HG2%)
ASSI { 504}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HA ))
3.300 1.400 1.400 peak 504 spectrum 1 weight 0.10000E+01 volume 0.10859E-02 ppm1 7.911 ppm2 3.929 CV 1
ASSI { 506}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 46 and name HA ))
3.200 1.200 1.200 peak 506 spectrum 1 weight 0.10000E+01 volume 0.84018E-03 ppm1 7.910 ppm2 3.421 CV 1
ASSI { 507}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HB ))
3.200 1.200 1.200 peak 507 spectrum 1 weight 0.10000E+01 volume 0.28942E-02 ppm1 7.909 ppm2 2.058 CV 1
ASSI { 508}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 49 and name HB% )
2.200 0.600 0.600 peak 508 spectrum 1 weight 0.10000E+01 volume 0.73309E-02 ppm1 7.909 ppm2 1.521 CV 1
ASSI { 509}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 48 and name HG2%)
3.500 1.500 1.500 peak 509 spectrum 1 weight 0.10000E+01 volume 0.14816E-02 ppm1 7.910 ppm2 1.106 CV 1
ASSI { 510}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 48 and name HG1%)
3.000 1.100 1.100 peak 510 spectrum 1 weight 0.10000E+01 volume 0.16345E-02 ppm1 7.909 ppm2 1.003 CV 1
ASSI { 511}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 14 and name HD1%)
4.200 2.200 1.800 peak 511 spectrum 1 weight 0.10000E+01 volume 0.47257E-03 ppm1 7.904 ppm2 0.759 CV 1
ASSI { 512}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HN ))
2.400 0.700 0.700 peak 512 spectrum 1 weight 0.10000E+01 volume 0.30972E-02 ppm1 7.910 ppm2 8.772 CV 1
ASSI { 515}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HA ))
2.700 0.900 0.900 peak 515 spectrum 1 weight 0.10000E+01 volume 0.23101E-02 ppm1 8.771 ppm2 3.947 CV 1
ASSI { 517}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 14 and name HD1%)
3.300 1.400 1.400 peak 517 spectrum 1 weight 0.10000E+01 volume 0.12556E-02 ppm1 8.772 ppm2 0.729 CV 1
ASSI { 519}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 48 and name HG2%)
2.800 2.800 3.200 peak 519 spectrum 1 weight 0.10000E+01 volume 0.90716E-03 ppm1 8.771 ppm2 1.064 CV 1
ASSI { 523}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 47 and name HA ))
3.200 1.300 1.300 peak 523 spectrum 1 weight 0.10000E+01 volume 0.10316E-02 ppm1 8.771 ppm2 3.314 CV 1
ASSI { 525}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HA ))
2.800 1.000 1.000 peak 525 spectrum 1 weight 0.10000E+01 volume 0.18687E-02 ppm1 8.839 ppm2 4.181 CV 1
ASSI { 526}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HA ))
3.000 1.100 1.100 peak 526 spectrum 1 weight 0.10000E+01 volume 0.16603E-02 ppm1 8.840 ppm2 3.938 CV 1
ASSI { 527}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HG1 ))
2.300 0.600 0.600 peak 527 spectrum 1 weight 0.10000E+01 volume 0.28970E-02 ppm1 8.838 ppm2 2.817 CV 1
ASSI { 528}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HB1 ))
3.400 1.400 1.400 peak 528 spectrum 1 weight 0.10000E+01 volume 0.29690E-02 ppm1 8.837 ppm2 2.460 CV 1
ASSI { 529}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HG2 ))
3.800 1.800 1.800 peak 529 spectrum 1 weight 0.10000E+01 volume 0.13252E-02 ppm1 8.836 ppm2 2.290 CV 1
ASSI { 531}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 50 and name HB% )
2.800 1.000 1.000 peak 531 spectrum 1 weight 0.10000E+01 volume 0.26663E-02 ppm1 8.839 ppm2 1.496 CV 1
ASSI { 533}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 58 and name HD1%)
4.200 2.200 1.800 peak 533 spectrum 1 weight 0.10000E+01 volume 0.45460E-03 ppm1 8.840 ppm2 0.589 CV 1
ASSI { 534}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HN ))
2.400 0.700 0.700 peak 534 spectrum 1 weight 0.10000E+01 volume 0.25333E-02 ppm1 8.838 ppm2 7.748 CV 1
ASSI { 536}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 53 and name HN ))
2.400 0.700 0.700 peak 536 spectrum 1 weight 0.10000E+01 volume 0.22994E-02 ppm1 7.747 ppm2 8.197 CV 1
ASSI { 538}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HG1 ))
3.200 1.300 1.300 peak 538 spectrum 1 weight 0.10000E+01 volume 0.27425E-02 ppm1 7.747 ppm2 2.449 CV 1
ASSI { 539}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HB1 ))
2.500 0.800 0.800 peak 539 spectrum 1 weight 0.10000E+01 volume 0.41514E-02 ppm1 7.747 ppm2 2.128 CV 1
ASSI { 540}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HB2 ))
3.400 1.500 1.500 peak 540 spectrum 1 weight 0.10000E+01 volume 0.27615E-02 ppm1 7.747 ppm2 2.040 CV 1
ASSI { 541}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HG2 ))
2.600 0.800 0.800 peak 541 spectrum 1 weight 0.10000E+01 volume 0.10215E-02 ppm1 7.748 ppm2 2.230 CV 1
ASSI { 542}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 50 and name HB% )
4.200 2.200 1.800 peak 542 spectrum 1 weight 0.10000E+01 volume 0.66021E-03 ppm1 7.745 ppm2 1.491 CV 1
ASSI { 543}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 49 and name HA ))
3.600 1.600 1.600 peak 543 spectrum 1 weight 0.10000E+01 volume 0.11791E-02 ppm1 7.746 ppm2 4.216 CV 1
ASSI { 546}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 49 and name HA ))
4.300 2.300 1.700 peak 546 spectrum 1 weight 0.10000E+01 volume 0.58076E-03 ppm1 8.197 ppm2 4.227 CV 1
ASSI { 550}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB1 ))
2.800 1.000 1.000 peak 550 spectrum 1 weight 0.10000E+01 volume 0.37847E-02 ppm1 8.196 ppm2 1.619 CV 1
ASSI { 551}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB2 ))
2.300 0.700 0.700 peak 551 spectrum 1 weight 0.10000E+01 volume 0.32178E-02 ppm1 8.196 ppm2 1.088 CV 1
ASSI { 553}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 14 and name HD1%)
4.200 2.200 1.800 peak 553 spectrum 1 weight 0.10000E+01 volume 0.61720E-03 ppm1 8.195 ppm2 0.737 CV 1
ASSI { 555}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HB1 ))
3.700 1.700 1.700 peak 555 spectrum 1 weight 0.10000E+01 volume 0.13664E-02 ppm1 8.134 ppm2 3.433 CV 1
ASSI { 556}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HB2 ))
2.500 0.800 0.800 peak 556 spectrum 1 weight 0.10000E+01 volume 0.22233E-02 ppm1 8.134 ppm2 2.739 CV 1
ASSI { 557}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HB1 ))
3.300 1.300 1.300 peak 557 spectrum 1 weight 0.10000E+01 volume 0.90820E-03 ppm1 8.138 ppm2 1.613 CV 1
ASSI { 558}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HB2 ))
3.000 1.100 1.100 peak 558 spectrum 1 weight 0.10000E+01 volume 0.18204E-02 ppm1 8.136 ppm2 1.089 CV 1
ASSI { 561}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 50 and name HB% )
4.500 2.600 1.500 peak 561 spectrum 1 weight 0.10000E+01 volume 0.34724E-03 ppm1 8.133 ppm2 1.484 CV 1
ASSI { 562}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HA ))
3.300 1.400 1.400 peak 562 spectrum 1 weight 0.10000E+01 volume 0.10093E-02 ppm1 8.135 ppm2 3.913 CV 1
ASSI { 563}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 55 and name HA ))
5.300 3.500 0.700 peak 563 spectrum 1 weight 0.10000E+01 volume 0.48363E-03 ppm1 8.134 ppm2 4.485 CV 1
ASSI { 564}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HA ))
3.000 1.100 1.100 peak 564 spectrum 1 weight 0.10000E+01 volume 0.15815E-02 ppm1 8.134 ppm2 4.841 CV 1
ASSI { 565}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HA ))
2.700 0.900 0.900 peak 565 spectrum 1 weight 0.10000E+01 volume 0.37503E-02 ppm1 7.824 ppm2 4.483 CV 1
ASSI { 566}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 51 and name HA ))
2.800 1.000 1.000 peak 566 spectrum 1 weight 0.10000E+01 volume 0.22048E-02 ppm1 7.824 ppm2 4.180 CV 1
ASSI { 568}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HB ))
3.400 1.400 1.400 peak 568 spectrum 1 weight 0.10000E+01 volume 0.91922E-03 ppm1 7.825 ppm2 2.005 CV 1
ASSI { 570}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB ))
2.400 0.700 0.700 peak 570 spectrum 1 weight 0.10000E+01 volume 0.39497E-02 ppm1 7.600 ppm2 1.988 CV 1
ASSI { 574}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HB2 ))
3.400 1.400 1.400 peak 574 spectrum 1 weight 0.10000E+01 volume 0.12384E-02 ppm1 7.601 ppm2 2.416 CV 1
OR { 574}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HB1 ))
ASSI { 576}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 64 and name HN ))
2.700 0.900 0.900 peak 576 spectrum 1 weight 0.10000E+01 volume 0.20706E-02 ppm1 7.598 ppm2 7.039 CV 1
ASSI { 577}
(( segid " " and resid 66 and name HN ))
( segid " " and resid 66 and name HD2%)
3.800 1.800 1.800 peak 577 spectrum 1 weight 0.10000E+01 volume 0.12750E-02 ppm1 7.712 ppm2 0.606 CV 1
ASSI { 579}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HB2 ))
2.700 0.900 0.900 peak 579 spectrum 1 weight 0.10000E+01 volume 0.15231E-02 ppm1 7.715 ppm2 0.920 CV 1
ASSI { 580}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HG ))
2.300 0.700 0.700 peak 580 spectrum 1 weight 0.10000E+01 volume 0.35898E-02 ppm1 7.714 ppm2 1.794 CV 1
ASSI { 581}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HB1 ))
3.200 1.300 1.300 peak 581 spectrum 1 weight 0.10000E+01 volume 0.26341E-02 ppm1 7.713 ppm2 2.196 CV 1
ASSI { 583}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HB2 ))
4.400 2.400 1.600 peak 583 spectrum 1 weight 0.10000E+01 volume 0.42583E-03 ppm1 7.712 ppm2 2.724 CV 1
ASSI { 584}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 63 and name HA ))
3.400 1.400 1.400 peak 584 spectrum 1 weight 0.10000E+01 volume 0.88944E-03 ppm1 7.714 ppm2 3.232 CV 1
ASSI { 586}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 64 and name HA ))
3.400 1.500 1.500 peak 586 spectrum 1 weight 0.10000E+01 volume 0.74817E-03 ppm1 7.713 ppm2 4.049 CV 1
ASSI { 587}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HA ))
2.900 1.000 1.000 peak 587 spectrum 1 weight 0.10000E+01 volume 0.18475E-02 ppm1 7.713 ppm2 4.462 CV 1
ASSI { 588}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HA ))
3.800 1.800 1.800 peak 588 spectrum 1 weight 0.10000E+01 volume 0.58687E-03 ppm1 7.713 ppm2 4.876 CV 1
ASSI { 590}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HN ))
4.400 2.400 1.600 peak 590 spectrum 1 weight 0.10000E+01 volume 0.64069E-03 ppm1 7.712 ppm2 8.214 CV 1
ASSI { 592}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HB ))
2.500 0.800 0.800 peak 592 spectrum 1 weight 0.10000E+01 volume 0.31767E-02 ppm1 9.869 ppm2 1.689 CV 1
ASSI { 593}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HG11))
2.600 0.800 0.800 peak 593 spectrum 1 weight 0.10000E+01 volume 0.17106E-02 ppm1 9.866 ppm2 1.539 CV 1
ASSI { 595}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 51 and name HG2 ))
2.700 0.900 0.900 peak 595 spectrum 1 weight 0.10000E+01 volume 0.10999E-02 ppm1 9.867 ppm2 2.296 CV 1
ASSI { 596}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HG12))
3.900 1.900 1.900 peak 596 spectrum 1 weight 0.10000E+01 volume 0.11626E-02 ppm1 9.867 ppm2 0.854 CV 1
ASSI { 599}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 59 and name HD2 ))
4.300 2.300 1.700 peak 599 spectrum 1 weight 0.10000E+01 volume 0.44870E-03 ppm1 9.867 ppm2 3.815 CV 1
OR { 599}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 59 and name HD1 ))
ASSI { 600}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 51 and name HG1 ))
5.000 3.200 1.000 peak 600 spectrum 1 weight 0.10000E+01 volume 0.40076E-03 ppm1 9.871 ppm2 2.823 CV 1
ASSI { 603}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 71 and name HA ))
2.800 1.000 1.000 peak 603 spectrum 1 weight 0.10000E+01 volume 0.24096E-02 ppm1 8.343 ppm2 4.489 CV 1
ASSI { 605}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HA1 ))
3.000 1.100 1.100 peak 605 spectrum 1 weight 0.10000E+01 volume 0.13309E-02 ppm1 8.341 ppm2 4.007 CV 1
ASSI { 606}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 68 and name HB ))
4.100 2.100 1.900 peak 606 spectrum 1 weight 0.10000E+01 volume 0.46579E-03 ppm1 8.342 ppm2 4.338 CV 1
ASSI { 607}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 71 and name HB1 ))
3.000 1.100 1.100 peak 607 spectrum 1 weight 0.10000E+01 volume 0.21414E-02 ppm1 8.343 ppm2 3.114 CV 1
ASSI { 608}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 71 and name HB2 ))
2.900 1.000 1.000 peak 608 spectrum 1 weight 0.10000E+01 volume 0.13102E-02 ppm1 8.344 ppm2 2.909 CV 1
ASSI { 609}
(( segid " " and resid 71 and name HN ))
( segid " " and resid 72 and name HB% )
4.600 2.700 1.400 peak 609 spectrum 1 weight 0.10000E+01 volume 0.52836E-03 ppm1 8.345 ppm2 1.605 CV 1
ASSI { 611}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HN ))
2.700 0.900 0.900 peak 611 spectrum 1 weight 0.10000E+01 volume 0.17636E-02 ppm1 8.344 ppm2 9.414 CV 1
ASSI { 614}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HB ))
2.600 0.800 0.800 peak 614 spectrum 1 weight 0.10000E+01 volume 0.17033E-02 ppm1 7.042 ppm2 1.988 CV 1
ASSI { 616}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 63 and name HG1%)
3.100 1.200 1.200 peak 616 spectrum 1 weight 0.10000E+01 volume 0.14669E-02 ppm1 7.040 ppm2 0.822 CV 1
ASSI { 617}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HG1 ))
2.400 0.700 0.700 peak 617 spectrum 1 weight 0.10000E+01 volume 0.35623E-02 ppm1 7.041 ppm2 1.384 CV 1
OR { 617}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HG2 ))
ASSI { 620}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HN ))
2.600 0.800 0.800 peak 620 spectrum 1 weight 0.10000E+01 volume 0.21361E-02 ppm1 7.041 ppm2 7.280 CV 1
ASSI { 622}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HA ))
3.400 1.400 1.400 peak 622 spectrum 1 weight 0.10000E+01 volume 0.93287E-03 ppm1 7.272 ppm2 4.880 CV 1
ASSI { 623}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HB2 ))
2.600 0.900 0.900 peak 623 spectrum 1 weight 0.10000E+01 volume 0.25900E-02 ppm1 7.277 ppm2 2.728 CV 1
ASSI { 626}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HG1 ))
3.800 1.800 1.800 peak 626 spectrum 1 weight 0.10000E+01 volume 0.87926E-03 ppm1 7.277 ppm2 1.388 CV 1
ASSI { 629}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 66 and name HN ))
2.400 0.700 0.700 peak 629 spectrum 1 weight 0.10000E+01 volume 0.40643E-02 ppm1 7.278 ppm2 7.714 CV 1
ASSI { 631}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HA ))
3.300 1.300 1.300 peak 631 spectrum 1 weight 0.10000E+01 volume 0.15752E-02 ppm1 8.574 ppm2 4.473 CV 1
ASSI { 633}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HN ))
2.300 0.600 0.600 peak 633 spectrum 1 weight 0.10000E+01 volume 0.41624E-02 ppm1 8.573 ppm2 8.208 CV 1
ASSI { 635}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 71 and name HB1 ))
2.800 1.000 1.000 peak 635 spectrum 1 weight 0.10000E+01 volume 0.24217E-02 ppm1 8.573 ppm2 3.112 CV 1
ASSI { 636}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB2 ))
2.900 1.100 1.100 peak 636 spectrum 1 weight 0.10000E+01 volume 0.20804E-02 ppm1 8.576 ppm2 2.044 CV 1
OR { 636}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB1 ))
ASSI { 638}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HB ))
3.800 1.800 1.800 peak 638 spectrum 1 weight 0.10000E+01 volume 0.57368E-03 ppm1 8.575 ppm2 4.351 CV 1
ASSI { 640}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HN ))
2.400 0.700 0.700 peak 640 spectrum 1 weight 0.10000E+01 volume 0.36231E-02 ppm1 7.820 ppm2 8.136 CV 1
ASSI { 641}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HB1 ))
3.900 1.900 1.900 peak 641 spectrum 1 weight 0.10000E+01 volume 0.10214E-02 ppm1 7.824 ppm2 3.256 CV 1
ASSI { 642}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HB2 ))
3.200 1.300 1.300 peak 642 spectrum 1 weight 0.10000E+01 volume 0.15339E-02 ppm1 7.823 ppm2 2.543 CV 1
ASSI { 645}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HB ))
2.100 0.500 0.500 peak 645 spectrum 1 weight 0.10000E+01 volume 0.37092E-02 ppm1 8.148 ppm2 4.355 CV 1
ASSI { 647}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 68 and name HB ))
2.800 1.000 1.000 peak 647 spectrum 1 weight 0.10000E+01 volume 0.17011E-02 ppm1 9.415 ppm2 4.355 CV 1
ASSI { 651}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 28 and name HA ))
3.400 1.400 1.400 peak 651 spectrum 1 weight 0.10000E+01 volume 0.20778E-02 ppm1 9.416 ppm2 3.584 CV 1
ASSI { 652}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HB ))
3.200 1.300 1.300 peak 652 spectrum 1 weight 0.10000E+01 volume 0.21532E-02 ppm1 9.416 ppm2 2.284 CV 1
ASSI { 655}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 68 and name HG2%)
3.100 1.200 1.200 peak 655 spectrum 1 weight 0.10000E+01 volume 0.45967E-03 ppm1 9.410 ppm2 1.055 CV 1
ASSI { 660}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HN ))
2.600 0.900 0.900 peak 660 spectrum 1 weight 0.10000E+01 volume 0.15269E-02 ppm1 9.414 ppm2 8.157 CV 1
ASSI { 663}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HA ))
2.300 0.600 0.600 peak 663 spectrum 1 weight 0.10000E+01 volume 0.62277E-02 ppm1 8.206 ppm2 4.466 CV 1
ASSI { 665}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 71 and name HB2 ))
3.300 1.400 1.400 peak 665 spectrum 1 weight 0.10000E+01 volume 0.14185E-02 ppm1 8.209 ppm2 2.902 CV 1
ASSI { 666}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 71 and name HB1 ))
2.900 1.100 1.100 peak 666 spectrum 1 weight 0.10000E+01 volume 0.13528E-02 ppm1 8.207 ppm2 3.110 CV 1
ASSI { 667}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB1 ))
2.800 1.000 1.000 peak 667 spectrum 1 weight 0.10000E+01 volume 0.44962E-02 ppm1 8.209 ppm2 2.043 CV 1
OR { 667}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 668}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HD2 ))
4.400 2.500 1.600 peak 668 spectrum 1 weight 0.10000E+01 volume 0.75118E-03 ppm1 8.205 ppm2 1.767 CV 1
OR { 668}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HD1 ))
ASSI { 669}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HG1 ))
2.900 1.100 1.100 peak 669 spectrum 1 weight 0.10000E+01 volume 0.16676E-02 ppm1 8.206 ppm2 1.559 CV 1
ASSI { 670}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HG2 ))
3.100 1.200 1.200 peak 670 spectrum 1 weight 0.10000E+01 volume 0.80597E-03 ppm1 8.210 ppm2 1.460 CV 1
ASSI { 671}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HB2 ))
3.800 1.800 1.800 peak 671 spectrum 1 weight 0.10000E+01 volume 0.66247E-03 ppm1 8.207 ppm2 0.922 CV 1
ASSI { 673}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HA ))
2.400 0.700 0.700 peak 673 spectrum 1 weight 0.10000E+01 volume 0.48053E-02 ppm1 8.637 ppm2 4.405 CV 1
ASSI { 676}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HB1 ))
3.600 1.600 1.600 peak 676 spectrum 1 weight 0.10000E+01 volume 0.94184E-03 ppm1 8.636 ppm2 2.390 CV 1
ASSI { 677}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HB2 ))
3.300 1.400 1.400 peak 677 spectrum 1 weight 0.10000E+01 volume 0.91645E-03 ppm1 8.632 ppm2 1.936 CV 1
ASSI { 682}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HB2 ))
3.700 1.700 1.700 peak 682 spectrum 1 weight 0.10000E+01 volume 0.10639E-02 ppm1 8.292 ppm2 2.139 CV 1
ASSI { 683}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HB1 ))
2.900 1.100 1.100 peak 683 spectrum 1 weight 0.10000E+01 volume 0.15951E-02 ppm1 8.292 ppm2 2.325 CV 1
ASSI { 684}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HG2 ))
4.300 2.300 1.700 peak 684 spectrum 1 weight 0.10000E+01 volume 0.62670E-03 ppm1 8.298 ppm2 2.574 CV 1
ASSI { 686}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HB2 ))
2.800 1.000 1.000 peak 686 spectrum 1 weight 0.10000E+01 volume 0.23862E-02 ppm1 7.884 ppm2 2.136 CV 1
ASSI { 687}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HB1 ))
3.300 1.400 1.400 peak 687 spectrum 1 weight 0.10000E+01 volume 0.20562E-02 ppm1 7.881 ppm2 2.332 CV 1
ASSI { 688}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HG2 ))
3.300 1.300 1.300 peak 688 spectrum 1 weight 0.10000E+01 volume 0.16815E-02 ppm1 7.884 ppm2 2.575 CV 1
ASSI { 689}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HG1 ))
2.600 0.800 0.800 peak 689 spectrum 1 weight 0.10000E+01 volume 0.29489E-02 ppm1 7.882 ppm2 2.702 CV 1
ASSI { 690}
(( segid " " and resid 80 and name HN ))
( segid " " and resid 56 and name HG2%)
3.400 1.400 1.400 peak 690 spectrum 1 weight 0.10000E+01 volume 0.71843E-03 ppm1 7.882 ppm2 0.941 CV 1
ASSI { 692}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HB1 ))
3.900 1.900 1.900 peak 692 spectrum 1 weight 0.10000E+01 volume 0.39236E-03 ppm1 7.886 ppm2 3.584 CV 1
ASSI { 693}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 77 and name HA ))
3.800 1.800 1.800 peak 693 spectrum 1 weight 0.10000E+01 volume 0.49892E-03 ppm1 7.883 ppm2 3.890 CV 1
ASSI { 695}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HA ))
3.700 1.700 1.700 peak 695 spectrum 1 weight 0.10000E+01 volume 0.66922E-03 ppm1 7.882 ppm2 4.627 CV 1
ASSI { 696}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HN ))
2.400 0.700 0.700 peak 696 spectrum 1 weight 0.10000E+01 volume 0.42340E-02 ppm1 7.882 ppm2 7.712 CV 1
ASSI { 698}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB1 ))
2.500 0.800 0.800 peak 698 spectrum 1 weight 0.10000E+01 volume 0.39552E-02 ppm1 7.481 ppm2 2.418 CV 1
OR { 698}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 699}
(( segid " " and resid 62 and name HN ))
( segid " " and resid 58 and name HG2%)
3.900 1.900 1.900 peak 699 spectrum 1 weight 0.10000E+01 volume 0.59952E-03 ppm1 7.482 ppm2 0.351 CV 1
ASSI { 702}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HA ))
4.600 2.700 1.400 peak 702 spectrum 1 weight 0.10000E+01 volume 0.53330E-03 ppm1 7.474 ppm2 3.225 CV 1
ASSI { 703}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 59 and name HD2 ))
4.100 2.100 1.900 peak 703 spectrum 1 weight 0.10000E+01 volume 0.30647E-03 ppm1 7.477 ppm2 3.818 CV 1
ASSI { 705}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HN ))
2.900 1.100 1.100 peak 705 spectrum 1 weight 0.10000E+01 volume 0.11967E-02 ppm1 7.482 ppm2 8.659 CV 1
ASSI { 707}
(( segid " " and resid 80 and name HE22))
(( segid " " and resid 77 and name HN ))
3.400 1.400 1.400 peak 707 spectrum 1 weight 0.10000E+01 volume 0.28085E-03 ppm1 7.727 ppm2 8.481 CV 1
ASSI { 708}
(( segid " " and resid 80 and name HE21))
(( segid " " and resid 77 and name HA ))
2.800 1.000 1.000 peak 708 spectrum 1 weight 0.10000E+01 volume 0.84178E-03 ppm1 7.634 ppm2 3.896 CV 1
ASSI { 709}
(( segid " " and resid 80 and name HE22))
(( segid " " and resid 77 and name HA ))
3.600 1.600 1.600 peak 709 spectrum 1 weight 0.10000E+01 volume 0.14209E-02 ppm1 7.734 ppm2 3.892 CV 1
ASSI { 710}
(( segid " " and resid 80 and name HE22))
(( segid " " and resid 80 and name HG1 ))
3.400 1.500 1.500 peak 710 spectrum 1 weight 0.10000E+01 volume 0.20159E-02 ppm1 7.732 ppm2 2.704 CV 1
ASSI { 711}
(( segid " " and resid 80 and name HE22))
(( segid " " and resid 80 and name HG2 ))
3.600 1.700 1.700 peak 711 spectrum 1 weight 0.10000E+01 volume 0.14676E-02 ppm1 7.732 ppm2 2.576 CV 1
ASSI { 712}
(( segid " " and resid 80 and name HE21))
(( segid " " and resid 80 and name HG2 ))
3.500 1.500 1.500 peak 712 spectrum 1 weight 0.10000E+01 volume 0.62176E-03 ppm1 7.635 ppm2 2.578 CV 1
ASSI { 713}
(( segid " " and resid 80 and name HE21))
(( segid " " and resid 80 and name HG1 ))
3.100 1.200 1.200 peak 713 spectrum 1 weight 0.10000E+01 volume 0.10095E-02 ppm1 7.635 ppm2 2.702 CV 1
ASSI { 715}
(( segid " " and resid 80 and name HE21))
( segid " " and resid 77 and name HD1%)
2.700 2.700 3.300 peak 715 spectrum 1 weight 0.10000E+01 volume 0.11548E-02 ppm1 7.633 ppm2 0.819 CV 1
OR { 715}
(( segid " " and resid 80 and name HE21))
( segid " " and resid 77 and name HD2%)
ASSI { 718}
(( segid " " and resid 80 and name HE22))
( segid " " and resid 77 and name HD1%)
2.700 2.700 3.300 peak 718 spectrum 1 weight 0.10000E+01 volume 0.10949E-02 ppm1 7.733 ppm2 0.817 CV 1
OR { 718}
(( segid " " and resid 80 and name HE22))
( segid " " and resid 77 and name HD2%)
ASSI { 719}
(( segid " " and resid 4 and name HE21))
(( segid " " and resid 4 and name HG1 ))
3.500 1.500 1.500 peak 719 spectrum 1 weight 0.10000E+01 volume 0.72082E-03 ppm1 6.833 ppm2 2.233 CV 1
ASSI { 720}
(( segid " " and resid 4 and name HE22))
(( segid " " and resid 4 and name HG1 ))
3.900 1.900 1.900 peak 720 spectrum 1 weight 0.10000E+01 volume 0.13025E-02 ppm1 7.507 ppm2 2.224 CV 1
ASSI { 721}
(( segid " " and resid 4 and name HE22))
(( segid " " and resid 4 and name HG2 ))
4.000 2.000 2.000 peak 721 spectrum 1 weight 0.10000E+01 volume 0.10156E-02 ppm1 7.505 ppm2 2.168 CV 1
OR { 721}
(( segid " " and resid 4 and name HE22))
(( segid " " and resid 4 and name HB1 ))
ASSI { 722}
(( segid " " and resid 4 and name HE21))
( segid " " and resid 28 and name HD2%)
3.800 1.800 1.800 peak 722 spectrum 1 weight 0.10000E+01 volume 0.59433E-03 ppm1 6.833 ppm2 0.913 CV 1
ASSI { 723}
(( segid " " and resid 4 and name HE22))
( segid " " and resid 28 and name HD2%)
4.800 2.900 1.200 peak 723 spectrum 1 weight 0.10000E+01 volume 0.27577E-03 ppm1 7.492 ppm2 0.926 CV 1
ASSI { 728}
(( segid " " and resid 16 and name HD22))
(( segid " " and resid 16 and name HB1 ))
3.700 1.700 1.700 peak 728 spectrum 1 weight 0.10000E+01 volume 0.20667E-02 ppm1 8.062 ppm2 3.102 CV 1
ASSI { 729}
(( segid " " and resid 16 and name HD22))
(( segid " " and resid 16 and name HB2 ))
4.100 2.100 1.900 peak 729 spectrum 1 weight 0.10000E+01 volume 0.97781E-03 ppm1 8.058 ppm2 2.746 CV 1
ASSI { 731}
(( segid " " and resid 16 and name HD21))
(( segid " " and resid 16 and name HB2 ))
3.300 1.400 1.400 peak 731 spectrum 1 weight 0.10000E+01 volume 0.44619E-03 ppm1 6.849 ppm2 2.744 CV 1
ASSI { 732}
(( segid " " and resid 16 and name HD21))
(( segid " " and resid 16 and name HB1 ))
3.600 1.600 1.600 peak 732 spectrum 1 weight 0.10000E+01 volume 0.10316E-02 ppm1 6.849 ppm2 3.115 CV 1
ASSI { 736}
(( segid " " and resid 65 and name HD21))
(( segid " " and resid 65 and name HB1 ))
3.500 1.600 1.600 peak 736 spectrum 1 weight 0.10000E+01 volume 0.70653E-03 ppm1 6.997 ppm2 3.037 CV 1
ASSI { 737}
(( segid " " and resid 65 and name HD21))
(( segid " " and resid 65 and name HB2 ))
2.900 1.100 1.100 peak 737 spectrum 1 weight 0.10000E+01 volume 0.12262E-02 ppm1 6.995 ppm2 2.725 CV 1
ASSI { 740}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HA ))
2.900 1.100 1.100 peak 740 spectrum 1 weight 0.10000E+01 volume 0.21987E-02 ppm1 8.257 ppm2 4.380 CV 1
ASSI { 741}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 75 and name HA ))
3.700 1.700 1.700 peak 741 spectrum 1 weight 0.10000E+01 volume 0.69967E-03 ppm1 8.257 ppm2 4.212 CV 1
ASSI { 744}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HB2 ))
2.900 1.000 1.000 peak 744 spectrum 1 weight 0.10000E+01 volume 0.19112E-02 ppm1 8.258 ppm2 2.213 CV 1
ASSI { 746}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HG ))
3.000 1.100 1.100 peak 746 spectrum 1 weight 0.10000E+01 volume 0.17545E-02 ppm1 8.258 ppm2 1.648 CV 1
OR { 746}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HB2 ))
ASSI { 750}
(( segid " " and resid 77 and name HN ))
( segid " " and resid 76 and name HG2%)
2.800 1.000 1.000 peak 750 spectrum 1 weight 0.10000E+01 volume 0.32779E-02 ppm1 8.498 ppm2 0.525 CV 1
ASSI { 752}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 74 and name HN ))
2.600 0.900 0.900 peak 752 spectrum 1 weight 0.10000E+01 volume 0.22994E-02 ppm1 8.643 ppm2 8.017 CV 1
ASSI { 753}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HN ))
2.600 0.800 0.800 peak 753 spectrum 1 weight 0.10000E+01 volume 0.19124E-02 ppm1 8.642 ppm2 8.209 CV 1
ASSI { 754}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HB ))
2.900 1.100 1.100 peak 754 spectrum 1 weight 0.10000E+01 volume 0.40823E-02 ppm1 8.643 ppm2 4.176 CV 1
ASSI { 755}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HA ))
3.600 1.600 1.600 peak 755 spectrum 1 weight 0.10000E+01 volume 0.70490E-03 ppm1 8.643 ppm2 4.087 CV 1
ASSI { 756}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 70 and name HA2 ))
3.200 1.300 1.300 peak 756 spectrum 1 weight 0.10000E+01 volume 0.93405E-03 ppm1 8.641 ppm2 3.772 CV 1
ASSI { 757}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HA ))
2.100 0.600 0.600 peak 757 spectrum 1 weight 0.10000E+01 volume 0.82808E-02 ppm1 8.643 ppm2 3.673 CV 1
ASSI { 762}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 76 and name HN ))
2.500 0.800 0.800 peak 762 spectrum 1 weight 0.10000E+01 volume 0.25470E-02 ppm1 7.939 ppm2 8.516 CV 1
ASSI { 763}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 75 and name HD% )
4.300 2.300 1.700 peak 763 spectrum 1 weight 0.10000E+01 volume 0.10227E-02 ppm1 7.940 ppm2 6.815 CV 1
ASSI { 764}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HA ))
2.700 0.900 0.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.29280E-02 ppm1 7.941 ppm2 4.217 CV 1
ASSI { 765}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 72 and name HA ))
3.100 1.200 1.200 peak 765 spectrum 1 weight 0.10000E+01 volume 0.12308E-02 ppm1 7.940 ppm2 4.109 CV 1
ASSI { 768}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 76 and name HB ))
4.500 2.500 1.500 peak 768 spectrum 1 weight 0.10000E+01 volume 0.58901E-03 ppm1 7.939 ppm2 1.780 CV 1
ASSI { 771}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 54 and name HD% )
2.900 1.000 1.000 peak 771 spectrum 1 weight 0.10000E+01 volume 0.18057E-02 ppm1 8.134 ppm2 7.463 CV 1
ASSI { 772}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HA ))
2.600 0.800 0.800 peak 772 spectrum 1 weight 0.10000E+01 volume 0.48627E-02 ppm1 8.975 ppm2 4.150 CV 1
OR { 772}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HB1 ))
OR { 772}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 774}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HB1 ))
2.900 1.000 1.000 peak 774 spectrum 1 weight 0.10000E+01 volume 0.26009E-02 ppm1 8.976 ppm2 3.084 CV 1
ASSI { 776}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 41 and name HN ))
3.000 1.200 1.200 peak 776 spectrum 1 weight 0.10000E+01 volume 0.14261E-02 ppm1 8.974 ppm2 8.120 CV 1
ASSI { 778}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 21 and name HN ))
2.400 0.700 0.700 peak 778 spectrum 1 weight 0.10000E+01 volume 0.23994E-02 ppm1 7.807 ppm2 6.463 CV 1
ASSI { 779}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HA ))
3.500 1.600 1.600 peak 779 spectrum 1 weight 0.10000E+01 volume 0.90678E-03 ppm1 7.809 ppm2 4.816 CV 1
ASSI { 780}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 16 and name HA ))
3.400 1.400 1.400 peak 780 spectrum 1 weight 0.10000E+01 volume 0.57238E-03 ppm1 7.810 ppm2 4.670 CV 1
ASSI { 781}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HA2 ))
2.300 0.700 0.700 peak 781 spectrum 1 weight 0.10000E+01 volume 0.43928E-02 ppm1 7.809 ppm2 3.943 CV 1
ASSI { 782}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HA1 ))
2.900 1.000 1.000 peak 782 spectrum 1 weight 0.10000E+01 volume 0.29311E-02 ppm1 7.808 ppm2 4.056 CV 1
ASSI { 783}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 19 and name HB% )
3.100 1.200 1.200 peak 783 spectrum 1 weight 0.10000E+01 volume 0.16075E-02 ppm1 7.809 ppm2 1.537 CV 1
ASSI { 784}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 18 and name HG12))
3.200 3.200 2.800 peak 784 spectrum 1 weight 0.10000E+01 volume 0.41216E-03 ppm1 7.799 ppm2 1.319 CV 1
ASSI { 786}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 18 and name HB ))
4.300 2.400 1.700 peak 786 spectrum 1 weight 0.10000E+01 volume 0.55265E-03 ppm1 7.810 ppm2 1.628 CV 1
ASSI { 790}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
3.500 1.500 1.500 peak 790 spectrum 1 weight 0.10000E+01 volume 0.73229E-03 ppm1 8.788 ppm2 3.811 CV 1
ASSI { 792}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HB ))
2.500 0.800 0.800 peak 792 spectrum 1 weight 0.10000E+01 volume 0.25730E-02 ppm1 8.789 ppm2 2.090 CV 1
ASSI { 793}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HB ))
2.300 0.600 0.600 peak 793 spectrum 1 weight 0.10000E+01 volume 0.40321E-02 ppm1 8.789 ppm2 2.243 CV 1
ASSI { 794}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HG12))
4.000 2.000 2.000 peak 794 spectrum 1 weight 0.10000E+01 volume 0.16958E-02 ppm1 8.788 ppm2 1.060 CV 1
ASSI { 798}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 26 and name HG2%)
4.300 2.400 1.700 peak 798 spectrum 1 weight 0.10000E+01 volume 0.69242E-03 ppm1 8.789 ppm2 0.910 CV 1
ASSI { 801}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HB1 ))
2.400 0.700 0.700 peak 801 spectrum 1 weight 0.10000E+01 volume 0.18157E-02 ppm1 8.459 ppm2 2.055 CV 1
ASSI { 802}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HG ))
2.800 2.800 3.200 peak 802 spectrum 1 weight 0.10000E+01 volume 0.55115E-02 ppm1 8.460 ppm2 1.750 CV 1
ASSI { 803}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HB2 ))
3.600 1.600 1.600 peak 803 spectrum 1 weight 0.10000E+01 volume 0.79143E-03 ppm1 8.460 ppm2 1.531 CV 1
ASSI { 804}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HB2 ))
2.700 0.900 0.900 peak 804 spectrum 1 weight 0.10000E+01 volume 0.12772E-02 ppm1 8.460 ppm2 1.463 CV 1
ASSI { 805}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HG2 ))
4.400 2.500 1.600 peak 805 spectrum 1 weight 0.10000E+01 volume 0.70410E-03 ppm1 8.457 ppm2 1.333 CV 1
OR { 805}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HG1 ))
ASSI { 806}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 28 and name HD1%)
4.400 2.400 1.600 peak 806 spectrum 1 weight 0.10000E+01 volume 0.55010E-03 ppm1 8.461 ppm2 0.801 CV 1
ASSI { 807}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 28 and name HD2%)
3.100 1.200 1.200 peak 807 spectrum 1 weight 0.10000E+01 volume 0.10166E-02 ppm1 8.462 ppm2 0.899 CV 1
ASSI { 809}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HB1 ))
2.700 0.900 0.900 peak 809 spectrum 1 weight 0.10000E+01 volume 0.31950E-02 ppm1 8.689 ppm2 3.104 CV 1
ASSI { 810}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HB2 ))
2.500 0.800 0.800 peak 810 spectrum 1 weight 0.10000E+01 volume 0.33976E-02 ppm1 8.689 ppm2 2.739 CV 1
ASSI { 814}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HB ))
2.800 1.000 1.000 peak 814 spectrum 1 weight 0.10000E+01 volume 0.18361E-02 ppm1 8.690 ppm2 2.244 CV 1
ASSI { 816}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 15 and name HG1%)
3.500 1.500 1.500 peak 816 spectrum 1 weight 0.10000E+01 volume 0.15711E-02 ppm1 8.689 ppm2 0.993 CV 1
ASSI { 818}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 15 and name HG2%)
4.200 2.200 1.800 peak 818 spectrum 1 weight 0.10000E+01 volume 0.93438E-03 ppm1 8.690 ppm2 1.167 CV 1
ASSI { 822}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HA ))
2.400 0.700 0.700 peak 822 spectrum 1 weight 0.10000E+01 volume 0.47060E-02 ppm1 8.179 ppm2 4.677 CV 1
ASSI { 823}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HB ))
3.000 1.200 1.200 peak 823 spectrum 1 weight 0.10000E+01 volume 0.31720E-02 ppm1 8.178 ppm2 2.002 CV 1
ASSI { 824}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HB2 ))
2.500 0.800 0.800 peak 824 spectrum 1 weight 0.10000E+01 volume 0.48103E-02 ppm1 8.178 ppm2 1.682 CV 1
OR { 824}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HB1 ))
ASSI { 825}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HG1 ))
3.400 1.400 1.400 peak 825 spectrum 1 weight 0.10000E+01 volume 0.93953E-03 ppm1 8.182 ppm2 1.345 CV 1
OR { 825}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HG2 ))
ASSI { 827}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HA ))
2.200 0.600 0.600 peak 827 spectrum 1 weight 0.10000E+01 volume 0.89857E-02 ppm1 8.243 ppm2 3.951 CV 1
ASSI { 829}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 40 and name HN ))
4.000 2.000 2.000 peak 829 spectrum 1 weight 0.10000E+01 volume 0.39028E-03 ppm1 8.245 ppm2 8.995 CV 1
ASSI { 830}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB1 ))
3.500 1.600 1.600 peak 830 spectrum 1 weight 0.10000E+01 volume 0.13136E-02 ppm1 8.243 ppm2 3.084 CV 1
ASSI { 831}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB2 ))
2.800 1.000 1.000 peak 831 spectrum 1 weight 0.10000E+01 volume 0.21252E-02 ppm1 8.243 ppm2 2.749 CV 1
ASSI { 832}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 42 and name HB2 ))
3.800 1.800 1.800 peak 832 spectrum 1 weight 0.10000E+01 volume 0.33084E-03 ppm1 8.244 ppm2 3.670 CV 1
ASSI { 833}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HB ))
4.000 2.000 2.000 peak 833 spectrum 1 weight 0.10000E+01 volume 0.51525E-03 ppm1 8.241 ppm2 1.878 CV 1
ASSI { 834}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 19 and name HB% )
4.600 2.600 1.400 peak 834 spectrum 1 weight 0.10000E+01 volume 0.20383E-03 ppm1 8.241 ppm2 1.544 CV 1
ASSI { 835}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 38 and name HG2%)
2.900 1.000 1.000 peak 835 spectrum 1 weight 0.10000E+01 volume 0.38230E-02 ppm1 8.243 ppm2 0.926 CV 1
OR { 835}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 38 and name HG1%)
ASSI { 836}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HA ))
3.300 1.400 1.400 peak 836 spectrum 1 weight 0.10000E+01 volume 0.10992E-02 ppm1 8.208 ppm2 4.483 CV 1
ASSI { 837}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HA ))
2.800 1.000 1.000 peak 837 spectrum 1 weight 0.10000E+01 volume 0.18453E-02 ppm1 8.211 ppm2 4.103 CV 1
ASSI { 838}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 73 and name HA ))
4.600 2.600 1.400 peak 838 spectrum 1 weight 0.10000E+01 volume 0.63881E-03 ppm1 8.210 ppm2 3.675 CV 1
ASSI { 839}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 69 and name HA ))
3.500 1.600 1.600 peak 839 spectrum 1 weight 0.10000E+01 volume 0.46131E-03 ppm1 8.209 ppm2 3.409 CV 1
ASSI { 840}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HB1 ))
2.900 1.100 1.100 peak 840 spectrum 1 weight 0.10000E+01 volume 0.22122E-02 ppm1 8.211 ppm2 3.110 CV 1
ASSI { 841}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 73 and name HB ))
5.100 3.300 0.900 peak 841 spectrum 1 weight 0.10000E+01 volume 0.50160E-03 ppm1 8.210 ppm2 4.196 CV 1
ASSI { 843}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 72 and name HB% )
2.300 0.700 0.700 peak 843 spectrum 1 weight 0.10000E+01 volume 0.53892E-02 ppm1 8.210 ppm2 1.605 CV 1
ASSI { 844}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 66 and name HB2 ))
4.000 2.000 2.000 peak 844 spectrum 1 weight 0.10000E+01 volume 0.87126E-03 ppm1 8.206 ppm2 0.925 CV 1
ASSI { 846}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 66 and name HD1%)
4.600 2.700 1.400 peak 846 spectrum 1 weight 0.10000E+01 volume 0.37846E-03 ppm1 8.213 ppm2 0.410 CV 1
ASSI { 847}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 32 and name HE% )
4.000 2.000 2.000 peak 847 spectrum 1 weight 0.10000E+01 volume 0.55131E-03 ppm1 8.212 ppm2 6.994 CV 1
ASSI { 849}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 68 and name HN ))
2.800 2.800 3.200 peak 849 spectrum 1 weight 0.10000E+01 volume 0.90971E-03 ppm1 8.211 ppm2 8.541 CV 1
ASSI { 851}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HA ))
3.700 1.700 1.700 peak 851 spectrum 1 weight 0.10000E+01 volume 0.58746E-03 ppm1 8.516 ppm2 4.229 CV 1
ASSI { 852}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 72 and name HA ))
4.200 2.200 1.800 peak 852 spectrum 1 weight 0.10000E+01 volume 0.28449E-03 ppm1 8.516 ppm2 4.096 CV 1
ASSI { 856}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HN ))
2.400 0.700 0.700 peak 856 spectrum 1 weight 0.10000E+01 volume 0.30277E-02 ppm1 8.689 ppm2 8.786 CV 1
ASSI { 859}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 78 and name HN ))
2.800 1.000 1.000 peak 859 spectrum 1 weight 0.10000E+01 volume 0.13085E-02 ppm1 8.493 ppm2 8.259 CV 1
ASSI { 863}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 28 and name HA ))
5.200 3.400 0.800 peak 863 spectrum 1 weight 0.10000E+01 volume 0.56618E-03 ppm1 8.149 ppm2 3.579 CV 1
ASSI { 864}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 31 and name HA ))
3.100 1.200 1.200 peak 864 spectrum 1 weight 0.10000E+01 volume 0.61963E-03 ppm1 8.151 ppm2 4.914 CV 1
ASSI { 865}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HN ))
3.500 1.500 1.500 peak 865 spectrum 1 weight 0.10000E+01 volume 0.77447E-03 ppm1 6.356 ppm2 7.493 CV 1
ASSI { 866}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HA ))
2.100 0.500 0.500 peak 866 spectrum 1 weight 0.10000E+01 volume 0.56250E-02 ppm1 6.355 ppm2 3.530 CV 1
ASSI { 868}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HB2 ))
2.500 0.800 0.800 peak 868 spectrum 1 weight 0.10000E+01 volume 0.17014E-02 ppm1 6.356 ppm2 1.541 CV 1
ASSI { 870}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HG1 ))
2.600 0.800 0.800 peak 870 spectrum 1 weight 0.10000E+01 volume 0.27321E-02 ppm1 6.353 ppm2 1.337 CV 1
OR { 870}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HG2 ))
ASSI { 871}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 30 and name HG1 ))
2.300 0.700 0.700 peak 871 spectrum 1 weight 0.10000E+01 volume 0.17586E-02 ppm1 6.356 ppm2 1.802 CV 1
ASSI { 873}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HB1 ))
3.300 1.400 1.400 peak 873 spectrum 1 weight 0.10000E+01 volume 0.19134E-02 ppm1 6.354 ppm2 2.050 CV 1
ASSI { 874}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 69 and name HG1%)
4.000 2.000 2.000 peak 874 spectrum 1 weight 0.10000E+01 volume 0.57678E-03 ppm1 6.352 ppm2 0.431 CV 1
ASSI { 878}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HE1 ))
4.700 2.800 1.300 peak 878 spectrum 1 weight 0.10000E+01 volume 0.37240E-03 ppm1 6.350 ppm2 3.037 CV 1
OR { 878}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HE2 ))
ASSI { 879}
(( segid " " and resid 77 and name HN ))
( segid " " and resid 77 and name HD2%)
3.600 1.600 1.600 peak 879 spectrum 1 weight 0.10000E+01 volume 0.14769E-02 ppm1 8.494 ppm2 0.816 CV 1
OR { 879}
(( segid " " and resid 77 and name HN ))
( segid " " and resid 77 and name HD1%)
ASSI { 884}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 40 and name H2A ))
4.600 2.600 1.400 peak 884 spectrum 1 weight 0.10000E+01 volume 0.25799E-03 ppm1 7.044 ppm2 2.477 CV 1
OR { 884}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 40 and name H38A))
OR { 884}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 40 and name H38B))
OR { 884}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 40 and name H2B ))
ASSI { 886}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HA ))
5.200 3.400 0.800 peak 886 spectrum 1 weight 0.10000E+01 volume 0.20902E-03 ppm1 8.310 ppm2 3.596 CV 1
ASSI { 887}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HB ))
4.700 2.800 1.300 peak 887 spectrum 1 weight 0.10000E+01 volume 0.46947E-03 ppm1 8.312 ppm2 2.187 CV 1
ASSI { 889}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 47 and name HA ))
4.400 2.400 1.600 peak 889 spectrum 1 weight 0.10000E+01 volume 0.23659E-03 ppm1 7.909 ppm2 3.310 CV 1
ASSI { 890}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 45 and name HA ))
3.700 1.700 1.700 peak 890 spectrum 1 weight 0.10000E+01 volume 0.74402E-03 ppm1 7.912 ppm2 4.062 CV 1
ASSI { 892}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 73 and name HB ))
2.800 1.000 1.000 peak 892 spectrum 1 weight 0.10000E+01 volume 0.28949E-02 ppm1 8.014 ppm2 4.178 CV 1
ASSI { 893}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HB1 ))
2.800 1.000 1.000 peak 893 spectrum 1 weight 0.10000E+01 volume 0.39032E-02 ppm1 8.017 ppm2 1.972 CV 1
ASSI { 894}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HB2 ))
2.400 0.700 0.700 peak 894 spectrum 1 weight 0.10000E+01 volume 0.36747E-02 ppm1 8.015 ppm2 1.899 CV 1
ASSI { 895}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HG2 ))
3.800 1.800 1.800 peak 895 spectrum 1 weight 0.10000E+01 volume 0.87047E-03 ppm1 8.015 ppm2 1.475 CV 1
OR { 895}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HG1 ))
ASSI { 896}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HD2 ))
4.800 2.900 1.200 peak 896 spectrum 1 weight 0.10000E+01 volume 0.41278E-03 ppm1 8.011 ppm2 1.655 CV 1
ASSI { 897}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HD1 ))
4.500 2.600 1.500 peak 897 spectrum 1 weight 0.10000E+01 volume 0.45398E-03 ppm1 8.010 ppm2 1.765 CV 1
ASSI { 898}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 73 and name HG2%)
3.800 1.800 1.800 peak 898 spectrum 1 weight 0.10000E+01 volume 0.12885E-02 ppm1 8.016 ppm2 1.105 CV 1
ASSI { 899}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 7 and name HG2%)
4.700 2.800 1.300 peak 899 spectrum 1 weight 0.10000E+01 volume 0.39889E-03 ppm1 8.016 ppm2 0.540 CV 1
OR { 899}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 7 and name HD1%)
ASSI { 900}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HD2 ))
4.500 2.500 1.500 peak 900 spectrum 1 weight 0.10000E+01 volume 0.75294E-03 ppm1 7.039 ppm2 1.660 CV 1
OR { 900}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HD1 ))
ASSI { 902}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 40 and name H42B))
4.500 2.600 1.500 peak 902 spectrum 1 weight 0.10000E+01 volume 0.26295E-03 ppm1 8.194 ppm2 3.236 CV 1
ASSI { 903}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HB2 ))
3.900 1.900 1.900 peak 903 spectrum 1 weight 0.10000E+01 volume 0.26514E-03 ppm1 8.188 ppm2 3.860 CV 1
ASSI { 912}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 40 and name H2A ))
4.500 2.600 1.500 peak 912 spectrum 1 weight 0.10000E+01 volume 0.25950E-03 ppm1 7.282 ppm2 2.471 CV 1
OR { 912}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 40 and name H2B ))
ASSI { 1}
(( segid " " and resid 40 and name H3B ))
(( segid " " and resid 40 and name H4A ))
2.300 0.700 0.700 peak 1 spectrum 1 weight 0.10000E+01 volume 0.38654E-02 ppm1 1.217 ppm2 0.745 CV 1
OR { 1}
(( segid " " and resid 40 and name H3A ))
(( segid " " and resid 40 and name H4B ))
OR { 1}
(( segid " " and resid 40 and name H3B ))
(( segid " " and resid 40 and name H4B ))
OR { 1}
(( segid " " and resid 40 and name H3A ))
(( segid " " and resid 40 and name H4A ))
ASSI { 2}
(( segid " " and resid 40 and name H3A ))
(( segid " " and resid 40 and name H5A ))
2.700 0.900 0.900 peak 2 spectrum 1 weight 0.10000E+01 volume 0.32765E-02 ppm1 1.215 ppm2 0.652 CV 1
OR { 2}
(( segid " " and resid 40 and name H3B ))
(( segid " " and resid 40 and name H5B ))
OR { 2}
(( segid " " and resid 40 and name H3B ))
(( segid " " and resid 40 and name H5A ))
OR { 2}
(( segid " " and resid 40 and name H3A ))
(( segid " " and resid 40 and name H5B ))
OR { 2}
(( segid " " and resid 40 and name H3A ))
(( segid " " and resid 40 and name H6B ))
OR { 2}
(( segid " " and resid 40 and name H3A ))
(( segid " " and resid 40 and name H6A ))
OR { 2}
(( segid " " and resid 40 and name H3B ))
(( segid " " and resid 40 and name H6B ))
ASSI { 3}
(( segid " " and resid 40 and name H36A))
(( segid " " and resid 40 and name H38B))
2.700 0.900 0.900 peak 3 spectrum 1 weight 0.10000E+01 volume 0.38002E-02 ppm1 8.027 ppm2 2.441 CV 1
OR { 3}
(( segid " " and resid 40 and name H36A))
(( segid " " and resid 40 and name H38A))
ASSI { 4}
(( segid " " and resid 40 and name H41A))
(( segid " " and resid 40 and name H38B))
2.100 0.500 0.500 peak 4 spectrum 1 weight 0.10000E+01 volume 0.13795E-01 ppm1 8.176 ppm2 2.440 CV 1
OR { 4}
(( segid " " and resid 40 and name H41A))
(( segid " " and resid 40 and name H38A))
ASSI { 1}
(( segid " " and resid 40 and name H28A))
( segid " " and resid 40 and name H31%)
2.600 0.800 0.800 peak 1 spectrum 1 weight 0.10000E+01 volume 0.13089E-01 ppm1 3.718 ppm2 0.877 CV 1
ASSI { 2}
(( segid " " and resid 40 and name H28A))
( segid " " and resid 40 and name H30%)
2.800 1.000 1.000 peak 2 spectrum 1 weight 0.10000E+01 volume 0.48179E-02 ppm1 3.717 ppm2 0.860 CV 1
ASSI { 3}
(( segid " " and resid 40 and name H28B))
( segid " " and resid 40 and name H31%)
2.400 0.700 0.700 peak 3 spectrum 1 weight 0.10000E+01 volume 0.13028E-01 ppm1 3.387 ppm2 0.877 CV 1
ASSI { 4}
(( segid " " and resid 40 and name H28B))
( segid " " and resid 40 and name H30%)
2.300 0.700 0.700 peak 4 spectrum 1 weight 0.10000E+01 volume 0.65954E-02 ppm1 3.388 ppm2 0.860 CV 1
ASSI { 5}
(( segid " " and resid 40 and name H32A))
( segid " " and resid 40 and name H31%)
2.600 0.900 0.900 peak 5 spectrum 1 weight 0.10000E+01 volume 0.57787E-02 ppm1 4.012 ppm2 0.876 CV 1
ASSI { 6}
(( segid " " and resid 40 and name H32A))
( segid " " and resid 40 and name H30%)
3.100 1.200 1.200 peak 6 spectrum 1 weight 0.10000E+01 volume 0.63826E-02 ppm1 4.012 ppm2 0.860 CV 1
ASSI { 9}
(( segid " " and resid 40 and name H41A))
( segid " " and resid 40 and name H31%)
2.800 2.800 3.200 peak 9 spectrum 1 weight 0.10000E+01 volume 0.76304E-03 ppm1 8.177 ppm2 0.876 CV 1
ASSI { 10}
(( segid " " and resid 40 and name H41A))
( segid " " and resid 40 and name H30%)
3.300 1.300 1.300 peak 10 spectrum 1 weight 0.10000E+01 volume 0.15982E-02 ppm1 8.177 ppm2 0.860 CV 1
ASSI { 11}
(( segid " " and resid 40 and name H36A))
( segid " " and resid 40 and name H31%)
4.200 2.200 1.800 peak 11 spectrum 1 weight 0.10000E+01 volume 0.27296E-02 ppm1 8.026 ppm2 0.874 CV 1
ASSI { 12}
(( segid " " and resid 40 and name H36A))
( segid " " and resid 40 and name H30%)
3.200 1.300 1.300 peak 12 spectrum 1 weight 0.10000E+01 volume 0.40966E-02 ppm1 8.026 ppm2 0.860 CV 1
ASSI { 13}
(( segid " " and resid 40 and name H38A))
(( segid " " and resid 40 and name H37B))
2.500 0.800 0.800 peak 13 spectrum 1 weight 0.10000E+01 volume 0.47220E-02 ppm1 2.446 ppm2 3.544 CV 1
OR { 13}
(( segid " " and resid 40 and name H38B))
(( segid " " and resid 40 and name H37B))
ASSI { 14}
(( segid " " and resid 40 and name H38A))
(( segid " " and resid 40 and name H37A))
2.500 0.800 0.800 peak 14 spectrum 1 weight 0.10000E+01 volume 0.50771E-02 ppm1 2.446 ppm2 3.408 CV 1
OR { 14}
(( segid " " and resid 40 and name H38B))
(( segid " " and resid 40 and name H37A))
ASSI { 19}
( segid " " and resid 50 and name HB% )
( segid " " and resid 40 and name H8% )
2.500 0.800 0.800 peak 19 spectrum 1 weight 0.10000E+01 volume 0.43299E-02 ppm1 1.480 ppm2 0.609 CV 1
ASSI { 20}
(( segid " " and resid 76 and name HG11))
( segid " " and resid 40 and name H8% )
3.800 1.800 1.800 peak 20 spectrum 1 weight 0.10000E+01 volume 0.54218E-03 ppm1 1.954 ppm2 0.604 CV 1
ASSI { 21}
( segid " " and resid 58 and name HG2%)
( segid " " and resid 40 and name H8% )
3.600 1.600 1.600 peak 21 spectrum 1 weight 0.10000E+01 volume 0.16712E-02 ppm1 0.326 ppm2 0.609 CV 1
ASSI { 22}
( segid " " and resid 66 and name HD1%)
( segid " " and resid 40 and name H8% )
3.700 1.700 1.700 peak 22 spectrum 1 weight 0.10000E+01 volume 0.18772E-02 ppm1 0.401 ppm2 0.609 CV 1
ASSI { 23}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 40 and name H8% )
4.900 3.000 1.100 peak 23 spectrum 1 weight 0.10000E+01 volume 0.53485E-03 ppm1 4.092 ppm2 0.609 CV 1
ASSI { 29}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H6A ))
3.300 1.300 1.300 peak 29 spectrum 1 weight 0.10000E+01 volume 0.10116E-02 ppm1 0.403 ppm2 0.658 CV 1
OR { 29}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H6B ))
OR { 29}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H5B ))
OR { 29}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H5A ))
ASSI { 31}
(( segid " " and resid 40 and name H41A))
(( segid " " and resid 40 and name H42B))
2.900 1.100 1.100 peak 31 spectrum 1 weight 0.10000E+01 volume 0.18292E-02 ppm1 8.176 ppm2 3.211 CV 1
ASSI { 32}
(( segid " " and resid 40 and name H41A))
(( segid " " and resid 40 and name H42A))
3.000 1.100 1.100 peak 32 spectrum 1 weight 0.10000E+01 volume 0.16789E-02 ppm1 8.177 ppm2 3.172 CV 1
ASSI { 34}
(( segid " " and resid 40 and name H43B))
(( segid " " and resid 40 and name H42B))
2.500 0.800 0.800 peak 34 spectrum 1 weight 0.10000E+01 volume 0.46981E-02 ppm1 2.824 ppm2 3.218 CV 1
OR { 34}
(( segid " " and resid 40 and name H43A))
(( segid " " and resid 40 and name H42B))
ASSI { 35}
(( segid " " and resid 40 and name H43A))
(( segid " " and resid 40 and name H42A))
2.800 1.000 1.000 peak 35 spectrum 1 weight 0.10000E+01 volume 0.38264E-02 ppm1 2.825 ppm2 3.170 CV 1
OR { 35}
(( segid " " and resid 40 and name H43B))
(( segid " " and resid 40 and name H42A))
ASSI { 37}
(( segid " " and resid 40 and name H41A))
(( segid " " and resid 40 and name H43A))
3.000 1.200 1.200 peak 37 spectrum 1 weight 0.10000E+01 volume 0.20585E-02 ppm1 8.176 ppm2 2.824 CV 1
OR { 37}
(( segid " " and resid 40 and name H41A))
(( segid " " and resid 40 and name H43B))
ASSI { 38}
(( segid " " and resid 40 and name H2B ))
(( segid " " and resid 40 and name H42B))
4.500 2.500 1.500 peak 38 spectrum 1 weight 0.10000E+01 volume 0.64300E-03 ppm1 2.448 ppm2 3.213 CV 1
OR { 38}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H42B))
ASSI { 39}
(( segid " " and resid 40 and name H2B ))
(( segid " " and resid 40 and name H42A))
3.700 1.700 1.700 peak 39 spectrum 1 weight 0.10000E+01 volume 0.69590E-03 ppm1 2.447 ppm2 3.170 CV 1
OR { 39}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H42A))
ASSI { 40}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H43A))
3.700 1.700 1.700 peak 40 spectrum 1 weight 0.10000E+01 volume 0.12909E-02 ppm1 2.450 ppm2 2.823 CV 1
OR { 40}
(( segid " " and resid 40 and name H2B ))
(( segid " " and resid 40 and name H43B))
OR { 40}
(( segid " " and resid 40 and name H2B ))
(( segid " " and resid 40 and name H43A))
OR { 40}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H43B))
ASSI { 41}
(( segid " " and resid 40 and name H37B))
(( segid " " and resid 40 and name H41A))
4.300 2.300 1.700 peak 41 spectrum 1 weight 0.10000E+01 volume 0.12273E-02 ppm1 3.541 ppm2 8.171 CV 1
ASSI { 42}
(( segid " " and resid 40 and name H37A))
(( segid " " and resid 40 and name H41A))
3.700 1.700 1.700 peak 42 spectrum 1 weight 0.10000E+01 volume 0.12228E-02 ppm1 3.409 ppm2 8.171 CV 1
ASSI { 43}
(( segid " " and resid 40 and name H37B))
(( segid " " and resid 40 and name H36A))
2.200 0.600 0.600 peak 43 spectrum 1 weight 0.10000E+01 volume 0.46591E-02 ppm1 3.538 ppm2 8.023 CV 1
ASSI { 44}
(( segid " " and resid 40 and name H37A))
(( segid " " and resid 40 and name H36A))
2.500 0.800 0.800 peak 44 spectrum 1 weight 0.10000E+01 volume 0.60438E-02 ppm1 3.411 ppm2 8.023 CV 1
ASSI { 45}
(( segid " " and resid 40 and name H32A))
(( segid " " and resid 40 and name H36A))
2.000 0.500 0.500 peak 45 spectrum 1 weight 0.10000E+01 volume 0.91369E-02 ppm1 4.012 ppm2 8.022 CV 1
ASSI { 46}
(( segid " " and resid 40 and name H28A))
(( segid " " and resid 40 and name H36A))
2.500 0.800 0.800 peak 46 spectrum 1 weight 0.10000E+01 volume 0.93685E-03 ppm1 3.717 ppm2 8.023 CV 1
ASSI { 47}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H43A))
4.200 2.200 1.800 peak 47 spectrum 1 weight 0.10000E+01 volume 0.71583E-03 ppm1 1.537 ppm2 2.823 CV 1
ASSI { 51}
(( segid " " and resid 40 and name H43A))
( segid " " and resid 40 and name H31%)
2.600 2.600 3.400 peak 51 spectrum 1 weight 0.10000E+01 volume 0.12186E-02 ppm1 2.824 ppm2 0.876 CV 1
OR { 51}
(( segid " " and resid 40 and name H43B))
( segid " " and resid 40 and name H31%)
ASSI { 52}
(( segid " " and resid 40 and name H43A))
( segid " " and resid 40 and name H30%)
3.300 1.400 1.400 peak 52 spectrum 1 weight 0.10000E+01 volume 0.18722E-02 ppm1 2.822 ppm2 0.860 CV 1
OR { 52}
(( segid " " and resid 40 and name H43B))
( segid " " and resid 40 and name H30%)
ASSI { 53}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H38A))
3.500 1.500 1.500 peak 53 spectrum 1 weight 0.10000E+01 volume 0.99013E-03 ppm1 1.536 ppm2 2.458 CV 1
OR { 53}
( segid " " and resid 43 and name HE% )
(( segid " " and resid 40 and name H38B))
ASSI { 54}
(( segid " " and resid 66 and name HG ))
(( segid " " and resid 40 and name H2A ))
4.900 3.000 1.100 peak 54 spectrum 1 weight 0.10000E+01 volume 0.62515E-03 ppm1 1.796 ppm2 2.454 CV 1
OR { 54}
(( segid " " and resid 66 and name HG ))
(( segid " " and resid 40 and name H2B ))
ASSI { 56}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 40 and name H31%)
2.800 2.800 3.200 peak 56 spectrum 1 weight 0.10000E+01 volume 0.90988E-03 ppm1 4.291 ppm2 0.877 CV 1
ASSI { 57}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 40 and name H30%)
2.900 2.900 3.100 peak 57 spectrum 1 weight 0.10000E+01 volume 0.63399E-03 ppm1 4.293 ppm2 0.858 CV 1
ASSI { 58}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name H28A))
3.500 1.500 1.500 peak 58 spectrum 1 weight 0.10000E+01 volume 0.99775E-03 ppm1 4.139 ppm2 3.720 CV 1
OR { 58}
(( segid " " and resid 40 and name HB1 ))
(( segid " " and resid 40 and name H28A))
OR { 58}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name H28A))
ASSI { 59}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name H28B))
3.400 1.500 1.500 peak 59 spectrum 1 weight 0.10000E+01 volume 0.11482E-02 ppm1 4.139 ppm2 3.388 CV 1
OR { 59}
(( segid " " and resid 40 and name HB1 ))
(( segid " " and resid 40 and name H28B))
OR { 59}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name H28B))
ASSI { 60}
(( segid " " and resid 40 and name H28A))
(( segid " " and resid 40 and name H32A))
2.400 0.700 0.700 peak 60 spectrum 1 weight 0.10000E+01 volume 0.52468E-02 ppm1 3.719 ppm2 4.011 CV 1
ASSI { 61}
(( segid " " and resid 40 and name H37B))
(( segid " " and resid 40 and name H32A))
4.000 2.000 2.000 peak 61 spectrum 1 weight 0.10000E+01 volume 0.17610E-02 ppm1 3.541 ppm2 4.010 CV 1
ASSI { 64}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 40 and name H7B ))
3.500 1.600 1.600 peak 64 spectrum 1 weight 0.10000E+01 volume 0.65489E-03 ppm1 3.300 ppm2 0.912 CV 1
OR { 64}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 40 and name H7A ))
ASSI { 65}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 40 and name H30%)
3.400 1.500 1.500 peak 65 spectrum 1 weight 0.10000E+01 volume 0.45096E-02 ppm1 4.148 ppm2 0.860 CV 1
ASSI { 66}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 40 and name H31%)
4.300 2.300 1.700 peak 66 spectrum 1 weight 0.10000E+01 volume 0.15038E-02 ppm1 4.137 ppm2 0.877 CV 1
OR { 66}
(( segid " " and resid 40 and name HB1 ))
( segid " " and resid 40 and name H31%)
OR { 66}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 40 and name H31%)
ASSI { 67}
(( segid " " and resid 40 and name H38B))
(( segid " " and resid 40 and name H32A))
4.500 2.500 1.500 peak 67 spectrum 1 weight 0.10000E+01 volume 0.21081E-02 ppm1 2.447 ppm2 4.010 CV 1
OR { 67}
(( segid " " and resid 40 and name H38A))
(( segid " " and resid 40 and name H32A))
ASSI { 68}
(( segid " " and resid 40 and name H43A))
(( segid " " and resid 40 and name H32A))
3.100 3.100 2.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.45976E-03 ppm1 2.822 ppm2 4.009 CV 1
OR { 68}
(( segid " " and resid 40 and name H43B))
(( segid " " and resid 40 and name H32A))
ASSI { 69}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name H32A))
4.200 2.200 1.800 peak 69 spectrum 1 weight 0.10000E+01 volume 0.19014E-02 ppm1 4.148 ppm2 4.014 CV 1
OR { 69}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name H32A))
ASSI { 70}
(( segid " " and resid 40 and name HB1 ))
( segid " " and resid 40 and name H30%)
4.100 2.100 1.900 peak 70 spectrum 1 weight 0.10000E+01 volume 0.40031E-02 ppm1 4.117 ppm2 0.859 CV 1
ASSI { 71}
(( segid " " and resid 40 and name H2B ))
(( segid " " and resid 40 and name H5A ))
3.800 1.800 1.800 peak 71 spectrum 1 weight 0.10000E+01 volume 0.24228E-02 ppm1 2.456 ppm2 0.656 CV 1
OR { 71}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H5A ))
OR { 71}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H5B ))
OR { 71}
(( segid " " and resid 40 and name H2B ))
(( segid " " and resid 40 and name H5B ))
OR { 71}
(( segid " " and resid 40 and name H2B ))
(( segid " " and resid 40 and name H6B ))
OR { 71}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H6B ))
OR { 71}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H6A ))
ASSI { 72}
(( segid " " and resid 40 and name H2B ))
(( segid " " and resid 40 and name H4B ))
2.700 0.900 0.900 peak 72 spectrum 1 weight 0.10000E+01 volume 0.26068E-02 ppm1 2.456 ppm2 0.745 CV 1
OR { 72}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H4A ))
OR { 72}
(( segid " " and resid 40 and name H2A ))
(( segid " " and resid 40 and name H4B ))
OR { 72}
(( segid " " and resid 40 and name H2B ))
(( segid " " and resid 40 and name H4A ))
ASSI { 73}
(( segid " " and resid 40 and name H3A ))
(( segid " " and resid 40 and name H7A ))
5.800 4.200 0.200 peak 73 spectrum 1 weight 0.10000E+01 volume 0.26855E-03 ppm1 1.216 ppm2 0.911 CV 1
OR { 73}
(( segid " " and resid 40 and name H3A ))
(( segid " " and resid 40 and name H7B ))
OR { 73}
(( segid " " and resid 40 and name H3B ))
(( segid " " and resid 40 and name H7B ))
OR { 73}
(( segid " " and resid 40 and name H3B ))
(( segid " " and resid 40 and name H7A ))
ASSI { 74}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 40 and name H7A ))
4.000 2.000 2.000 peak 74 spectrum 1 weight 0.10000E+01 volume 0.36702E-03 ppm1 1.592 ppm2 0.905 CV 1
ASSI { 75}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 40 and name H7B ))
4.200 2.200 1.800 peak 75 spectrum 1 weight 0.10000E+01 volume 0.43584E-03 ppm1 1.475 ppm2 0.906 CV 1
OR { 75}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 40 and name H7A ))
ASSI { 77}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 40 and name H7B ))
4.100 2.100 1.900 peak 77 spectrum 1 weight 0.10000E+01 volume 0.69627E-03 ppm1 0.313 ppm2 0.911 CV 1
OR { 77}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 40 and name H7A ))
ASSI { 78}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 40 and name H6B ))
3.500 1.500 1.500 peak 78 spectrum 1 weight 0.10000E+01 volume 0.48614E-03 ppm1 1.588 ppm2 0.655 CV 1
OR { 78}
( segid " " and resid 72 and name HB% )
(( segid " " and resid 40 and name H6A ))
ASSI { 80}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 40 and name H3A ))
4.200 2.200 1.800 peak 80 spectrum 1 weight 0.10000E+01 volume 0.51203E-03 ppm1 3.128 ppm2 1.225 CV 1
OR { 80}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 40 and name H3B ))
OR { 80}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 40 and name H3A ))
OR { 80}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 40 and name H3B ))
ASSI { 86}
( segid " " and resid 40 and name H30%)
(( segid " " and resid 40 and name H42A))
5.000 3.100 1.000 peak 86 spectrum 1 weight 0.10000E+01 volume 0.69548E-03 ppm1 0.864 ppm2 3.167 CV 1
ASSI { 87}
( segid " " and resid 40 and name H30%)
(( segid " " and resid 40 and name H42B))
4.300 2.300 1.700 peak 87 spectrum 1 weight 0.10000E+01 volume 0.90473E-03 ppm1 0.867 ppm2 3.211 CV 1
ASSI { 88}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name H38B))
5.000 3.100 1.000 peak 88 spectrum 1 weight 0.10000E+01 volume 0.37379E-03 ppm1 4.141 ppm2 2.447 CV 1
OR { 88}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name H38B))
OR { 88}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name H38A))
OR { 88}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name H38A))
ASSI { 89}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name H43B))
4.800 2.900 1.200 peak 89 spectrum 1 weight 0.10000E+01 volume 0.43224E-03 ppm1 4.145 ppm2 2.831 CV 1
OR { 89}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name H43B))
OR { 89}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name H43A))
OR { 89}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name H43A))
ASSI { 92}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H2A ))
5.100 3.200 0.900 peak 92 spectrum 1 weight 0.10000E+01 volume 0.50009E-03 ppm1 0.404 ppm2 2.455 CV 1
OR { 92}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H2B ))
ASSI { 94}
( segid " " and resid 66 and name HD1%)
(( segid " " and resid 40 and name H7A ))
4.000 2.000 2.000 peak 94 spectrum 1 weight 0.10000E+01 volume 0.69187E-03 ppm1 0.408 ppm2 0.909 CV 1
ASSI { 101}
(( segid " " and resid 40 and name H36A))
(( segid " " and resid 40 and name H43A))
5.900 4.300 0.100 peak 101 spectrum 1 weight 0.10000E+01 volume 0.23050E-03 ppm1 8.025 ppm2 2.821 CV 1
OR { 101}
(( segid " " and resid 40 and name H36A))
(( segid " " and resid 40 and name H43B))
ASSI { 103}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 40 and name H42A))
5.600 3.900 0.400 peak 103 spectrum 1 weight 0.10000E+01 volume 0.24607E-03 ppm1 1.259 ppm2 3.167 CV 1
ASSI { 104}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 40 and name H43A))
3.900 1.900 1.900 peak 104 spectrum 1 weight 0.10000E+01 volume 0.47178E-03 ppm1 4.028 ppm2 2.820 CV 1
OR { 104}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 40 and name H43B))
ASSI { 106}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H4B ))
4.200 2.200 1.800 peak 106 spectrum 1 weight 0.10000E+01 volume 0.34568E-03 ppm1 7.174 ppm2 0.755 CV 1
OR { 106}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H4A ))
ASSI { 107}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H5A ))
4.600 2.600 1.400 peak 107 spectrum 1 weight 0.10000E+01 volume 0.42612E-03 ppm1 7.184 ppm2 0.652 CV 1
OR { 107}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H6B ))
OR { 107}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H5B ))
OR { 107}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H6A ))
ASSI { 108}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H4B ))
3.500 1.500 1.500 peak 108 spectrum 1 weight 0.10000E+01 volume 0.53221E-03 ppm1 6.975 ppm2 0.741 CV 1
OR { 108}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H4A ))
ASSI { 110}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H6B ))
3.900 1.900 1.900 peak 110 spectrum 1 weight 0.10000E+01 volume 0.56601E-03 ppm1 6.973 ppm2 0.654 CV 1
OR { 110}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H5A ))
OR { 110}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H5B ))
OR { 110}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H6A ))
ASSI { 111}
( segid " " and resid 32 and name HE% )
( segid " " and resid 40 and name H8% )
4.800 2.900 1.200 peak 111 spectrum 1 weight 0.10000E+01 volume 0.39273E-03 ppm1 6.975 ppm2 0.613 CV 1
ASSI { 112}
(( segid " " and resid 32 and name HZ ))
( segid " " and resid 40 and name H8% )
4.100 2.100 1.900 peak 112 spectrum 1 weight 0.10000E+01 volume 0.45159E-03 ppm1 6.858 ppm2 0.610 CV 1
ASSI { 113}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 40 and name H6B ))
4.300 2.300 1.700 peak 113 spectrum 1 weight 0.10000E+01 volume 0.35342E-03 ppm1 6.857 ppm2 0.653 CV 1
OR { 113}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 40 and name H5A ))
OR { 113}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 40 and name H6A ))
OR { 113}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 40 and name H5B ))
ASSI { 114}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 40 and name H4B ))
4.700 2.700 1.300 peak 114 spectrum 1 weight 0.10000E+01 volume 0.34783E-03 ppm1 6.859 ppm2 0.757 CV 1
OR { 114}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 40 and name H4A ))
ASSI { 115}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H2B ))
3.600 1.700 1.700 peak 115 spectrum 1 weight 0.10000E+01 volume 0.58294E-03 ppm1 7.181 ppm2 2.456 CV 1
OR { 115}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H2A ))
ASSI { 116}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 40 and name H4A ))
4.700 2.800 1.300 peak 116 spectrum 1 weight 0.10000E+01 volume 0.43643E-03 ppm1 0.312 ppm2 0.752 CV 1
OR { 116}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 40 and name H4B ))
ASSI { 119}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H3A ))
3.800 1.800 1.800 peak 119 spectrum 1 weight 0.10000E+01 volume 0.42189E-03 ppm1 7.182 ppm2 1.215 CV 1
OR { 119}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 40 and name H3B ))
ASSI { 120}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H7A ))
4.400 2.400 1.600 peak 120 spectrum 1 weight 0.10000E+01 volume 0.28643E-03 ppm1 6.965 ppm2 0.905 CV 1
OR { 120}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 40 and name H7B ))
ASSI { 121}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 40 and name H43B))
4.000 2.000 2.000 peak 121 spectrum 1 weight 0.10000E+01 volume 0.32745E-03 ppm1 4.454 ppm2 2.815 CV 1
OR { 121}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 40 and name H43A))
ASSI { 123}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 40 and name H42B))
4.600 2.600 1.400 peak 123 spectrum 1 weight 0.10000E+01 volume 0.24792E-03 ppm1 1.256 ppm2 3.217 CV 1
ASSI { 124}
(( segid " " and resid 40 and name H41A))
(( segid " " and resid 40 and name H32A))
2.900 2.900 3.100 peak 124 spectrum 1 weight 0.10000E+01 volume 0.66545E-03 ppm1 8.184 ppm2 4.011 CV 1
ASSI { 1}
( segid " " and resid 54 and name HD% )
(( segid " " and resid 54 and name HA ))
2.500 0.800 0.800 peak 1 spectrum 1 weight 0.10000E+01 volume 0.43358E-02 ppm1 7.459 ppm2 4.839 CV 1
ASSI { 6}
(( segid " " and resid 79 and name HD2 ))
(( segid " " and resid 79 and name HB1 ))
3.200 1.300 1.300 peak 6 spectrum 1 weight 0.10000E+01 volume 0.13285E-02 ppm1 7.001 ppm2 3.572 CV 1
ASSI { 7}
(( segid " " and resid 79 and name HD2 ))
(( segid " " and resid 79 and name HB2 ))
3.300 1.300 1.300 peak 7 spectrum 1 weight 0.10000E+01 volume 0.16131E-02 ppm1 7.004 ppm2 2.514 CV 1
ASSI { 8}
( segid " " and resid 75 and name HD% )
(( segid " " and resid 75 and name HA ))
3.300 1.300 1.300 peak 8 spectrum 1 weight 0.10000E+01 volume 0.12029E-02 ppm1 6.816 ppm2 4.216 CV 1
ASSI { 15}
( segid " " and resid 75 and name HE% )
( segid " " and resid 75 and name HD% )
1.800 0.400 0.400 peak 15 spectrum 1 weight 0.10000E+01 volume 0.22138E-01 ppm1 6.533 ppm2 6.818 CV 1
ASSI { 16}
( segid " " and resid 75 and name HE% )
(( segid " " and resid 58 and name HA ))
2.700 0.900 0.900 peak 16 spectrum 1 weight 0.10000E+01 volume 0.19737E-02 ppm1 6.538 ppm2 4.510 CV 1
ASSI { 17}
( segid " " and resid 75 and name HE% )
(( segid " " and resid 59 and name HD1 ))
3.500 1.500 1.500 peak 17 spectrum 1 weight 0.10000E+01 volume 0.13595E-02 ppm1 6.532 ppm2 3.814 CV 1
OR { 17}
( segid " " and resid 75 and name HE% )
(( segid " " and resid 59 and name HD2 ))
ASSI { 18}
( segid " " and resid 75 and name HE% )
(( segid " " and resid 62 and name HB2 ))
2.900 1.000 1.000 peak 18 spectrum 1 weight 0.10000E+01 volume 0.28457E-02 ppm1 6.533 ppm2 2.418 CV 1
OR { 18}
( segid " " and resid 75 and name HE% )
(( segid " " and resid 62 and name HB1 ))
ASSI { 19}
( segid " " and resid 75 and name HE% )
(( segid " " and resid 58 and name HG12))
2.400 0.700 0.700 peak 19 spectrum 1 weight 0.10000E+01 volume 0.29515E-02 ppm1 6.534 ppm2 0.846 CV 1
ASSI { 21}
( segid " " and resid 75 and name HE% )
( segid " " and resid 58 and name HG2%)
3.000 1.100 1.100 peak 21 spectrum 1 weight 0.10000E+01 volume 0.20884E-02 ppm1 6.531 ppm2 0.356 CV 1
ASSI { 22}
( segid " " and resid 75 and name HE% )
(( segid " " and resid 58 and name HG11))
4.100 2.100 1.900 peak 22 spectrum 1 weight 0.10000E+01 volume 0.72630E-03 ppm1 6.536 ppm2 1.537 CV 1
ASSI { 24}
( segid " " and resid 54 and name HD% )
(( segid " " and resid 54 and name HB1 ))
2.600 0.800 0.800 peak 24 spectrum 1 weight 0.10000E+01 volume 0.32136E-02 ppm1 7.458 ppm2 3.435 CV 1
ASSI { 25}
( segid " " and resid 54 and name HD% )
(( segid " " and resid 54 and name HB2 ))
2.300 0.700 0.700 peak 25 spectrum 1 weight 0.10000E+01 volume 0.44053E-02 ppm1 7.458 ppm2 2.740 CV 1
ASSI { 26}
( segid " " and resid 54 and name HE% )
( segid " " and resid 54 and name HD% )
1.900 0.400 0.400 peak 26 spectrum 1 weight 0.10000E+01 volume 0.11932E-01 ppm1 7.123 ppm2 7.460 CV 1
ASSI { 29}
( segid " " and resid 54 and name HE% )
( segid " " and resid 11 and name HD2%)
3.200 1.300 1.300 peak 29 spectrum 1 weight 0.10000E+01 volume 0.78825E-03 ppm1 7.123 ppm2 0.879 CV 1
OR { 29}
( segid " " and resid 54 and name HE% )
( segid " " and resid 11 and name HD1%)
ASSI { 32}
(( segid " " and resid 54 and name HZ ))
( segid " " and resid 54 and name HE% )
2.100 0.500 0.500 peak 32 spectrum 1 weight 0.10000E+01 volume 0.63303E-02 ppm1 7.456 ppm2 7.124 CV 1
ASSI { 33}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 32 and name HB1 ))
2.300 0.700 0.700 peak 33 spectrum 1 weight 0.10000E+01 volume 0.52053E-02 ppm1 7.185 ppm2 3.138 CV 1
OR { 33}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 32 and name HB2 ))
ASSI { 34}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 32 and name HA ))
2.900 1.100 1.100 peak 34 spectrum 1 weight 0.10000E+01 volume 0.18440E-02 ppm1 7.188 ppm2 4.087 CV 1
ASSI { 40}
( segid " " and resid 32 and name HE% )
( segid " " and resid 32 and name HD% )
2.600 0.900 0.900 peak 40 spectrum 1 weight 0.10000E+01 volume 0.20533E-02 ppm1 6.985 ppm2 7.192 CV 1
ASSI { 46}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 32 and name HZ ))
2.200 0.600 0.600 peak 46 spectrum 1 weight 0.10000E+01 volume 0.71994E-02 ppm1 6.981 ppm2 6.865 CV 1
ASSI { 49}
(( segid " " and resid 32 and name HZ ))
( segid " " and resid 72 and name HB% )
3.700 1.700 1.700 peak 49 spectrum 1 weight 0.10000E+01 volume 0.58742E-03 ppm1 6.864 ppm2 1.599 CV 1
Contact the webmaster for help, if required. Saturday, June 1, 2024 6:18:09 PM GMT (wattos1)