NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
8649 |
1mm2   |
5555 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 2}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HN ))
2.600 0.900 0.900 peak 2 spectrum 1 weight 0.10000E+01 volume 0.16221E-01 ppm1 4.658 ppm2 9.676 CV 1
ASSI { 3}
(( segid " " and resid 48 and name HD1 ))
(( segid " " and resid 48 and name HE1 ))
2.400 0.700 0.700 peak 3 spectrum 1 weight 0.10000E+01 volume 0.29960E-01 ppm1 7.304 ppm2 9.824 CV 1
ASSI { 4}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HN ))
3.100 1.200 1.200 peak 4 spectrum 1 weight 0.10000E+01 volume 0.65580E-02 ppm1 4.433 ppm2 9.336 CV 1
ASSI { 6}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HN ))
2.800 1.000 1.000 peak 6 spectrum 1 weight 0.10000E+01 volume 0.93641E-02 ppm1 3.866 ppm2 9.337 CV 1
ASSI { 8}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HB3 ))
2.200 0.600 0.600 peak 8 spectrum 1 weight 0.10000E+01 volume 0.11249E-01 ppm1 4.326 ppm2 3.845 CV 1
ASSI { 15}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HN ))
3.200 1.300 1.300 peak 15 spectrum 1 weight 0.10000E+01 volume 0.41714E-02 ppm1 5.536 ppm2 9.197 CV 1
ASSI { 16}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HN ))
3.700 1.700 1.700 peak 16 spectrum 1 weight 0.10000E+01 volume 0.45806E-02 ppm1 2.977 ppm2 9.197 CV 1
ASSI { 17}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HN ))
2.600 0.800 0.800 peak 17 spectrum 1 weight 0.10000E+01 volume 0.87004E-02 ppm1 2.422 ppm2 9.198 CV 1
ASSI { 20}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HB3 ))
1.600 0.300 0.600 peak 20 spectrum 1 weight 0.10000E+01 volume 0.42986E-01 ppm1 2.974 ppm2 2.405 CV 1
ASSI { 21}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB3 ))
3.200 1.300 1.300 peak 21 spectrum 1 weight 0.10000E+01 volume 0.62966E-02 ppm1 5.536 ppm2 2.406 CV 1
ASSI { 22}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB2 ))
2.600 0.900 0.900 peak 22 spectrum 1 weight 0.10000E+01 volume 0.91819E-02 ppm1 5.534 ppm2 2.961 CV 1
ASSI { 23}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HN ))
2.600 0.800 0.800 peak 23 spectrum 1 weight 0.10000E+01 volume 0.10385E-01 ppm1 3.887 ppm2 9.197 CV 1
ASSI { 24}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HN ))
2.900 1.100 1.100 peak 24 spectrum 1 weight 0.10000E+01 volume 0.77788E-02 ppm1 4.534 ppm2 9.099 CV 1
ASSI { 26}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HN ))
3.500 1.500 1.500 peak 26 spectrum 1 weight 0.10000E+01 volume 0.76447E-02 ppm1 2.968 ppm2 9.101 CV 1
ASSI { 28}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HB2 ))
3.100 1.200 1.200 peak 28 spectrum 1 weight 0.10000E+01 volume 0.10753E-01 ppm1 4.536 ppm2 3.197 CV 1
ASSI { 29}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HB3 ))
2.300 0.700 0.700 peak 29 spectrum 1 weight 0.10000E+01 volume 0.18157E-01 ppm1 4.533 ppm2 2.950 CV 1
ASSI { 30}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HN ))
2.900 1.000 1.000 peak 30 spectrum 1 weight 0.10000E+01 volume 0.69672E-02 ppm1 3.467 ppm2 9.093 CV 1
ASSI { 31}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HN ))
3.300 1.300 1.300 peak 31 spectrum 1 weight 0.10000E+01 volume 0.76859E-02 ppm1 3.320 ppm2 9.093 CV 1
ASSI { 37}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HN ))
2.700 0.900 0.900 peak 37 spectrum 1 weight 0.10000E+01 volume 0.13632E-01 ppm1 0.787 ppm2 9.032 CV 1
ASSI { 38}
(( segid " " and resid 22 and name HG ))
(( segid " " and resid 22 and name HN ))
4.200 2.200 1.800 peak 38 spectrum 1 weight 0.10000E+01 volume 0.29021E-02 ppm1 0.601 ppm2 9.034 CV 1
ASSI { 47}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 22 and name HD1%)
2.800 1.000 1.000 peak 47 spectrum 1 weight 0.10000E+01 volume 0.84219E-02 ppm1 1.250 ppm2 0.368 CV 1
ASSI { 48}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 22 and name HD1%)
2.400 0.700 0.700 peak 48 spectrum 1 weight 0.10000E+01 volume 0.23409E-01 ppm1 0.791 ppm2 0.368 CV 1
ASSI { 49}
(( segid " " and resid 22 and name HG ))
( segid " " and resid 22 and name HD1%)
2.200 0.600 0.600 peak 49 spectrum 1 weight 0.10000E+01 volume 0.27102E-01 ppm1 0.602 ppm2 0.368 CV 1
ASSI { 55}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB3 ))
2.600 0.800 0.800 peak 55 spectrum 1 weight 0.10000E+01 volume 0.19069E-01 ppm1 4.336 ppm2 0.775 CV 1
ASSI { 56}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HG ))
3.300 1.300 1.300 peak 56 spectrum 1 weight 0.10000E+01 volume 0.43330E-02 ppm1 4.336 ppm2 0.586 CV 1
ASSI { 57}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 22 and name HD1%)
3.200 1.300 1.300 peak 57 spectrum 1 weight 0.10000E+01 volume 0.19148E-01 ppm1 4.336 ppm2 0.367 CV 1
ASSI { 58}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HN ))
3.200 1.300 1.300 peak 58 spectrum 1 weight 0.10000E+01 volume 0.43158E-02 ppm1 4.112 ppm2 8.990 CV 1
ASSI { 59}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HN ))
3.000 1.100 1.100 peak 59 spectrum 1 weight 0.10000E+01 volume 0.65924E-02 ppm1 2.273 ppm2 8.990 CV 1
ASSI { 60}
(( segid " " and resid 10 and name HG3 ))
(( segid " " and resid 10 and name HN ))
2.600 0.900 0.900 peak 60 spectrum 1 weight 0.10000E+01 volume 0.12088E-01 ppm1 2.135 ppm2 8.990 CV 1
ASSI { 61}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HN ))
2.800 1.000 1.000 peak 61 spectrum 1 weight 0.10000E+01 volume 0.14199E-01 ppm1 1.832 ppm2 8.989 CV 1
OR { 61}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HN ))
ASSI { 68}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HG2 ))
3.200 1.300 1.300 peak 68 spectrum 1 weight 0.10000E+01 volume 0.64754E-02 ppm1 4.109 ppm2 2.258 CV 1
ASSI { 69}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HG3 ))
2.900 1.000 1.000 peak 69 spectrum 1 weight 0.10000E+01 volume 0.26259E-01 ppm1 4.109 ppm2 2.125 CV 1
ASSI { 70}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HB3 ))
2.900 1.100 1.100 peak 70 spectrum 1 weight 0.10000E+01 volume 0.78201E-02 ppm1 4.107 ppm2 1.817 CV 1
OR { 70}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 77}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 26 and name HN ))
3.100 1.200 1.200 peak 77 spectrum 1 weight 0.10000E+01 volume 0.96289E-02 ppm1 1.063 ppm2 9.677 CV 1
ASSI { 78}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 26 and name HG2%)
2.100 0.600 0.600 peak 78 spectrum 1 weight 0.10000E+01 volume 0.61935E-01 ppm1 4.654 ppm2 1.051 CV 1
ASSI { 79}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HN ))
2.900 1.000 1.000 peak 79 spectrum 1 weight 0.10000E+01 volume 0.87107E-02 ppm1 4.007 ppm2 8.840 CV 1
ASSI { 80}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 14 and name HN ))
2.400 0.700 0.700 peak 80 spectrum 1 weight 0.10000E+01 volume 0.18618E-01 ppm1 2.298 ppm2 8.840 CV 1
ASSI { 81}
( segid " " and resid 14 and name HG1%)
(( segid " " and resid 14 and name HN ))
3.600 1.600 1.600 peak 81 spectrum 1 weight 0.10000E+01 volume 0.11331E-01 ppm1 1.317 ppm2 8.841 CV 1
ASSI { 82}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 14 and name HN ))
3.000 1.100 1.100 peak 82 spectrum 1 weight 0.10000E+01 volume 0.64892E-02 ppm1 1.134 ppm2 8.841 CV 1
ASSI { 83}
( segid " " and resid 14 and name HG1%)
( segid " " and resid 14 and name HG2%)
2.200 0.600 0.600 peak 83 spectrum 1 weight 0.10000E+01 volume 0.41920E-01 ppm1 1.314 ppm2 1.122 CV 1
ASSI { 84}
(( segid " " and resid 14 and name HB ))
( segid " " and resid 14 and name HG2%)
2.200 0.600 0.600 peak 84 spectrum 1 weight 0.10000E+01 volume 0.26242E-01 ppm1 2.304 ppm2 1.122 CV 1
ASSI { 85}
(( segid " " and resid 14 and name HB ))
( segid " " and resid 14 and name HG1%)
2.300 0.600 0.600 peak 85 spectrum 1 weight 0.10000E+01 volume 0.25094E-01 ppm1 2.304 ppm2 1.301 CV 1
ASSI { 86}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 14 and name HG1%)
2.400 0.700 0.700 peak 86 spectrum 1 weight 0.10000E+01 volume 0.25372E-01 ppm1 4.009 ppm2 1.301 CV 1
ASSI { 87}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 14 and name HG2%)
2.500 0.800 0.800 peak 87 spectrum 1 weight 0.10000E+01 volume 0.23219E-01 ppm1 4.009 ppm2 1.123 CV 1
ASSI { 89}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HN ))
3.000 1.100 1.100 peak 89 spectrum 1 weight 0.10000E+01 volume 0.61763E-02 ppm1 4.176 ppm2 8.830 CV 1
ASSI { 90}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 9 and name HN ))
2.700 0.900 0.900 peak 90 spectrum 1 weight 0.10000E+01 volume 0.17607E-01 ppm1 2.649 ppm2 8.829 CV 1
OR { 90}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HN ))
ASSI { 93}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HN ))
3.400 1.500 1.500 peak 93 spectrum 1 weight 0.10000E+01 volume 0.94604E-02 ppm1 1.879 ppm2 8.830 CV 1
ASSI { 94}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HN ))
2.500 0.800 0.800 peak 94 spectrum 1 weight 0.10000E+01 volume 0.97149E-02 ppm1 1.698 ppm2 8.830 CV 1
ASSI { 96}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HB3 ))
2.500 0.800 0.800 peak 96 spectrum 1 weight 0.10000E+01 volume 0.16857E-01 ppm1 2.647 ppm2 1.674 CV 1
OR { 96}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 9 and name HB3 ))
ASSI { 99}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HB2 ))
3.200 1.300 1.300 peak 99 spectrum 1 weight 0.10000E+01 volume 0.47319E-02 ppm1 2.647 ppm2 1.865 CV 1
OR { 99}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 102}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HG3 ))
2.800 1.000 1.000 peak 102 spectrum 1 weight 0.10000E+01 volume 0.11960E-01 ppm1 4.182 ppm2 2.635 CV 1
OR { 102}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HG2 ))
ASSI { 104}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HN ))
2.800 1.000 1.000 peak 104 spectrum 1 weight 0.10000E+01 volume 0.10117E-01 ppm1 4.189 ppm2 8.775 CV 1
ASSI { 105}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 20 and name HN ))
4.300 2.300 1.700 peak 105 spectrum 1 weight 0.10000E+01 volume 0.32161E-02 ppm1 2.247 ppm2 8.775 CV 1
ASSI { 106}
(( segid " " and resid 20 and name HG3 ))
(( segid " " and resid 20 and name HN ))
4.900 3.100 1.100 peak 106 spectrum 1 weight 0.10000E+01 volume 0.12335E-02 ppm1 2.174 ppm2 8.775 CV 1
ASSI { 107}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HN ))
2.600 0.800 0.800 peak 107 spectrum 1 weight 0.10000E+01 volume 0.10526E-01 ppm1 2.091 ppm2 8.775 CV 1
ASSI { 108}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name HN ))
3.200 1.300 1.300 peak 108 spectrum 1 weight 0.10000E+01 volume 0.12944E-01 ppm1 2.022 ppm2 8.775 CV 1
ASSI { 114}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HN ))
2.200 0.600 0.600 peak 114 spectrum 1 weight 0.10000E+01 volume 0.15730E-01 ppm1 3.321 ppm2 8.679 CV 1
ASSI { 115}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 32 and name HN ))
3.600 1.700 1.700 peak 115 spectrum 1 weight 0.10000E+01 volume 0.44396E-02 ppm1 2.798 ppm2 8.679 CV 1
ASSI { 120}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 43 and name HN ))
4.200 2.200 1.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.20008E-02 ppm1 1.779 ppm2 8.676 CV 1
ASSI { 121}
(( segid " " and resid 43 and name HG13))
(( segid " " and resid 43 and name HN ))
2.600 0.800 0.800 peak 121 spectrum 1 weight 0.10000E+01 volume 0.96220E-02 ppm1 1.079 ppm2 8.676 CV 1
ASSI { 122}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 43 and name HN ))
2.900 1.100 1.100 peak 122 spectrum 1 weight 0.10000E+01 volume 0.76412E-02 ppm1 0.907 ppm2 8.675 CV 1
ASSI { 124}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 43 and name HD1%)
2.500 0.800 0.800 peak 124 spectrum 1 weight 0.10000E+01 volume 0.16613E-01 ppm1 1.782 ppm2 0.776 CV 1
ASSI { 127}
( segid " " and resid 43 and name HD1%)
(( segid " " and resid 43 and name HN ))
3.900 1.900 1.900 peak 127 spectrum 1 weight 0.10000E+01 volume 0.70119E-02 ppm1 0.790 ppm2 8.675 CV 1
ASSI { 131}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 43 and name HD1%)
4.400 2.400 1.600 peak 131 spectrum 1 weight 0.10000E+01 volume 0.38756E-02 ppm1 3.923 ppm2 0.776 CV 1
ASSI { 133}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HG13))
3.400 1.500 1.500 peak 133 spectrum 1 weight 0.10000E+01 volume 0.66749E-02 ppm1 3.923 ppm2 1.067 CV 1
ASSI { 135}
(( segid " " and resid 19 and name HA1 ))
(( segid " " and resid 19 and name HN ))
3.100 1.200 1.200 peak 135 spectrum 1 weight 0.10000E+01 volume 0.46494E-02 ppm1 4.551 ppm2 8.648 CV 1
ASSI { 136}
(( segid " " and resid 19 and name HA2 ))
(( segid " " and resid 19 and name HN ))
2.800 1.000 1.000 peak 136 spectrum 1 weight 0.10000E+01 volume 0.16758E-01 ppm1 3.673 ppm2 8.646 CV 1
ASSI { 137}
(( segid " " and resid 19 and name HA1 ))
(( segid " " and resid 19 and name HA2 ))
1.800 0.400 0.400 peak 137 spectrum 1 weight 0.10000E+01 volume 0.55985E-01 ppm1 4.554 ppm2 3.659 CV 1
ASSI { 142}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HB3 ))
2.900 1.100 1.100 peak 142 spectrum 1 weight 0.10000E+01 volume 0.12662E-01 ppm1 5.312 ppm2 2.982 CV 1
ASSI { 143}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HB2 ))
2.800 1.000 1.000 peak 143 spectrum 1 weight 0.10000E+01 volume 0.11252E-01 ppm1 5.312 ppm2 3.085 CV 1
ASSI { 146}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HN ))
3.000 1.100 1.100 peak 146 spectrum 1 weight 0.10000E+01 volume 0.58805E-02 ppm1 4.683 ppm2 8.596 CV 1
ASSI { 151}
(( segid " " and resid 18 and name HA1 ))
(( segid " " and resid 18 and name HA2 ))
2.700 0.900 0.900 peak 151 spectrum 1 weight 0.10000E+01 volume 0.48282E-02 ppm1 4.503 ppm2 3.901 CV 1
ASSI { 153}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 45 and name HN ))
2.800 1.000 1.000 peak 153 spectrum 1 weight 0.10000E+01 volume 0.11930E-01 ppm1 2.777 ppm2 8.563 CV 1
OR { 153}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HN ))
ASSI { 155}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HN ))
3.800 1.800 1.800 peak 155 spectrum 1 weight 0.10000E+01 volume 0.20345E-02 ppm1 4.366 ppm2 8.541 CV 1
ASSI { 165}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HN ))
3.000 1.200 1.200 peak 165 spectrum 1 weight 0.10000E+01 volume 0.96530E-02 ppm1 2.239 ppm2 8.453 CV 1
ASSI { 166}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 23 and name HN ))
3.300 1.400 1.400 peak 166 spectrum 1 weight 0.10000E+01 volume 0.46116E-02 ppm1 1.567 ppm2 8.453 CV 1
ASSI { 170}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HN ))
3.100 1.200 1.200 peak 170 spectrum 1 weight 0.10000E+01 volume 0.67781E-02 ppm1 4.587 ppm2 8.404 CV 1
ASSI { 171}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HN ))
3.200 1.300 1.300 peak 171 spectrum 1 weight 0.10000E+01 volume 0.67574E-02 ppm1 2.642 ppm2 8.404 CV 1
OR { 171}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HN ))
ASSI { 172}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB2 ))
2.600 0.800 0.800 peak 172 spectrum 1 weight 0.10000E+01 volume 0.22803E-01 ppm1 4.588 ppm2 2.630 CV 1
OR { 172}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB3 ))
ASSI { 173}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HN ))
2.800 1.000 1.000 peak 173 spectrum 1 weight 0.10000E+01 volume 0.94501E-02 ppm1 4.370 ppm2 8.390 CV 1
ASSI { 174}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 47 and name HN ))
3.500 1.600 1.600 peak 174 spectrum 1 weight 0.10000E+01 volume 0.76825E-02 ppm1 2.239 ppm2 8.390 CV 1
OR { 174}
(( segid " " and resid 47 and name HG3 ))
(( segid " " and resid 47 and name HN ))
ASSI { 175}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HN ))
2.500 0.800 0.800 peak 175 spectrum 1 weight 0.10000E+01 volume 0.19340E-01 ppm1 1.989 ppm2 8.390 CV 1
ASSI { 187}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HN ))
3.700 1.700 1.700 peak 187 spectrum 1 weight 0.10000E+01 volume 0.32422E-02 ppm1 3.341 ppm2 8.352 CV 1
ASSI { 188}
(( segid " " and resid 52 and name HD3 ))
(( segid " " and resid 52 and name HN ))
3.600 1.600 1.600 peak 188 spectrum 1 weight 0.10000E+01 volume 0.30410E-02 ppm1 3.210 ppm2 8.353 CV 1
ASSI { 197}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HD2 ))
4.100 2.100 1.900 peak 197 spectrum 1 weight 0.10000E+01 volume 0.41439E-02 ppm1 4.183 ppm2 3.330 CV 1
ASSI { 198}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HD3 ))
4.100 2.100 1.900 peak 198 spectrum 1 weight 0.10000E+01 volume 0.31827E-02 ppm1 4.183 ppm2 3.196 CV 1
ASSI { 202}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HN ))
2.900 1.000 1.000 peak 202 spectrum 1 weight 0.10000E+01 volume 0.65030E-02 ppm1 4.995 ppm2 8.347 CV 1
ASSI { 203}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HN ))
2.800 1.000 1.000 peak 203 spectrum 1 weight 0.10000E+01 volume 0.11878E-01 ppm1 2.917 ppm2 8.348 CV 1
ASSI { 204}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 37 and name HN ))
2.400 0.700 0.700 peak 204 spectrum 1 weight 0.10000E+01 volume 0.10626E-01 ppm1 2.625 ppm2 8.347 CV 1
ASSI { 206}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB3 ))
2.700 0.900 0.900 peak 206 spectrum 1 weight 0.10000E+01 volume 0.14223E-01 ppm1 4.999 ppm2 2.612 CV 1
ASSI { 207}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB2 ))
3.000 1.100 1.100 peak 207 spectrum 1 weight 0.10000E+01 volume 0.85697E-02 ppm1 4.999 ppm2 2.906 CV 1
ASSI { 208}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HN ))
3.400 1.400 1.400 peak 208 spectrum 1 weight 0.10000E+01 volume 0.28942E-02 ppm1 5.735 ppm2 7.581 CV 1
ASSI { 210}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 30 and name HN ))
3.500 1.500 1.500 peak 210 spectrum 1 weight 0.10000E+01 volume 0.52306E-02 ppm1 3.335 ppm2 7.580 CV 1
ASSI { 217}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HN ))
2.900 1.000 1.000 peak 217 spectrum 1 weight 0.10000E+01 volume 0.81605E-02 ppm1 5.040 ppm2 8.226 CV 1
ASSI { 219}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 27 and name HN ))
3.000 1.100 1.100 peak 219 spectrum 1 weight 0.10000E+01 volume 0.76963E-02 ppm1 2.724 ppm2 8.226 CV 1
ASSI { 223}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB2 ))
2.400 0.700 0.700 peak 223 spectrum 1 weight 0.10000E+01 volume 0.18694E-01 ppm1 5.043 ppm2 3.260 CV 1
ASSI { 224}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB3 ))
2.700 0.900 0.900 peak 224 spectrum 1 weight 0.10000E+01 volume 0.20145E-01 ppm1 5.039 ppm2 2.706 CV 1
ASSI { 236}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HN ))
3.200 1.200 1.200 peak 236 spectrum 1 weight 0.10000E+01 volume 0.55985E-02 ppm1 4.283 ppm2 8.233 CV 1
ASSI { 245}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB2 ))
2.800 1.000 1.000 peak 245 spectrum 1 weight 0.10000E+01 volume 0.13405E-01 ppm1 4.676 ppm2 3.134 CV 1
ASSI { 246}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB3 ))
2.900 1.000 1.000 peak 246 spectrum 1 weight 0.10000E+01 volume 0.11276E-01 ppm1 4.676 ppm2 3.069 CV 1
ASSI { 247}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HN ))
2.200 0.600 0.600 peak 247 spectrum 1 weight 0.10000E+01 volume 0.33240E-01 ppm1 4.173 ppm2 8.149 CV 1
ASSI { 252}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HN ))
3.600 1.600 1.600 peak 252 spectrum 1 weight 0.10000E+01 volume 0.43296E-02 ppm1 1.314 ppm2 8.149 CV 1
ASSI { 253}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HN ))
3.400 1.500 1.500 peak 253 spectrum 1 weight 0.10000E+01 volume 0.35042E-02 ppm1 1.212 ppm2 8.148 CV 1
ASSI { 254}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HN ))
3.500 1.500 1.500 peak 254 spectrum 1 weight 0.10000E+01 volume 0.33258E-02 ppm1 2.207 ppm2 8.149 CV 1
ASSI { 266}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HN ))
3.300 1.400 1.400 peak 266 spectrum 1 weight 0.10000E+01 volume 0.37862E-02 ppm1 3.398 ppm2 8.073 CV 1
ASSI { 267}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HN ))
3.000 1.100 1.100 peak 267 spectrum 1 weight 0.10000E+01 volume 0.79026E-02 ppm1 3.007 ppm2 8.073 CV 1
ASSI { 269}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB3 ))
2.400 0.700 0.700 peak 269 spectrum 1 weight 0.10000E+01 volume 0.25094E-01 ppm1 4.933 ppm2 2.988 CV 1
ASSI { 270}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HB3 ))
1.700 0.400 0.500 peak 270 spectrum 1 weight 0.10000E+01 volume 0.65889E-01 ppm1 3.405 ppm2 2.986 CV 1
ASSI { 277}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB2 ))
3.500 1.600 1.600 peak 277 spectrum 1 weight 0.10000E+01 volume 0.21552E-02 ppm1 4.301 ppm2 1.850 CV 1
ASSI { 283}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HN ))
2.700 0.900 0.900 peak 283 spectrum 1 weight 0.10000E+01 volume 0.10781E-01 ppm1 4.025 ppm2 8.001 CV 1
ASSI { 284}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 53 and name HN ))
2.800 1.000 1.000 peak 284 spectrum 1 weight 0.10000E+01 volume 0.79679E-02 ppm1 2.833 ppm2 8.001 CV 1
ASSI { 285}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 53 and name HN ))
2.600 0.900 0.900 peak 285 spectrum 1 weight 0.10000E+01 volume 0.14388E-01 ppm1 2.631 ppm2 8.001 CV 1
ASSI { 287}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB3 ))
2.900 1.100 1.100 peak 287 spectrum 1 weight 0.10000E+01 volume 0.10998E-01 ppm1 4.028 ppm2 2.616 CV 1
ASSI { 288}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB2 ))
2.600 0.800 0.800 peak 288 spectrum 1 weight 0.10000E+01 volume 0.16496E-01 ppm1 4.028 ppm2 2.824 CV 1
ASSI { 300}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HN ))
2.900 1.100 1.100 peak 300 spectrum 1 weight 0.10000E+01 volume 0.71942E-02 ppm1 4.352 ppm2 7.991 CV 1
ASSI { 301}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HN ))
2.500 0.800 0.800 peak 301 spectrum 1 weight 0.10000E+01 volume 0.12776E-01 ppm1 1.439 ppm2 7.993 CV 1
ASSI { 302}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 21 and name HN ))
2.800 1.000 1.000 peak 302 spectrum 1 weight 0.10000E+01 volume 0.13178E-01 ppm1 1.248 ppm2 7.993 CV 1
ASSI { 303}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HN ))
3.700 1.700 1.700 peak 303 spectrum 1 weight 0.10000E+01 volume 0.75209E-02 ppm1 0.910 ppm2 7.993 CV 1
ASSI { 304}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HN ))
4.100 2.100 1.900 peak 304 spectrum 1 weight 0.10000E+01 volume 0.46047E-02 ppm1 0.419 ppm2 7.993 CV 1
ASSI { 305}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HD1%)
4.700 2.700 1.300 peak 305 spectrum 1 weight 0.10000E+01 volume 0.23935E-02 ppm1 4.356 ppm2 0.405 CV 1
ASSI { 308}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB2 ))
3.400 1.500 1.500 peak 308 spectrum 1 weight 0.10000E+01 volume 0.38309E-02 ppm1 4.354 ppm2 1.421 CV 1
ASSI { 309}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HN ))
4.000 2.000 2.000 peak 309 spectrum 1 weight 0.10000E+01 volume 0.13742E-02 ppm1 4.190 ppm2 7.820 CV 1
ASSI { 314}
(( segid " " and resid 61 and name HG3 ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 314 spectrum 1 weight 0.10000E+01 volume 0.17941E-03 ppm1 1.389 ppm2 7.821 CV 1
OR { 314}
(( segid " " and resid 61 and name HG2 ))
(( segid " " and resid 61 and name HN ))
ASSI { 321}
(( segid " " and resid 46 and name HA1 ))
(( segid " " and resid 46 and name HN ))
3.600 1.600 1.600 peak 321 spectrum 1 weight 0.10000E+01 volume 0.25998E-02 ppm1 4.048 ppm2 8.118 CV 1
ASSI { 327}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 55 and name HN ))
2.800 1.000 1.000 peak 327 spectrum 1 weight 0.10000E+01 volume 0.14746E-01 ppm1 2.920 ppm2 7.687 CV 1
OR { 327}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HN ))
ASSI { 331}
(( segid " " and resid 54 and name HA ))
( segid " " and resid 54 and name HG2%)
3.000 1.100 1.100 peak 331 spectrum 1 weight 0.10000E+01 volume 0.13659E-01 ppm1 4.000 ppm2 1.001 CV 1
ASSI { 341}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 40 and name HN ))
2.200 0.600 0.600 peak 341 spectrum 1 weight 0.10000E+01 volume 0.17095E-01 ppm1 1.747 ppm2 7.531 CV 1
ASSI { 342}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HN ))
3.100 1.200 1.200 peak 342 spectrum 1 weight 0.10000E+01 volume 0.57086E-02 ppm1 1.539 ppm2 7.530 CV 1
ASSI { 343}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HN ))
3.000 1.100 1.100 peak 343 spectrum 1 weight 0.10000E+01 volume 0.15705E-01 ppm1 1.459 ppm2 7.530 CV 1
ASSI { 344}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 40 and name HN ))
4.200 2.200 1.800 peak 344 spectrum 1 weight 0.10000E+01 volume 0.34733E-02 ppm1 0.931 ppm2 7.530 CV 1
ASSI { 345}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 40 and name HN ))
4.400 2.400 1.600 peak 345 spectrum 1 weight 0.10000E+01 volume 0.29007E-02 ppm1 0.711 ppm2 7.530 CV 1
ASSI { 346}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HN ))
2.700 0.900 0.900 peak 346 spectrum 1 weight 0.10000E+01 volume 0.95705E-02 ppm1 4.454 ppm2 7.402 CV 1
ASSI { 348}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 35 and name HN ))
3.100 1.200 1.200 peak 348 spectrum 1 weight 0.10000E+01 volume 0.11809E-01 ppm1 2.878 ppm2 7.402 CV 1
ASSI { 349}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB2 ))
3.000 1.100 1.100 peak 349 spectrum 1 weight 0.10000E+01 volume 0.11641E-01 ppm1 4.451 ppm2 3.270 CV 1
ASSI { 350}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB3 ))
2.700 0.900 0.900 peak 350 spectrum 1 weight 0.10000E+01 volume 0.79954E-02 ppm1 4.451 ppm2 2.865 CV 1
ASSI { 355}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HN ))
3.400 1.400 1.400 peak 355 spectrum 1 weight 0.10000E+01 volume 0.57292E-02 ppm1 3.125 ppm2 7.134 CV 1
ASSI { 359}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HD2 ))
4.800 2.900 1.200 peak 359 spectrum 1 weight 0.10000E+01 volume 0.81605E-03 ppm1 4.667 ppm2 7.018 CV 1
ASSI { 360}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HD2 ))
3.800 1.800 1.800 peak 360 spectrum 1 weight 0.10000E+01 volume 0.23003E-02 ppm1 3.152 ppm2 7.019 CV 1
ASSI { 361}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HD2 ))
3.700 1.700 1.700 peak 361 spectrum 1 weight 0.10000E+01 volume 0.28278E-02 ppm1 3.072 ppm2 7.018 CV 1
ASSI { 362}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HN ))
2.500 0.800 0.800 peak 362 spectrum 1 weight 0.10000E+01 volume 0.18102E-01 ppm1 4.402 ppm2 6.981 CV 1
ASSI { 363}
(( segid " " and resid 42 and name HG2 ))
(( segid " " and resid 42 and name HN ))
3.900 1.900 1.900 peak 363 spectrum 1 weight 0.10000E+01 volume 0.35283E-02 ppm1 2.054 ppm2 6.983 CV 1
ASSI { 369}
(( segid " " and resid 49 and name HG ))
(( segid " " and resid 49 and name HN ))
2.900 1.000 1.000 peak 369 spectrum 1 weight 0.10000E+01 volume 0.79610E-02 ppm1 1.589 ppm2 6.870 CV 1
ASSI { 385}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HN ))
2.900 1.000 1.000 peak 385 spectrum 1 weight 0.10000E+01 volume 0.66233E-02 ppm1 4.460 ppm2 6.688 CV 1
ASSI { 387}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HN ))
3.900 1.900 1.900 peak 387 spectrum 1 weight 0.10000E+01 volume 0.26311E-02 ppm1 2.461 ppm2 6.688 CV 1
ASSI { 388}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HB3 ))
1.600 0.300 0.600 peak 388 spectrum 1 weight 0.10000E+01 volume 0.66749E-01 ppm1 2.715 ppm2 2.447 CV 1
ASSI { 389}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB3 ))
2.500 0.800 0.800 peak 389 spectrum 1 weight 0.10000E+01 volume 0.15362E-01 ppm1 4.465 ppm2 2.446 CV 1
ASSI { 390}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.400 0.700 0.700 peak 390 spectrum 1 weight 0.10000E+01 volume 0.18395E-01 ppm1 4.465 ppm2 2.699 CV 1
ASSI { 395}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HN ))
3.200 1.300 1.300 peak 395 spectrum 1 weight 0.10000E+01 volume 0.15179E-01 ppm1 1.189 ppm2 6.870 CV 1
ASSI { 398}
( segid " " and resid 49 and name HD2%)
(( segid " " and resid 49 and name HN ))
3.900 1.900 1.900 peak 398 spectrum 1 weight 0.10000E+01 volume 0.36659E-02 ppm1 0.757 ppm2 6.870 CV 1
ASSI { 399}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HN ))
2.700 0.900 0.900 peak 399 spectrum 1 weight 0.10000E+01 volume 0.93710E-02 ppm1 4.181 ppm2 6.500 CV 1
ASSI { 400}
(( segid " " and resid 36 and name HG ))
(( segid " " and resid 36 and name HN ))
1.800 0.400 0.400 peak 400 spectrum 1 weight 0.10000E+01 volume 0.36521E-01 ppm1 1.732 ppm2 6.502 CV 1
ASSI { 401}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HN ))
2.900 1.100 1.100 peak 401 spectrum 1 weight 0.10000E+01 volume 0.11194E-01 ppm1 1.473 ppm2 6.501 CV 1
OR { 401}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 36 and name HN ))
ASSI { 405}
(( segid " " and resid 8 and name HD2 ))
(( segid " " and resid 8 and name HE1 ))
4.100 2.100 1.900 peak 405 spectrum 1 weight 0.10000E+01 volume 0.35696E-02 ppm1 7.516 ppm2 8.595 CV 1
ASSI { 424}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 21 and name HD2%)
3.500 1.500 1.500 peak 424 spectrum 1 weight 0.10000E+01 volume 0.86798E-02 ppm1 1.450 ppm2 -0.150 CV 1
ASSI { 425}
(( segid " " and resid 21 and name HG ))
( segid " " and resid 21 and name HD2%)
2.200 0.600 0.600 peak 425 spectrum 1 weight 0.10000E+01 volume 0.26596E-01 ppm1 1.258 ppm2 -0.150 CV 1
ASSI { 426}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 21 and name HD2%)
2.500 0.800 0.800 peak 426 spectrum 1 weight 0.10000E+01 volume 0.11163E-01 ppm1 0.913 ppm2 -0.150 CV 1
ASSI { 427}
( segid " " and resid 21 and name HD1%)
( segid " " and resid 21 and name HD2%)
2.200 0.600 0.600 peak 427 spectrum 1 weight 0.10000E+01 volume 0.36487E-01 ppm1 0.423 ppm2 -0.150 CV 1
ASSI { 428}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 21 and name HD1%)
2.400 0.700 0.700 peak 428 spectrum 1 weight 0.10000E+01 volume 0.20269E-01 ppm1 1.450 ppm2 0.405 CV 1
ASSI { 430}
(( segid " " and resid 21 and name HG ))
( segid " " and resid 21 and name HD1%)
2.200 0.600 0.600 peak 430 spectrum 1 weight 0.10000E+01 volume 0.27408E-01 ppm1 1.258 ppm2 0.405 CV 1
ASSI { 431}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 21 and name HD1%)
2.700 0.900 0.900 peak 431 spectrum 1 weight 0.10000E+01 volume 0.14433E-01 ppm1 0.910 ppm2 0.403 CV 1
ASSI { 434}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 22 and name HD2%)
2.700 0.900 0.900 peak 434 spectrum 1 weight 0.10000E+01 volume 0.11118E-01 ppm1 1.255 ppm2 -0.634 CV 1
ASSI { 436}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 22 and name HD2%)
2.700 0.900 0.900 peak 436 spectrum 1 weight 0.10000E+01 volume 0.32594E-01 ppm1 0.788 ppm2 -0.634 CV 1
ASSI { 440}
( segid " " and resid 22 and name HD1%)
( segid " " and resid 22 and name HD2%)
2.300 0.700 0.700 peak 440 spectrum 1 weight 0.10000E+01 volume 0.27546E-01 ppm1 0.384 ppm2 -0.633 CV 1
ASSI { 441}
(( segid " " and resid 33 and name HB ))
( segid " " and resid 33 and name HD1%)
2.400 0.700 0.700 peak 441 spectrum 1 weight 0.10000E+01 volume 0.22587E-01 ppm1 2.086 ppm2 0.631 CV 1
ASSI { 442}
(( segid " " and resid 33 and name HG12))
( segid " " and resid 33 and name HD1%)
2.200 0.600 0.600 peak 442 spectrum 1 weight 0.10000E+01 volume 0.29385E-01 ppm1 1.463 ppm2 0.631 CV 1
ASSI { 443}
(( segid " " and resid 33 and name HG13))
( segid " " and resid 33 and name HD1%)
2.300 0.700 0.700 peak 443 spectrum 1 weight 0.10000E+01 volume 0.25812E-01 ppm1 1.291 ppm2 0.631 CV 1
ASSI { 448}
(( segid " " and resid 33 and name HB ))
( segid " " and resid 33 and name HG2%)
2.200 0.600 0.600 peak 448 spectrum 1 weight 0.10000E+01 volume 0.30830E-01 ppm1 2.086 ppm2 0.774 CV 1
ASSI { 449}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 33 and name HG13))
2.700 0.900 0.900 peak 449 spectrum 1 weight 0.10000E+01 volume 0.80436E-02 ppm1 2.086 ppm2 1.277 CV 1
ASSI { 451}
(( segid " " and resid 36 and name HG ))
( segid " " and resid 36 and name HD2%)
2.000 0.500 0.500 peak 451 spectrum 1 weight 0.10000E+01 volume 0.33595E-01 ppm1 1.737 ppm2 0.544 CV 1
ASSI { 490}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB3 ))
3.000 1.100 1.100 peak 490 spectrum 1 weight 0.10000E+01 volume 0.42470E-02 ppm1 5.730 ppm2 3.324 CV 1
ASSI { 495}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HD3 ))
4.600 2.600 1.400 peak 495 spectrum 1 weight 0.10000E+01 volume 0.22514E-02 ppm1 3.908 ppm2 3.140 CV 1
ASSI { 500}
(( segid " " and resid 13 and name HD2 ))
(( segid " " and resid 13 and name HG2 ))
3.400 1.400 1.400 peak 500 spectrum 1 weight 0.10000E+01 volume 0.41507E-02 ppm1 3.291 ppm2 1.690 CV 1
ASSI { 501}
(( segid " " and resid 13 and name HD2 ))
(( segid " " and resid 13 and name HG3 ))
3.800 1.800 1.800 peak 501 spectrum 1 weight 0.10000E+01 volume 0.90924E-03 ppm1 3.291 ppm2 1.606 CV 1
ASSI { 502}
(( segid " " and resid 13 and name HD2 ))
(( segid " " and resid 13 and name HB3 ))
3.600 1.600 1.600 peak 502 spectrum 1 weight 0.10000E+01 volume 0.38653E-02 ppm1 3.292 ppm2 1.364 CV 1
ASSI { 505}
(( segid " " and resid 13 and name HD3 ))
(( segid " " and resid 13 and name HG2 ))
4.100 2.200 1.900 peak 505 spectrum 1 weight 0.10000E+01 volume 0.54747E-03 ppm1 3.154 ppm2 1.691 CV 1
ASSI { 506}
(( segid " " and resid 13 and name HD3 ))
(( segid " " and resid 13 and name HG3 ))
3.300 1.400 1.400 peak 506 spectrum 1 weight 0.10000E+01 volume 0.49898E-02 ppm1 3.154 ppm2 1.606 CV 1
ASSI { 507}
(( segid " " and resid 13 and name HD3 ))
(( segid " " and resid 13 and name HB3 ))
3.400 1.500 1.500 peak 507 spectrum 1 weight 0.10000E+01 volume 0.31913E-02 ppm1 3.152 ppm2 1.365 CV 1
ASSI { 510}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB2 ))
3.800 1.800 1.800 peak 510 spectrum 1 weight 0.10000E+01 volume 0.25190E-02 ppm1 4.683 ppm2 3.863 CV 1
ASSI { 519}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HD3 ))
5.300 3.600 0.700 peak 519 spectrum 1 weight 0.10000E+01 volume 0.26167E-03 ppm1 4.474 ppm2 3.395 CV 1
ASSI { 528}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 44 and name HD3 ))
1.600 0.300 0.600 peak 528 spectrum 1 weight 0.10000E+01 volume 0.46597E-01 ppm1 3.682 ppm2 3.396 CV 1
ASSI { 533}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 44 and name HB2 ))
4.500 2.500 1.500 peak 533 spectrum 1 weight 0.10000E+01 volume 0.18171E-02 ppm1 3.412 ppm2 2.313 CV 1
ASSI { 542}
(( segid " " and resid 4 and name HA2 ))
(( segid " " and resid 4 and name HN ))
4.700 2.800 1.300 peak 542 spectrum 1 weight 0.10000E+01 volume 0.58461E-03 ppm1 3.982 ppm2 8.443 CV 1
ASSI { 560}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HD1 ))
2.900 1.000 1.000 peak 560 spectrum 1 weight 0.10000E+01 volume 0.14584E-01 ppm1 4.535 ppm2 7.292 CV 1
ASSI { 562}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HE1 ))
5.300 3.600 0.700 peak 562 spectrum 1 weight 0.10000E+01 volume 0.83703E-03 ppm1 4.542 ppm2 9.823 CV 1
ASSI { 563}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HE1 ))
5.800 4.200 0.200 peak 563 spectrum 1 weight 0.10000E+01 volume 0.49383E-03 ppm1 3.217 ppm2 9.823 CV 1
ASSI { 564}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HE1 ))
5.800 4.200 0.200 peak 564 spectrum 1 weight 0.10000E+01 volume 0.45531E-03 ppm1 2.966 ppm2 9.821 CV 1
ASSI { 565}
(( segid " " and resid 46 and name HA2 ))
(( segid " " and resid 46 and name HN ))
3.800 1.800 1.800 peak 565 spectrum 1 weight 0.10000E+01 volume 0.22167E-02 ppm1 3.983 ppm2 8.118 CV 1
ASSI { 577}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HG ))
3.200 1.300 1.300 peak 577 spectrum 1 weight 0.10000E+01 volume 0.63929E-02 ppm1 1.249 ppm2 0.586 CV 1
ASSI { 578}
(( segid " " and resid 19 and name HA2 ))
(( segid " " and resid 20 and name HN ))
3.300 1.400 1.400 peak 578 spectrum 1 weight 0.10000E+01 volume 0.12817E-01 ppm1 3.673 ppm2 8.776 CV 1
ASSI { 579}
(( segid " " and resid 19 and name HA1 ))
(( segid " " and resid 20 and name HN ))
2.300 0.700 0.700 peak 579 spectrum 1 weight 0.10000E+01 volume 0.22569E-01 ppm1 4.551 ppm2 8.777 CV 1
ASSI { 585}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 21 and name HN ))
5.200 3.300 0.800 peak 585 spectrum 1 weight 0.10000E+01 volume 0.10179E-02 ppm1 2.247 ppm2 7.993 CV 1
ASSI { 586}
(( segid " " and resid 20 and name HG3 ))
(( segid " " and resid 21 and name HN ))
6.000 4.800 0.000 peak 586 spectrum 1 weight 0.10000E+01 volume 0.51893E-03 ppm1 2.174 ppm2 7.993 CV 1
ASSI { 587}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 21 and name HN ))
4.400 2.400 1.600 peak 587 spectrum 1 weight 0.10000E+01 volume 0.26521E-02 ppm1 2.091 ppm2 7.992 CV 1
ASSI { 589}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 21 and name HN ))
4.900 3.000 1.100 peak 589 spectrum 1 weight 0.10000E+01 volume 0.73936E-03 ppm1 2.022 ppm2 7.993 CV 1
ASSI { 590}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HN ))
4.200 2.200 1.800 peak 590 spectrum 1 weight 0.10000E+01 volume 0.19468E-02 ppm1 8.007 ppm2 8.775 CV 1
ASSI { 591}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 22 and name HN ))
3.000 1.100 1.100 peak 591 spectrum 1 weight 0.10000E+01 volume 0.66577E-02 ppm1 0.912 ppm2 9.033 CV 1
ASSI { 593}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 22 and name HN ))
4.000 2.000 2.000 peak 593 spectrum 1 weight 0.10000E+01 volume 0.41301E-02 ppm1 1.441 ppm2 9.034 CV 1
ASSI { 595}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 22 and name HN ))
4.700 2.800 1.300 peak 595 spectrum 1 weight 0.10000E+01 volume 0.11850E-02 ppm1 8.009 ppm2 9.035 CV 1
ASSI { 598}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 23 and name HN ))
3.300 1.400 1.400 peak 598 spectrum 1 weight 0.10000E+01 volume 0.15998E-01 ppm1 0.399 ppm2 8.457 CV 1
ASSI { 599}
(( segid " " and resid 22 and name HG ))
(( segid " " and resid 23 and name HN ))
3.600 1.600 1.600 peak 599 spectrum 1 weight 0.10000E+01 volume 0.27171E-02 ppm1 0.601 ppm2 8.457 CV 1
ASSI { 600}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 23 and name HN ))
3.400 1.400 1.400 peak 600 spectrum 1 weight 0.10000E+01 volume 0.43124E-02 ppm1 0.787 ppm2 8.457 CV 1
ASSI { 601}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 23 and name HN ))
4.500 2.600 1.500 peak 601 spectrum 1 weight 0.10000E+01 volume 0.17263E-02 ppm1 1.246 ppm2 8.457 CV 1
ASSI { 603}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HN ))
4.800 2.900 1.200 peak 603 spectrum 1 weight 0.10000E+01 volume 0.10361E-02 ppm1 8.470 ppm2 9.035 CV 1
ASSI { 604}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 24 and name HN ))
4.300 2.300 1.700 peak 604 spectrum 1 weight 0.10000E+01 volume 0.17896E-02 ppm1 1.567 ppm2 8.598 CV 1
ASSI { 607}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HN ))
2.900 1.000 1.000 peak 607 spectrum 1 weight 0.10000E+01 volume 0.12112E-01 ppm1 2.732 ppm2 8.598 CV 1
ASSI { 608}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HB3 ))
1.900 0.400 0.400 peak 608 spectrum 1 weight 0.10000E+01 volume 0.33423E-01 ppm1 3.875 ppm2 2.716 CV 1
ASSI { 609}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB3 ))
2.500 0.800 0.800 peak 609 spectrum 1 weight 0.10000E+01 volume 0.12408E-01 ppm1 4.682 ppm2 2.717 CV 1
ASSI { 611}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HN ))
5.500 3.800 0.500 peak 611 spectrum 1 weight 0.10000E+01 volume 0.43055E-03 ppm1 8.613 ppm2 8.455 CV 1
ASSI { 612}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HN ))
2.200 0.600 0.600 peak 612 spectrum 1 weight 0.10000E+01 volume 0.25647E-01 ppm1 4.683 ppm2 9.244 CV 1
ASSI { 615}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HN ))
5.200 3.300 0.800 peak 615 spectrum 1 weight 0.10000E+01 volume 0.79610E-03 ppm1 8.613 ppm2 9.244 CV 1
ASSI { 617}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 26 and name HN ))
3.400 1.500 1.500 peak 617 spectrum 1 weight 0.10000E+01 volume 0.28601E-02 ppm1 2.799 ppm2 9.677 CV 1
ASSI { 618}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 26 and name HN ))
3.800 1.800 1.800 peak 618 spectrum 1 weight 0.10000E+01 volume 0.55469E-02 ppm1 2.733 ppm2 9.677 CV 1
ASSI { 619}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HN ))
2.700 0.900 0.900 peak 619 spectrum 1 weight 0.10000E+01 volume 0.90753E-02 ppm1 9.260 ppm2 9.676 CV 1
ASSI { 621}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 27 and name HN ))
4.300 2.400 1.700 peak 621 spectrum 1 weight 0.10000E+01 volume 0.24832E-02 ppm1 1.063 ppm2 8.225 CV 1
ASSI { 622}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HN ))
4.100 2.100 1.900 peak 622 spectrum 1 weight 0.10000E+01 volume 0.17305E-02 ppm1 3.274 ppm2 8.226 CV 1
ASSI { 627}
(( segid " " and resid 28 and name HD3 ))
(( segid " " and resid 28 and name HB2 ))
4.300 2.300 1.700 peak 627 spectrum 1 weight 0.10000E+01 volume 0.23546E-02 ppm1 3.526 ppm2 2.211 CV 1
ASSI { 631}
(( segid " " and resid 28 and name HD3 ))
(( segid " " and resid 28 and name HG2 ))
2.800 1.000 1.000 peak 631 spectrum 1 weight 0.10000E+01 volume 0.78820E-02 ppm1 3.526 ppm2 1.782 CV 1
OR { 631}
(( segid " " and resid 28 and name HD3 ))
(( segid " " and resid 28 and name HG3 ))
ASSI { 632}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HD3 ))
4.100 2.100 1.900 peak 632 spectrum 1 weight 0.10000E+01 volume 0.17968E-02 ppm1 4.359 ppm2 3.510 CV 1
ASSI { 634}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 28 and name HD3 ))
1.800 0.400 0.400 peak 634 spectrum 1 weight 0.10000E+01 volume 0.32948E-01 ppm1 3.733 ppm2 3.511 CV 1
ASSI { 637}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HD3 ))
2.400 0.700 0.700 peak 637 spectrum 1 weight 0.10000E+01 volume 0.12483E-01 ppm1 5.038 ppm2 3.511 CV 1
ASSI { 642}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 29 and name HN ))
4.000 2.000 2.000 peak 642 spectrum 1 weight 0.10000E+01 volume 0.12813E-02 ppm1 3.736 ppm2 9.336 CV 1
ASSI { 643}
(( segid " " and resid 28 and name HD3 ))
(( segid " " and resid 29 and name HN ))
3.900 1.900 1.900 peak 643 spectrum 1 weight 0.10000E+01 volume 0.28467E-02 ppm1 3.526 ppm2 9.336 CV 1
ASSI { 645}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 29 and name HN ))
4.200 2.200 1.800 peak 645 spectrum 1 weight 0.10000E+01 volume 0.22594E-02 ppm1 1.925 ppm2 9.336 CV 1
ASSI { 646}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 30 and name HN ))
3.500 1.500 1.500 peak 646 spectrum 1 weight 0.10000E+01 volume 0.63413E-02 ppm1 3.863 ppm2 7.581 CV 1
ASSI { 647}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 30 and name HN ))
3.600 1.600 1.600 peak 647 spectrum 1 weight 0.10000E+01 volume 0.24898E-02 ppm1 4.327 ppm2 7.581 CV 1
ASSI { 648}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 30 and name HN ))
2.400 0.700 0.700 peak 648 spectrum 1 weight 0.10000E+01 volume 0.24031E-01 ppm1 4.433 ppm2 7.580 CV 1
ASSI { 649}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HN ))
4.400 2.400 1.600 peak 649 spectrum 1 weight 0.10000E+01 volume 0.14416E-02 ppm1 7.591 ppm2 9.337 CV 1
ASSI { 650}
( segid " " and resid 43 and name HG2%)
( segid " " and resid 43 and name HD1%)
2.800 1.000 1.000 peak 650 spectrum 1 weight 0.10000E+01 volume 0.16909E-01 ppm1 0.910 ppm2 0.776 CV 1
ASSI { 652}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 43 and name HG13))
3.300 1.300 1.300 peak 652 spectrum 1 weight 0.10000E+01 volume 0.52718E-02 ppm1 1.782 ppm2 1.067 CV 1
ASSI { 655}
(( segid " " and resid 43 and name HG12))
(( segid " " and resid 43 and name HG13))
1.600 0.300 0.600 peak 655 spectrum 1 weight 0.10000E+01 volume 0.56707E-01 ppm1 1.593 ppm2 1.066 CV 1
ASSI { 658}
(( segid " " and resid 43 and name HG12))
(( segid " " and resid 43 and name HN ))
2.700 0.900 0.900 peak 658 spectrum 1 weight 0.10000E+01 volume 0.13508E-01 ppm1 1.595 ppm2 8.676 CV 1
ASSI { 659}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HD2 ))
2.300 0.700 0.700 peak 659 spectrum 1 weight 0.10000E+01 volume 0.25293E-01 ppm1 3.936 ppm2 3.669 CV 1
ASSI { 668}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 46 and name HN ))
3.400 1.500 1.500 peak 668 spectrum 1 weight 0.10000E+01 volume 0.46563E-02 ppm1 2.777 ppm2 8.120 CV 1
OR { 668}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 46 and name HN ))
ASSI { 669}
(( segid " " and resid 46 and name HA1 ))
(( segid " " and resid 47 and name HN ))
3.100 1.200 1.200 peak 669 spectrum 1 weight 0.10000E+01 volume 0.42126E-02 ppm1 4.049 ppm2 8.391 CV 1
ASSI { 670}
(( segid " " and resid 46 and name HA2 ))
(( segid " " and resid 47 and name HN ))
4.200 2.200 1.800 peak 670 spectrum 1 weight 0.10000E+01 volume 0.37037E-02 ppm1 3.986 ppm2 8.391 CV 1
ASSI { 671}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HN ))
2.000 0.500 0.500 peak 671 spectrum 1 weight 0.10000E+01 volume 0.50208E-01 ppm1 4.370 ppm2 9.101 CV 1
ASSI { 672}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 48 and name HN ))
4.100 2.100 1.900 peak 672 spectrum 1 weight 0.10000E+01 volume 0.45634E-02 ppm1 2.239 ppm2 9.101 CV 1
OR { 672}
(( segid " " and resid 47 and name HG3 ))
(( segid " " and resid 48 and name HN ))
ASSI { 673}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 48 and name HN ))
3.700 1.700 1.700 peak 673 spectrum 1 weight 0.10000E+01 volume 0.59424E-02 ppm1 1.904 ppm2 9.101 CV 1
ASSI { 674}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 48 and name HN ))
4.200 2.200 1.800 peak 674 spectrum 1 weight 0.10000E+01 volume 0.37725E-02 ppm1 1.989 ppm2 9.101 CV 1
ASSI { 675}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 49 and name HN ))
2.100 0.600 0.600 peak 675 spectrum 1 weight 0.10000E+01 volume 0.44396E-01 ppm1 4.530 ppm2 6.869 CV 1
ASSI { 684}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HB3 ))
1.700 0.400 0.500 peak 684 spectrum 1 weight 0.10000E+01 volume 0.36315E-01 ppm1 1.180 ppm2 0.877 CV 1
ASSI { 686}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 49 and name HD2%)
3.000 1.100 1.100 peak 686 spectrum 1 weight 0.10000E+01 volume 0.51755E-02 ppm1 1.180 ppm2 0.734 CV 1
ASSI { 694}
( segid " " and resid 49 and name HD2%)
(( segid " " and resid 50 and name HN ))
4.600 2.600 1.400 peak 694 spectrum 1 weight 0.10000E+01 volume 0.13773E-02 ppm1 0.757 ppm2 9.094 CV 1
ASSI { 695}
( segid " " and resid 49 and name HD1%)
(( segid " " and resid 50 and name HN ))
4.300 2.300 1.700 peak 695 spectrum 1 weight 0.10000E+01 volume 0.41095E-02 ppm1 0.830 ppm2 9.094 CV 1
ASSI { 696}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 50 and name HN ))
4.000 2.000 2.000 peak 696 spectrum 1 weight 0.10000E+01 volume 0.32167E-02 ppm1 0.901 ppm2 9.094 CV 1
ASSI { 697}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 50 and name HN ))
3.200 1.300 1.300 peak 697 spectrum 1 weight 0.10000E+01 volume 0.34733E-02 ppm1 1.189 ppm2 9.094 CV 1
ASSI { 698}
(( segid " " and resid 49 and name HG ))
(( segid " " and resid 50 and name HN ))
5.100 3.200 0.900 peak 698 spectrum 1 weight 0.10000E+01 volume 0.13577E-02 ppm1 1.589 ppm2 9.094 CV 1
ASSI { 703}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HN ))
3.700 1.700 1.700 peak 703 spectrum 1 weight 0.10000E+01 volume 0.22177E-02 ppm1 8.136 ppm2 8.563 CV 1
ASSI { 705}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HN ))
4.200 2.300 1.800 peak 705 spectrum 1 weight 0.10000E+01 volume 0.20513E-02 ppm1 8.406 ppm2 9.100 CV 1
ASSI { 706}
(( segid " " and resid 42 and name HG3 ))
(( segid " " and resid 42 and name HN ))
4.900 2.900 1.100 peak 706 spectrum 1 weight 0.10000E+01 volume 0.64651E-03 ppm1 2.017 ppm2 6.983 CV 1
ASSI { 710}
(( segid " " and resid 42 and name HG3 ))
(( segid " " and resid 43 and name HN ))
4.100 2.200 1.900 peak 710 spectrum 1 weight 0.10000E+01 volume 0.34052E-02 ppm1 2.018 ppm2 8.676 CV 1
ASSI { 711}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 43 and name HN ))
4.400 2.400 1.600 peak 711 spectrum 1 weight 0.10000E+01 volume 0.15141E-02 ppm1 1.833 ppm2 8.675 CV 1
OR { 711}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 43 and name HN ))
ASSI { 712}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
4.500 2.500 1.500 peak 712 spectrum 1 weight 0.10000E+01 volume 0.15066E-02 ppm1 6.996 ppm2 8.677 CV 1
ASSI { 724}
(( segid " " and resid 41 and name HD3 ))
(( segid " " and resid 41 and name HG3 ))
2.900 1.100 1.100 peak 724 spectrum 1 weight 0.10000E+01 volume 0.39341E-02 ppm1 3.793 ppm2 1.533 CV 1
ASSI { 728}
(( segid " " and resid 41 and name HD2 ))
(( segid " " and resid 42 and name HN ))
2.600 0.900 0.900 peak 728 spectrum 1 weight 0.10000E+01 volume 0.10324E-01 ppm1 3.907 ppm2 6.981 CV 1
ASSI { 729}
(( segid " " and resid 41 and name HD3 ))
(( segid " " and resid 42 and name HN ))
4.100 2.100 1.900 peak 729 spectrum 1 weight 0.10000E+01 volume 0.44155E-02 ppm1 3.791 ppm2 6.981 CV 1
ASSI { 733}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 42 and name HN ))
4.700 2.800 1.300 peak 733 spectrum 1 weight 0.10000E+01 volume 0.14725E-02 ppm1 2.250 ppm2 6.980 CV 1
ASSI { 735}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 15 and name HN ))
3.600 1.600 1.600 peak 735 spectrum 1 weight 0.10000E+01 volume 0.35730E-02 ppm1 4.007 ppm2 8.074 CV 1
ASSI { 737}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 15 and name HN ))
3.600 1.600 1.600 peak 737 spectrum 1 weight 0.10000E+01 volume 0.98696E-02 ppm1 1.134 ppm2 8.072 CV 1
ASSI { 739}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HN ))
2.500 0.800 0.800 peak 739 spectrum 1 weight 0.10000E+01 volume 0.15262E-01 ppm1 8.090 ppm2 8.841 CV 1
ASSI { 742}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HG3 ))
3.200 1.200 1.200 peak 742 spectrum 1 weight 0.10000E+01 volume 0.76378E-02 ppm1 1.811 ppm2 1.193 CV 1
ASSI { 743}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HG3 ))
2.600 0.800 0.800 peak 743 spectrum 1 weight 0.10000E+01 volume 0.10661E-01 ppm1 2.208 ppm2 1.193 CV 1
ASSI { 750}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HG2 ))
2.900 1.000 1.000 peak 750 spectrum 1 weight 0.10000E+01 volume 0.13085E-01 ppm1 2.208 ppm2 1.303 CV 1
ASSI { 759}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HG2 ))
2.800 1.000 1.000 peak 759 spectrum 1 weight 0.10000E+01 volume 0.63448E-02 ppm1 4.174 ppm2 1.303 CV 1
ASSI { 788}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 10 and name HN ))
4.000 2.000 2.000 peak 788 spectrum 1 weight 0.10000E+01 volume 0.35008E-02 ppm1 1.699 ppm2 8.990 CV 1
ASSI { 790}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 10 and name HN ))
4.500 2.500 1.500 peak 790 spectrum 1 weight 0.10000E+01 volume 0.18377E-02 ppm1 2.648 ppm2 8.990 CV 1
OR { 790}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 10 and name HN ))
ASSI { 791}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 10 and name HN ))
2.300 0.600 0.600 peak 791 spectrum 1 weight 0.10000E+01 volume 0.26294E-01 ppm1 4.176 ppm2 8.990 CV 1
ASSI { 792}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 10 and name HN ))
5.700 4.000 0.300 peak 792 spectrum 1 weight 0.10000E+01 volume 0.55779E-03 ppm1 8.849 ppm2 8.990 CV 1
ASSI { 794}
(( segid " " and resid 10 and name HG3 ))
(( segid " " and resid 11 and name HN ))
4.000 2.000 2.000 peak 794 spectrum 1 weight 0.10000E+01 volume 0.31579E-02 ppm1 2.135 ppm2 6.689 CV 1
ASSI { 795}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 11 and name HN ))
5.800 4.200 0.200 peak 795 spectrum 1 weight 0.10000E+01 volume 0.54507E-03 ppm1 2.271 ppm2 6.689 CV 1
ASSI { 796}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HN ))
2.900 1.000 1.000 peak 796 spectrum 1 weight 0.10000E+01 volume 0.10444E-01 ppm1 4.112 ppm2 6.689 CV 1
ASSI { 797}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HN ))
2.800 1.000 1.000 peak 797 spectrum 1 weight 0.10000E+01 volume 0.67712E-02 ppm1 6.703 ppm2 8.990 CV 1
ASSI { 798}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 11 and name HD% )
2.400 0.700 0.700 peak 798 spectrum 1 weight 0.10000E+01 volume 0.20014E-01 ppm1 2.706 ppm2 6.918 CV 1
ASSI { 799}
(( segid " " and resid 11 and name HB3 ))
( segid " " and resid 11 and name HD% )
2.400 0.700 0.700 peak 799 spectrum 1 weight 0.10000E+01 volume 0.18835E-01 ppm1 2.461 ppm2 6.918 CV 1
ASSI { 802}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 11 and name HD% )
3.000 1.100 1.100 peak 802 spectrum 1 weight 0.10000E+01 volume 0.68640E-02 ppm1 1.832 ppm2 6.918 CV 1
OR { 802}
(( segid " " and resid 10 and name HB3 ))
( segid " " and resid 11 and name HD% )
ASSI { 810}
(( segid " " and resid 48 and name HH2 ))
(( segid " " and resid 48 and name HZ2 ))
2.400 0.700 0.700 peak 810 spectrum 1 weight 0.10000E+01 volume 0.19636E-01 ppm1 6.519 ppm2 7.106 CV 1
ASSI { 811}
(( segid " " and resid 48 and name HH2 ))
(( segid " " and resid 48 and name HZ3 ))
2.400 0.700 0.700 peak 811 spectrum 1 weight 0.10000E+01 volume 0.19313E-01 ppm1 6.519 ppm2 6.642 CV 1
ASSI { 813}
(( segid " " and resid 48 and name HZ3 ))
(( segid " " and resid 48 and name HZ2 ))
3.400 1.500 1.500 peak 813 spectrum 1 weight 0.10000E+01 volume 0.11228E-01 ppm1 6.656 ppm2 7.106 CV 1
ASSI { 816}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 31 and name HN ))
3.700 1.700 1.700 peak 816 spectrum 1 weight 0.10000E+01 volume 0.54059E-02 ppm1 3.513 ppm2 9.198 CV 1
ASSI { 817}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 31 and name HN ))
3.200 1.200 1.200 peak 817 spectrum 1 weight 0.10000E+01 volume 0.74934E-02 ppm1 3.335 ppm2 9.198 CV 1
ASSI { 818}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HN ))
2.300 0.700 0.700 peak 818 spectrum 1 weight 0.10000E+01 volume 0.19952E-01 ppm1 5.732 ppm2 9.197 CV 1
ASSI { 819}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HN ))
5.300 3.500 0.700 peak 819 spectrum 1 weight 0.10000E+01 volume 0.67024E-03 ppm1 7.593 ppm2 9.197 CV 1
ASSI { 825}
(( segid " " and resid 31 and name HB3 ))
( segid " " and resid 31 and name HD% )
2.200 0.600 0.600 peak 825 spectrum 1 weight 0.10000E+01 volume 0.27064E-01 ppm1 2.422 ppm2 7.105 CV 1
ASSI { 829}
(( segid " " and resid 30 and name HA ))
( segid " " and resid 31 and name HE% )
5.700 4.100 0.300 peak 829 spectrum 1 weight 0.10000E+01 volume 0.28894E-03 ppm1 5.732 ppm2 6.878 CV 1
ASSI { 830}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HN ))
2.400 0.700 0.700 peak 830 spectrum 1 weight 0.10000E+01 volume 0.22109E-01 ppm1 5.538 ppm2 8.678 CV 1
ASSI { 831}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 32 and name HN ))
2.400 0.700 0.700 peak 831 spectrum 1 weight 0.10000E+01 volume 0.63344E-02 ppm1 2.980 ppm2 8.678 CV 1
ASSI { 835}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 32 and name HD2 ))
3.300 1.300 1.300 peak 835 spectrum 1 weight 0.10000E+01 volume 0.40545E-02 ppm1 2.798 ppm2 7.629 CV 1
ASSI { 836}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HD2 ))
4.000 2.000 2.000 peak 836 spectrum 1 weight 0.10000E+01 volume 0.22937E-02 ppm1 3.326 ppm2 7.629 CV 1
ASSI { 844}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 33 and name HG2%)
3.400 1.500 1.500 peak 844 spectrum 1 weight 0.10000E+01 volume 0.25073E-02 ppm1 3.890 ppm2 0.774 CV 1
ASSI { 845}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 33 and name HD1%)
4.100 2.100 1.900 peak 845 spectrum 1 weight 0.10000E+01 volume 0.69019E-02 ppm1 3.890 ppm2 0.631 CV 1
ASSI { 847}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 33 and name HN ))
3.500 1.500 1.500 peak 847 spectrum 1 weight 0.10000E+01 volume 0.51205E-02 ppm1 2.089 ppm2 9.198 CV 1
ASSI { 848}
(( segid " " and resid 33 and name HG12))
(( segid " " and resid 33 and name HN ))
2.300 0.700 0.700 peak 848 spectrum 1 weight 0.10000E+01 volume 0.13529E-01 ppm1 1.458 ppm2 9.198 CV 1
ASSI { 849}
(( segid " " and resid 33 and name HG13))
(( segid " " and resid 33 and name HN ))
2.300 0.700 0.700 peak 849 spectrum 1 weight 0.10000E+01 volume 0.22697E-01 ppm1 1.293 ppm2 9.198 CV 1
ASSI { 850}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 33 and name HN ))
2.300 0.700 0.700 peak 850 spectrum 1 weight 0.10000E+01 volume 0.24437E-01 ppm1 0.790 ppm2 9.198 CV 1
ASSI { 851}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 33 and name HN ))
4.100 2.100 1.900 peak 851 spectrum 1 weight 0.10000E+01 volume 0.60456E-02 ppm1 0.646 ppm2 9.198 CV 1
ASSI { 855}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 34 and name HN ))
4.000 2.000 2.000 peak 855 spectrum 1 weight 0.10000E+01 volume 0.22102E-02 ppm1 2.089 ppm2 7.134 CV 1
ASSI { 860}
(( segid " " and resid 33 and name HG12))
(( segid " " and resid 34 and name HN ))
3.200 1.300 1.300 peak 860 spectrum 1 weight 0.10000E+01 volume 0.10716E-01 ppm1 1.458 ppm2 7.134 CV 1
ASSI { 861}
(( segid " " and resid 33 and name HG13))
(( segid " " and resid 34 and name HN ))
2.800 1.000 1.000 peak 861 spectrum 1 weight 0.10000E+01 volume 0.50896E-02 ppm1 1.293 ppm2 7.134 CV 1
ASSI { 865}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HN ))
2.200 0.600 0.600 peak 865 spectrum 1 weight 0.10000E+01 volume 0.15269E-01 ppm1 7.145 ppm2 9.199 CV 1
ASSI { 866}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HD2 ))
3.200 1.300 1.300 peak 866 spectrum 1 weight 0.10000E+01 volume 0.46116E-02 ppm1 3.125 ppm2 7.173 CV 1
ASSI { 868}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HD2 ))
3.300 1.400 1.400 peak 868 spectrum 1 weight 0.10000E+01 volume 0.64204E-02 ppm1 3.464 ppm2 7.174 CV 1
ASSI { 869}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HN ))
5.200 3.300 0.800 peak 869 spectrum 1 weight 0.10000E+01 volume 0.79920E-03 ppm1 3.466 ppm2 7.402 CV 1
ASSI { 874}
(( segid " " and resid 36 and name HG ))
( segid " " and resid 36 and name HD1%)
2.000 0.500 0.500 peak 874 spectrum 1 weight 0.10000E+01 volume 0.39272E-01 ppm1 1.737 ppm2 0.834 CV 1
ASSI { 877}
( segid " " and resid 36 and name HD1%)
( segid " " and resid 36 and name HD2%)
2.100 0.600 0.600 peak 877 spectrum 1 weight 0.10000E+01 volume 0.35180E-01 ppm1 0.847 ppm2 0.544 CV 1
ASSI { 878}
(( segid " " and resid 36 and name HB3 ))
( segid " " and resid 36 and name HD1%)
2.400 0.700 0.700 peak 878 spectrum 1 weight 0.10000E+01 volume 0.12016E-01 ppm1 1.472 ppm2 0.834 CV 1
OR { 878}
(( segid " " and resid 36 and name HB2 ))
( segid " " and resid 36 and name HD1%)
ASSI { 879}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 36 and name HD2%)
3.100 1.200 1.200 peak 879 spectrum 1 weight 0.10000E+01 volume 0.23845E-01 ppm1 4.186 ppm2 0.544 CV 1
ASSI { 880}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 36 and name HD1%)
4.600 2.600 1.400 peak 880 spectrum 1 weight 0.10000E+01 volume 0.36074E-02 ppm1 4.186 ppm2 0.833 CV 1
ASSI { 881}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HN ))
3.000 1.100 1.100 peak 881 spectrum 1 weight 0.10000E+01 volume 0.12552E-01 ppm1 0.849 ppm2 6.501 CV 1
ASSI { 882}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 36 and name HN ))
3.300 1.400 1.400 peak 882 spectrum 1 weight 0.10000E+01 volume 0.18701E-01 ppm1 0.560 ppm2 6.501 CV 1
ASSI { 884}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 36 and name HN ))
4.200 2.200 1.800 peak 884 spectrum 1 weight 0.10000E+01 volume 0.19691E-02 ppm1 2.878 ppm2 6.500 CV 1
ASSI { 885}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HN ))
4.400 2.400 1.600 peak 885 spectrum 1 weight 0.10000E+01 volume 0.70979E-03 ppm1 4.443 ppm2 6.499 CV 1
ASSI { 887}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 37 and name HN ))
4.200 2.200 1.800 peak 887 spectrum 1 weight 0.10000E+01 volume 0.81467E-02 ppm1 0.566 ppm2 8.347 CV 1
ASSI { 888}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 37 and name HN ))
4.500 2.500 1.500 peak 888 spectrum 1 weight 0.10000E+01 volume 0.20774E-02 ppm1 0.847 ppm2 8.347 CV 1
ASSI { 889}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 37 and name HN ))
2.100 0.600 0.600 peak 889 spectrum 1 weight 0.10000E+01 volume 0.11379E-01 ppm1 1.472 ppm2 8.347 CV 1
OR { 889}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 37 and name HN ))
ASSI { 892}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 37 and name HN ))
4.400 2.400 1.600 peak 892 spectrum 1 weight 0.10000E+01 volume 0.18873E-02 ppm1 6.517 ppm2 8.347 CV 1
ASSI { 895}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HD21))
5.000 3.100 1.000 peak 895 spectrum 1 weight 0.10000E+01 volume 0.45669E-03 ppm1 4.995 ppm2 7.600 CV 1
ASSI { 900}
(( segid " " and resid 37 and name HD22))
(( segid " " and resid 37 and name HN ))
3.900 1.900 1.900 peak 900 spectrum 1 weight 0.10000E+01 volume 0.49864E-03 ppm1 6.908 ppm2 8.349 CV 1
ASSI { 914}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HD3 ))
3.800 1.800 1.800 peak 914 spectrum 1 weight 0.10000E+01 volume 0.34389E-02 ppm1 5.000 ppm2 3.682 CV 1
ASSI { 915}
(( segid " " and resid 51 and name HD3 ))
(( segid " " and resid 51 and name HB2 ))
3.200 1.300 1.300 peak 915 spectrum 1 weight 0.10000E+01 volume 0.17019E-01 ppm1 3.515 ppm2 2.444 CV 1
ASSI { 923}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB2 ))
2.300 0.700 0.700 peak 923 spectrum 1 weight 0.10000E+01 volume 0.18016E-01 ppm1 5.098 ppm2 2.441 CV 1
ASSI { 924}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HG2 ))
4.400 2.400 1.600 peak 924 spectrum 1 weight 0.10000E+01 volume 0.18508E-02 ppm1 5.099 ppm2 2.122 CV 1
ASSI { 925}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB3 ))
2.900 1.100 1.100 peak 925 spectrum 1 weight 0.10000E+01 volume 0.10678E-01 ppm1 5.099 ppm2 2.068 CV 1
ASSI { 926}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HG3 ))
4.800 2.900 1.200 peak 926 spectrum 1 weight 0.10000E+01 volume 0.13694E-02 ppm1 5.099 ppm2 2.013 CV 1
ASSI { 940}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 40 and name HD2%)
3.600 1.600 1.600 peak 940 spectrum 1 weight 0.10000E+01 volume 0.88276E-02 ppm1 1.540 ppm2 0.696 CV 1
ASSI { 941}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 40 and name HD2%)
2.600 0.800 0.800 peak 941 spectrum 1 weight 0.10000E+01 volume 0.99797E-02 ppm1 1.457 ppm2 0.696 CV 1
ASSI { 942}
( segid " " and resid 40 and name HD1%)
( segid " " and resid 40 and name HD2%)
2.200 0.600 0.600 peak 942 spectrum 1 weight 0.10000E+01 volume 0.38378E-01 ppm1 0.928 ppm2 0.696 CV 1
ASSI { 960}
(( segid " " and resid 52 and name HD3 ))
(( segid " " and resid 52 and name HG2 ))
3.000 1.100 1.100 peak 960 spectrum 1 weight 0.10000E+01 volume 0.67437E-02 ppm1 3.211 ppm2 1.907 CV 1
ASSI { 964}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 53 and name HN ))
4.000 2.000 2.000 peak 964 spectrum 1 weight 0.10000E+01 volume 0.47835E-03 ppm1 3.341 ppm2 8.002 CV 1
ASSI { 965}
(( segid " " and resid 52 and name HD3 ))
(( segid " " and resid 53 and name HN ))
4.600 2.600 1.400 peak 965 spectrum 1 weight 0.10000E+01 volume 0.20162E-03 ppm1 3.210 ppm2 8.001 CV 1
ASSI { 966}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 53 and name HN ))
3.300 1.300 1.300 peak 966 spectrum 1 weight 0.10000E+01 volume 0.83015E-02 ppm1 1.937 ppm2 8.003 CV 1
ASSI { 969}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HN ))
2.200 0.600 0.600 peak 969 spectrum 1 weight 0.10000E+01 volume 0.18907E-01 ppm1 8.017 ppm2 8.354 CV 1
ASSI { 972}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 54 and name HN ))
3.400 1.400 1.400 peak 972 spectrum 1 weight 0.10000E+01 volume 0.47388E-02 ppm1 2.631 ppm2 7.659 CV 1
ASSI { 973}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 54 and name HN ))
4.400 2.400 1.600 peak 973 spectrum 1 weight 0.10000E+01 volume 0.15884E-02 ppm1 2.833 ppm2 7.659 CV 1
ASSI { 974}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HN ))
2.400 0.700 0.700 peak 974 spectrum 1 weight 0.10000E+01 volume 0.16104E-01 ppm1 7.677 ppm2 8.001 CV 1
ASSI { 975}
(( segid " " and resid 54 and name HB ))
( segid " " and resid 54 and name HG2%)
2.500 0.800 0.800 peak 975 spectrum 1 weight 0.10000E+01 volume 0.17576E-01 ppm1 4.053 ppm2 1.001 CV 1
ASSI { 979}
( segid " " and resid 57 and name HB% )
(( segid " " and resid 58 and name HN ))
3.600 1.700 1.700 peak 979 spectrum 1 weight 0.10000E+01 volume 0.37346E-02 ppm1 1.391 ppm2 8.071 CV 1
ASSI { 992}
(( segid " " and resid 4 and name HA1 ))
(( segid " " and resid 4 and name HN ))
5.000 3.200 1.000 peak 992 spectrum 1 weight 0.10000E+01 volume 0.39341E-03 ppm1 4.048 ppm2 8.443 CV 1
ASSI { 998}
(( segid " " and resid 60 and name HA1 ))
(( segid " " and resid 61 and name HN ))
3.200 1.300 1.300 peak 998 spectrum 1 weight 0.10000E+01 volume 0.57636E-02 ppm1 3.957 ppm2 7.820 CV 1
OR { 998}
(( segid " " and resid 60 and name HA2 ))
(( segid " " and resid 61 and name HN ))
ASSI { 1009}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 13 and name HN ))
4.600 2.600 1.400 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.10258E-02 ppm1 1.621 ppm2 8.264 CV 1
ASSI { 1017}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 6 and name HN ))
4.900 3.000 1.100 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.58152E-03 ppm1 3.847 ppm2 8.404 CV 1
ASSI { 1018}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 6 and name HN ))
6.000 5.800 0.000 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.81571E-04 ppm1 3.777 ppm2 8.404 CV 1
ASSI { 1033}
(( segid " " and resid 1 and name HA2 ))
(( segid " " and resid 2 and name HD2 ))
2.500 0.800 0.800 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.19684E-01 ppm1 4.019 ppm2 3.578 CV 1
OR { 1033}
(( segid " " and resid 1 and name HA2 ))
(( segid " " and resid 2 and name HD3 ))
OR { 1033}
(( segid " " and resid 1 and name HA1 ))
(( segid " " and resid 2 and name HD2 ))
OR { 1033}
(( segid " " and resid 1 and name HA1 ))
(( segid " " and resid 2 and name HD3 ))
ASSI { 1044}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HB2 ))
3.200 1.300 1.300 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.88861E-02 ppm1 4.723 ppm2 3.283 CV 1
ASSI { 1051}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HD2 ))
3.800 1.800 1.800 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.34066E-02 ppm1 4.721 ppm2 7.503 CV 1
ASSI { 1052}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 8 and name HD2 ))
3.200 1.300 1.300 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.63585E-02 ppm1 3.299 ppm2 7.503 CV 1
ASSI { 1056}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HN ))
2.600 0.800 0.800 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.16648E-01 ppm1 4.721 ppm2 8.832 CV 1
ASSI { 1063}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HN ))
3.000 1.100 1.100 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.63344E-02 ppm1 4.175 ppm2 8.601 CV 1
ASSI { 1068}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 17 and name HN ))
2.900 1.000 1.000 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.89446E-02 ppm1 8.163 ppm2 8.605 CV 1
ASSI { 1069}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 12 and name HN ))
3.100 1.200 1.200 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.41576E-02 ppm1 2.462 ppm2 8.277 CV 1
ASSI { 1070}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 12 and name HN ))
4.700 2.800 1.300 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.18085E-02 ppm1 2.710 ppm2 8.277 CV 1
ASSI { 1071}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 12 and name HN ))
2.400 0.700 0.700 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.16180E-01 ppm1 4.466 ppm2 8.277 CV 1
ASSI { 1072}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HN ))
4.600 2.700 1.400 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.88930E-03 ppm1 6.702 ppm2 8.276 CV 1
ASSI { 1073}
(( segid " " and resid 8 and name HD2 ))
(( segid " " and resid 9 and name HN ))
5.400 3.700 0.600 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.41129E-03 ppm1 7.517 ppm2 8.831 CV 1
ASSI { 1084}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HN ))
2.200 0.600 0.600 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.29815E-01 ppm1 4.438 ppm2 7.528 CV 1
ASSI { 1085}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 40 and name HN ))
5.900 4.300 0.100 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.28842E-03 ppm1 3.795 ppm2 7.528 CV 1
ASSI { 1086}
(( segid " " and resid 39 and name HD3 ))
(( segid " " and resid 40 and name HN ))
6.000 4.700 0.000 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.13425E-03 ppm1 3.696 ppm2 7.528 CV 1
ASSI { 1090}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 40 and name HN ))
4.100 2.100 1.900 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.48557E-02 ppm1 2.311 ppm2 7.530 CV 1
ASSI { 1094}
(( segid " " and resid 38 and name HD2 ))
(( segid " " and resid 38 and name HB2 ))
3.900 1.900 1.900 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.49039E-02 ppm1 3.805 ppm2 2.441 CV 1
ASSI { 1095}
(( segid " " and resid 38 and name HD3 ))
(( segid " " and resid 38 and name HB2 ))
3.200 1.300 1.300 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.76447E-02 ppm1 3.700 ppm2 2.441 CV 1
ASSI { 1104}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HG2 ))
6.000 6.000 0.000 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.22748E-03 ppm1 4.996 ppm2 2.122 CV 1
ASSI { 1106}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HG3 ))
6.000 6.000 0.000 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.12253E-03 ppm1 4.996 ppm2 2.013 CV 1
ASSI { 1118}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 57 and name HN ))
2.700 0.900 0.900 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.14966E-01 ppm1 4.388 ppm2 8.233 CV 1
ASSI { 1119}
(( segid " " and resid 56 and name HD2 ))
(( segid " " and resid 57 and name HN ))
3.500 1.500 1.500 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.39169E-02 ppm1 3.749 ppm2 8.233 CV 1
OR { 1119}
(( segid " " and resid 56 and name HD3 ))
(( segid " " and resid 57 and name HN ))
ASSI { 1120}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 57 and name HN ))
4.300 2.300 1.700 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.82052E-03 ppm1 2.308 ppm2 8.233 CV 1
ASSI { 1123}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 57 and name HN ))
3.600 1.700 1.700 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.28285E-02 ppm1 1.931 ppm2 8.233 CV 1
ASSI { 1125}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB2 ))
3.400 1.500 1.500 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.57533E-02 ppm1 4.182 ppm2 2.447 CV 1
ASSI { 1130}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 52 and name HN ))
5.000 3.100 1.000 peak 1130 spectrum 1 weight 0.10000E+01 volume 0.56020E-03 ppm1 3.474 ppm2 8.355 CV 1
ASSI { 1151}
(( segid " " and resid 11 and name HB3 ))
( segid " " and resid 11 and name HE% )
4.500 2.500 1.500 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.27690E-02 ppm1 2.461 ppm2 7.283 CV 1
ASSI { 1162}
(( segid " " and resid 2 and name HD2 ))
(( segid " " and resid 2 and name HB2 ))
4.900 2.900 1.100 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.10949E-02 ppm1 3.594 ppm2 2.311 CV 1
OR { 1162}
(( segid " " and resid 2 and name HD3 ))
(( segid " " and resid 2 and name HB2 ))
ASSI { 1174}
(( segid " " and resid 22 and name HG ))
( segid " " and resid 22 and name HD2%)
2.400 0.700 0.700 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.17308E-01 ppm1 0.592 ppm2 -0.631 CV 1
ASSI { 1175}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 22 and name HD2%)
3.300 1.300 1.300 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.35111E-02 ppm1 4.336 ppm2 -0.631 CV 1
ASSI { 1176}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 22 and name HN ))
4.100 2.100 1.900 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.28264E-02 ppm1 -0.612 ppm2 9.032 CV 1
ASSI { 1177}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 23 and name HN ))
4.300 2.300 1.700 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.16073E-02 ppm1 -0.612 ppm2 8.457 CV 1
ASSI { 1181}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 21 and name HN ))
4.200 2.200 1.800 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.38894E-02 ppm1 -0.129 ppm2 7.993 CV 1
ASSI { 1183}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HD2%)
2.300 0.700 0.700 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.20809E-01 ppm1 4.357 ppm2 -0.149 CV 1
ASSI { 1187}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 48 and name HE3 ))
3.400 1.400 1.400 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.64032E-02 ppm1 -0.622 ppm2 7.287 CV 1
ASSI { 1188}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 48 and name HE1 ))
4.900 3.000 1.100 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.50827E-03 ppm1 0.382 ppm2 9.825 CV 1
ASSI { 1189}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 48 and name HE1 ))
4.600 2.600 1.400 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.15616E-02 ppm1 0.567 ppm2 9.823 CV 1
ASSI { 1190}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 48 and name HE1 ))
3.100 1.200 1.200 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.11441E-01 ppm1 0.717 ppm2 9.823 CV 1
ASSI { 1191}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 48 and name HE1 ))
3.600 1.600 1.600 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.41095E-02 ppm1 0.848 ppm2 9.822 CV 1
ASSI { 1192}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 48 and name HE1 ))
3.500 1.500 1.500 peak 1192 spectrum 1 weight 0.10000E+01 volume 0.26627E-02 ppm1 0.927 ppm2 9.823 CV 1
ASSI { 1194}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 48 and name HE1 ))
5.500 3.800 0.500 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.69775E-03 ppm1 1.760 ppm2 9.822 CV 1
ASSI { 1195}
(( segid " " and resid 44 and name HG3 ))
(( segid " " and resid 48 and name HE1 ))
4.300 2.300 1.700 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.10716E-02 ppm1 1.833 ppm2 9.822 CV 1
ASSI { 1202}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 48 and name HE1 ))
4.300 2.300 1.700 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.26400E-02 ppm1 -0.616 ppm2 9.823 CV 1
ASSI { 1203}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 31 and name HN ))
4.700 2.800 1.300 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.14791E-02 ppm1 -0.615 ppm2 9.198 CV 1
ASSI { 1204}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 31 and name HN ))
3.400 1.400 1.400 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.38791E-02 ppm1 -0.135 ppm2 9.199 CV 1
ASSI { 1205}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 22 and name HN ))
3.200 1.300 1.300 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.68468E-02 ppm1 -0.136 ppm2 9.032 CV 1
ASSI { 1207}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 20 and name HN ))
4.800 2.800 1.200 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.85044E-03 ppm1 -0.138 ppm2 8.776 CV 1
ASSI { 1208}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 32 and name HN ))
3.500 1.500 1.500 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.43158E-02 ppm1 -0.138 ppm2 8.675 CV 1
ASSI { 1209}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 19 and name HN ))
3.800 1.800 1.800 peak 1209 spectrum 1 weight 0.10000E+01 volume 0.24640E-02 ppm1 -0.138 ppm2 8.640 CV 1
ASSI { 1211}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 12 and name HN ))
2.700 0.900 0.900 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.78923E-02 ppm1 -0.138 ppm2 8.274 CV 1
ASSI { 1212}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 32 and name HN ))
6.000 4.900 0.000 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.25004E-03 ppm1 -0.617 ppm2 8.675 CV 1
ASSI { 1213}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 31 and name HN ))
4.700 2.800 1.300 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.22002E-02 ppm1 0.411 ppm2 9.200 CV 1
ASSI { 1214}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 31 and name HN ))
5.800 4.200 0.200 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.54610E-03 ppm1 0.569 ppm2 9.196 CV 1
ASSI { 1215}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 31 and name HN ))
3.800 1.800 1.800 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.26191E-02 ppm1 0.910 ppm2 9.197 CV 1
ASSI { 1216}
( segid " " and resid 26 and name HG2%)
(( segid " " and resid 25 and name HN ))
4.900 3.000 1.100 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.12170E-02 ppm1 1.069 ppm2 9.242 CV 1
ASSI { 1217}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 43 and name HN ))
3.300 1.300 1.300 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.53131E-02 ppm1 0.648 ppm2 8.674 CV 1
ASSI { 1218}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 19 and name HN ))
3.600 1.600 1.600 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.38997E-02 ppm1 0.426 ppm2 8.644 CV 1
ASSI { 1220}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 12 and name HN ))
3.500 1.500 1.500 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.36555E-02 ppm1 0.419 ppm2 8.275 CV 1
ASSI { 1222}
( segid " " and resid 49 and name HD1%)
(( segid " " and resid 27 and name HN ))
5.200 3.400 0.800 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.84219E-03 ppm1 0.832 ppm2 8.228 CV 1
ASSI { 1225}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 32 and name HE1 ))
2.900 1.000 1.000 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.11300E-01 ppm1 -0.135 ppm2 7.462 CV 1
ASSI { 1227}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 11 and name HN ))
5.100 3.200 0.900 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.39547E-03 ppm1 -0.138 ppm2 6.687 CV 1
ASSI { 1229}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 48 and name HE3 ))
3.100 1.200 1.200 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.66027E-02 ppm1 0.388 ppm2 7.284 CV 1
ASSI { 1230}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 32 and name HE1 ))
5.500 3.800 0.500 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.58461E-03 ppm1 0.424 ppm2 7.460 CV 1
ASSI { 1232}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 30 and name HN ))
6.000 5.100 0.000 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.29815E-03 ppm1 0.421 ppm2 7.577 CV 1
ASSI { 1234}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 54 and name HN ))
4.600 2.600 1.400 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.81433E-03 ppm1 0.882 ppm2 7.664 CV 1
ASSI { 1236}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 40 and name HN ))
4.800 2.900 1.200 peak 1236 spectrum 1 weight 0.10000E+01 volume 0.79163E-03 ppm1 0.643 ppm2 7.532 CV 1
ASSI { 1239}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 35 and name HN ))
4.500 2.500 1.500 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.12896E-02 ppm1 0.839 ppm2 7.404 CV 1
ASSI { 1241}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 35 and name HN ))
5.800 4.200 0.200 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.36177E-03 ppm1 1.132 ppm2 7.397 CV 1
ASSI { 1242}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 54 and name HN ))
4.900 3.000 1.100 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.44259E-03 ppm1 1.184 ppm2 7.660 CV 1
ASSI { 1243}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 32 and name HE1 ))
4.300 2.300 1.700 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.91647E-03 ppm1 1.253 ppm2 7.460 CV 1
ASSI { 1244}
( segid " " and resid 14 and name HG1%)
(( segid " " and resid 35 and name HN ))
4.800 2.900 1.200 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.11620E-02 ppm1 1.310 ppm2 7.402 CV 1
ASSI { 1245}
(( segid " " and resid 16 and name HG3 ))
( segid " " and resid 11 and name HE% )
4.000 2.000 2.000 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.22229E-02 ppm1 1.217 ppm2 7.280 CV 1
ASSI { 1246}
(( segid " " and resid 16 and name HG2 ))
( segid " " and resid 11 and name HE% )
4.100 2.100 1.900 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.89377E-03 ppm1 1.315 ppm2 7.282 CV 1
ASSI { 1247}
( segid " " and resid 14 and name HG2%)
( segid " " and resid 31 and name HD% )
3.900 1.900 1.900 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.11087E-02 ppm1 1.137 ppm2 7.108 CV 1
ASSI { 1248}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 48 and name HZ2 ))
2.400 0.700 0.700 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.25448E-01 ppm1 0.842 ppm2 7.106 CV 1
ASSI { 1249}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 48 and name HZ2 ))
2.100 0.600 0.600 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.38722E-01 ppm1 0.563 ppm2 7.106 CV 1
ASSI { 1254}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 42 and name HN ))
3.200 1.300 1.300 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.55022E-02 ppm1 0.648 ppm2 6.982 CV 1
ASSI { 1255}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 42 and name HN ))
4.600 2.700 1.400 peak 1255 spectrum 1 weight 0.10000E+01 volume 0.18484E-03 ppm1 0.713 ppm2 6.982 CV 1
ASSI { 1260}
(( segid " " and resid 16 and name HG2 ))
( segid " " and resid 11 and name HD% )
4.100 2.100 1.900 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.95773E-03 ppm1 1.321 ppm2 6.917 CV 1
ASSI { 1262}
(( segid " " and resid 22 and name HG ))
(( segid " " and resid 48 and name HE3 ))
2.900 1.000 1.000 peak 1262 spectrum 1 weight 0.10000E+01 volume 0.70154E-02 ppm1 0.600 ppm2 7.282 CV 1
ASSI { 1263}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 48 and name HD1 ))
3.500 1.600 1.600 peak 1263 spectrum 1 weight 0.10000E+01 volume 0.47113E-02 ppm1 0.711 ppm2 7.291 CV 1
ASSI { 1265}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 48 and name HD1 ))
4.100 2.100 1.900 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.20568E-02 ppm1 0.928 ppm2 7.289 CV 1
ASSI { 1266}
(( segid " " and resid 22 and name HG ))
(( segid " " and resid 48 and name HZ3 ))
3.100 1.200 1.200 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.62416E-02 ppm1 0.593 ppm2 6.639 CV 1
ASSI { 1267}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 48 and name HZ3 ))
5.600 3.900 0.400 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.71185E-03 ppm1 0.842 ppm2 6.641 CV 1
ASSI { 1270}
( segid " " and resid 14 and name HG1%)
(( segid " " and resid 36 and name HN ))
4.600 2.600 1.400 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.10021E-02 ppm1 1.310 ppm2 6.504 CV 1
ASSI { 1285}
(( segid " " and resid 51 and name HG3 ))
(( segid " " and resid 48 and name HH2 ))
5.000 3.100 1.000 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.13797E-02 ppm1 1.933 ppm2 6.505 CV 1
ASSI { 1286}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 36 and name HN ))
5.200 3.400 0.800 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.83221E-03 ppm1 2.306 ppm2 6.498 CV 1
ASSI { 1287}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 48 and name HH2 ))
2.600 0.800 0.800 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.85732E-02 ppm1 2.430 ppm2 6.505 CV 1
ASSI { 1289}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 48 and name HZ3 ))
3.200 1.300 1.300 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.43124E-02 ppm1 2.732 ppm2 6.639 CV 1
ASSI { 1290}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 11 and name HN ))
4.400 2.500 1.600 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.28787E-02 ppm1 2.641 ppm2 6.687 CV 1
OR { 1290}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 11 and name HN ))
ASSI { 1291}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 48 and name HZ3 ))
3.000 1.100 1.100 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.64926E-02 ppm1 2.435 ppm2 6.641 CV 1
ASSI { 1292}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 11 and name HN ))
3.000 1.200 1.200 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.37037E-02 ppm1 1.868 ppm2 6.687 CV 1
ASSI { 1294}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 11 and name HN ))
3.500 1.500 1.500 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.75518E-02 ppm1 1.692 ppm2 6.689 CV 1
ASSI { 1300}
(( segid " " and resid 13 and name HG3 ))
( segid " " and resid 11 and name HE% )
3.800 1.800 1.800 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.21287E-02 ppm1 1.616 ppm2 7.284 CV 1
ASSI { 1301}
(( segid " " and resid 9 and name HB3 ))
( segid " " and resid 11 and name HE% )
4.400 2.400 1.600 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.18966E-02 ppm1 1.694 ppm2 7.282 CV 1
ASSI { 1302}
(( segid " " and resid 13 and name HB2 ))
( segid " " and resid 11 and name HE% )
3.900 1.900 1.900 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.26328E-02 ppm1 1.992 ppm2 7.284 CV 1
ASSI { 1303}
(( segid " " and resid 44 and name HG3 ))
(( segid " " and resid 48 and name HD1 ))
2.800 1.000 1.000 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.15221E-01 ppm1 1.822 ppm2 7.288 CV 1
ASSI { 1305}
(( segid " " and resid 36 and name HG ))
( segid " " and resid 31 and name HD% )
3.900 1.900 1.900 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.32219E-02 ppm1 1.744 ppm2 7.105 CV 1
ASSI { 1309}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 48 and name HD1 ))
4.100 2.100 1.900 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.16610E-02 ppm1 2.326 ppm2 7.295 CV 1
ASSI { 1313}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 34 and name HD2 ))
3.800 1.800 1.800 peak 1313 spectrum 1 weight 0.10000E+01 volume 0.12803E-02 ppm1 2.795 ppm2 7.172 CV 1
ASSI { 1316}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 7 and name HD2 ))
4.400 2.400 1.600 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.26187E-03 ppm1 1.928 ppm2 7.020 CV 1
ASSI { 1317}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 7 and name HD2 ))
4.100 2.100 1.900 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.41198E-03 ppm1 2.221 ppm2 7.020 CV 1
ASSI { 1324}
(( segid " " and resid 13 and name HG2 ))
( segid " " and resid 31 and name HE% )
3.700 1.700 1.700 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.50345E-02 ppm1 1.714 ppm2 6.878 CV 1
ASSI { 1326}
(( segid " " and resid 13 and name HB2 ))
( segid " " and resid 11 and name HD% )
4.100 2.100 1.900 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.20957E-02 ppm1 1.993 ppm2 6.917 CV 1
ASSI { 1328}
(( segid " " and resid 36 and name HG ))
(( segid " " and resid 35 and name HN ))
3.200 1.300 1.300 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.53200E-02 ppm1 1.737 ppm2 7.403 CV 1
ASSI { 1330}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 35 and name HN ))
4.700 2.800 1.300 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.19925E-02 ppm1 1.470 ppm2 7.403 CV 1
OR { 1330}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 35 and name HN ))
ASSI { 1332}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 32 and name HE1 ))
4.200 2.200 1.800 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.22783E-02 ppm1 2.025 ppm2 7.460 CV 1
ASSI { 1333}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 32 and name HE1 ))
4.700 2.800 1.300 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.12181E-02 ppm1 2.092 ppm2 7.461 CV 1
ASSI { 1336}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 35 and name HN ))
5.200 3.400 0.800 peak 1336 spectrum 1 weight 0.10000E+01 volume 0.11527E-02 ppm1 2.301 ppm2 7.403 CV 1
ASSI { 1340}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 30 and name HN ))
4.800 2.900 1.200 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.13288E-02 ppm1 1.876 ppm2 7.583 CV 1
ASSI { 1343}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 54 and name HN ))
5.200 3.400 0.800 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.87073E-03 ppm1 1.933 ppm2 7.663 CV 1
ASSI { 1349}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HE ))
2.800 1.000 1.000 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.18756E-01 ppm1 1.709 ppm2 8.640 CV 1
ASSI { 1350}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HE ))
2.500 0.800 0.800 peak 1350 spectrum 1 weight 0.10000E+01 volume 0.11032E-01 ppm1 1.379 ppm2 8.641 CV 1
ASSI { 1354}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 30 and name HN ))
4.700 2.700 1.300 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.49486E-03 ppm1 1.992 ppm2 7.578 CV 1
ASSI { 1357}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 29 and name HN ))
4.100 2.100 1.900 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.29898E-02 ppm1 2.722 ppm2 9.337 CV 1
ASSI { 1358}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 50 and name HN ))
3.400 1.500 1.500 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.37003E-02 ppm1 2.626 ppm2 9.094 CV 1
ASSI { 1359}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 48 and name HN ))
3.000 1.100 1.100 peak 1359 spectrum 1 weight 0.10000E+01 volume 0.62106E-02 ppm1 2.737 ppm2 9.104 CV 1
ASSI { 1361}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 22 and name HN ))
4.800 2.800 1.200 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.67093E-03 ppm1 2.425 ppm2 9.035 CV 1
ASSI { 1362}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 32 and name HN ))
4.000 2.000 2.000 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.31583E-02 ppm1 2.420 ppm2 8.679 CV 1
ASSI { 1366}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 48 and name HN ))
3.700 1.700 1.700 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.67746E-02 ppm1 2.811 ppm2 9.102 CV 1
ASSI { 1369}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 29 and name HN ))
4.300 2.300 1.700 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.16961E-02 ppm1 3.279 ppm2 9.337 CV 1
ASSI { 1370}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 48 and name HE1 ))
5.000 3.100 1.000 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.55916E-03 ppm1 3.471 ppm2 9.824 CV 1
ASSI { 1372}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 26 and name HN ))
3.900 1.900 1.900 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.17329E-02 ppm1 3.874 ppm2 9.678 CV 1
ASSI { 1373}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 50 and name HN ))
4.400 2.500 1.600 peak 1373 spectrum 1 weight 0.10000E+01 volume 0.15781E-02 ppm1 3.871 ppm2 9.092 CV 1
ASSI { 1374}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 50 and name HN ))
5.500 3.800 0.500 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.60009E-03 ppm1 4.023 ppm2 9.094 CV 1
ASSI { 1375}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 32 and name HN ))
4.000 2.000 2.000 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.46597E-02 ppm1 2.874 ppm2 8.679 CV 1
ASSI { 1380}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 25 and name HN ))
5.200 3.400 0.800 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.47113E-03 ppm1 3.214 ppm2 9.239 CV 1
ASSI { 1382}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 15 and name HN ))
5.400 3.700 0.600 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.42780E-03 ppm1 2.875 ppm2 8.072 CV 1
ASSI { 1386}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 15 and name HN ))
5.500 3.800 0.500 peak 1386 spectrum 1 weight 0.10000E+01 volume 0.40579E-03 ppm1 3.902 ppm2 8.070 CV 1
ASSI { 1387}
(( segid " " and resid 56 and name HD3 ))
(( segid " " and resid 55 and name HN ))
4.000 2.000 2.000 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.27793E-02 ppm1 3.748 ppm2 7.689 CV 1
OR { 1387}
(( segid " " and resid 56 and name HD2 ))
(( segid " " and resid 55 and name HN ))
ASSI { 1392}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HG ))
5.300 3.500 0.700 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.53578E-03 ppm1 3.887 ppm2 7.388 CV 1
ASSI { 1393}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 11 and name HE% )
2.900 1.000 1.000 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.84769E-02 ppm1 3.912 ppm2 7.281 CV 1
ASSI { 1394}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 11 and name HE% )
4.000 2.000 2.000 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.29320E-02 ppm1 4.181 ppm2 7.283 CV 1
ASSI { 1396}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 54 and name HN ))
3.400 1.400 1.400 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.43261E-02 ppm1 4.189 ppm2 7.661 CV 1
ASSI { 1397}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 48 and name HD1 ))
6.000 4.700 0.000 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.52271E-03 ppm1 3.672 ppm2 7.290 CV 1
ASSI { 1398}
(( segid " " and resid 19 and name HA2 ))
(( segid " " and resid 32 and name HE1 ))
6.000 5.200 0.000 peak 1398 spectrum 1 weight 0.10000E+01 volume 0.21803E-03 ppm1 3.680 ppm2 7.459 CV 1
ASSI { 1400}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 15 and name HN ))
4.300 2.300 1.700 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.29764E-02 ppm1 4.181 ppm2 8.070 CV 1
ASSI { 1401}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 12 and name HN ))
3.600 1.600 1.600 peak 1401 spectrum 1 weight 0.10000E+01 volume 0.29819E-02 ppm1 4.181 ppm2 8.276 CV 1
ASSI { 1409}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 48 and name HH2 ))
2.900 1.100 1.100 peak 1409 spectrum 1 weight 0.10000E+01 volume 0.76687E-02 ppm1 3.476 ppm2 6.505 CV 1
ASSI { 1410}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 48 and name HZ3 ))
3.700 1.700 1.700 peak 1410 spectrum 1 weight 0.10000E+01 volume 0.25689E-02 ppm1 3.473 ppm2 6.639 CV 1
ASSI { 1414}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 11 and name HN ))
5.500 3.800 0.500 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.23010E-03 ppm1 3.519 ppm2 6.687 CV 1
ASSI { 1415}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 48 and name HZ3 ))
4.100 2.100 1.900 peak 1415 spectrum 1 weight 0.10000E+01 volume 0.28405E-02 ppm1 3.876 ppm2 6.639 CV 1
ASSI { 1417}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 11 and name HN ))
4.400 2.400 1.600 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.30991E-02 ppm1 4.174 ppm2 6.687 CV 1
ASSI { 1418}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 11 and name HD% )
2.300 0.700 0.700 peak 1418 spectrum 1 weight 0.10000E+01 volume 0.22129E-01 ppm1 4.176 ppm2 6.919 CV 1
ASSI { 1419}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 31 and name HE% )
4.100 2.100 1.900 peak 1419 spectrum 1 weight 0.10000E+01 volume 0.38860E-03 ppm1 4.186 ppm2 6.878 CV 1
ASSI { 1420}
(( segid " " and resid 29 and name HB3 ))
( segid " " and resid 31 and name HE% )
2.600 0.800 0.800 peak 1420 spectrum 1 weight 0.10000E+01 volume 0.12968E-01 ppm1 3.861 ppm2 6.880 CV 1
ASSI { 1421}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 31 and name HE% )
5.000 3.200 1.000 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.55779E-03 ppm1 4.013 ppm2 6.876 CV 1
ASSI { 1424}
(( segid " " and resid 12 and name HB2 ))
( segid " " and resid 11 and name HD% )
5.000 3.100 1.000 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.88242E-03 ppm1 3.332 ppm2 6.915 CV 1
ASSI { 1428}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 48 and name HZ2 ))
4.000 2.000 2.000 peak 1428 spectrum 1 weight 0.10000E+01 volume 0.27876E-02 ppm1 4.186 ppm2 7.105 CV 1
ASSI { 1429}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 34 and name HD2 ))
4.500 2.500 1.500 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.11565E-02 ppm1 3.320 ppm2 7.176 CV 1
ASSI { 1438}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 48 and name HZ3 ))
3.100 1.200 1.200 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.74487E-02 ppm1 4.683 ppm2 6.639 CV 1
ASSI { 1439}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 48 and name HH2 ))
5.600 3.900 0.400 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.49211E-03 ppm1 4.683 ppm2 6.504 CV 1
ASSI { 1440}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 48 and name HE3 ))
2.300 0.700 0.700 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.25252E-01 ppm1 4.683 ppm2 7.280 CV 1
ASSI { 1441}
(( segid " " and resid 29 and name HB2 ))
( segid " " and resid 31 and name HE% )
2.900 1.100 1.100 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.78785E-02 ppm1 4.327 ppm2 6.877 CV 1
ASSI { 1442}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 48 and name HZ3 ))
6.000 4.900 0.000 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.22831E-03 ppm1 4.333 ppm2 6.639 CV 1
ASSI { 1443}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 31 and name HE% )
5.100 3.200 0.900 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.12002E-02 ppm1 4.429 ppm2 6.880 CV 1
ASSI { 1444}
(( segid " " and resid 29 and name HB2 ))
( segid " " and resid 31 and name HD% )
3.900 1.900 1.900 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.19526E-02 ppm1 4.332 ppm2 7.107 CV 1
ASSI { 1446}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 48 and name HE3 ))
5.400 3.700 0.600 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.56295E-03 ppm1 4.346 ppm2 7.284 CV 1
ASSI { 1447}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 11 and name HD% )
3.900 1.900 1.900 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.48660E-03 ppm1 5.306 ppm2 6.917 CV 1
ASSI { 1452}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 31 and name HD% )
5.000 3.100 1.000 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.83806E-03 ppm1 4.437 ppm2 7.109 CV 1
ASSI { 1456}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 12 and name HN ))
5.000 3.100 1.000 peak 1456 spectrum 1 weight 0.10000E+01 volume 0.44637E-03 ppm1 5.301 ppm2 8.272 CV 1
ASSI { 1457}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 16 and name HN ))
4.700 2.800 1.300 peak 1457 spectrum 1 weight 0.10000E+01 volume 0.16613E-03 ppm1 5.301 ppm2 8.146 CV 1
ASSI { 1460}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 31 and name HN ))
3.700 1.700 1.700 peak 1460 spectrum 1 weight 0.10000E+01 volume 0.50964E-02 ppm1 4.353 ppm2 9.198 CV 1
ASSI { 1462}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 29 and name HN ))
6.000 4.800 0.000 peak 1462 spectrum 1 weight 0.10000E+01 volume 0.29664E-03 ppm1 4.696 ppm2 9.335 CV 1
ASSI { 1463}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 14 and name HN ))
4.200 2.200 1.800 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.95326E-03 ppm1 5.540 ppm2 8.837 CV 1
ASSI { 1466}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 9 and name HN ))
4.600 2.600 1.400 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.59493E-03 ppm1 4.438 ppm2 8.829 CV 1
ASSI { 1467}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 9 and name HN ))
4.400 2.400 1.600 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.13807E-02 ppm1 4.356 ppm2 8.829 CV 1
ASSI { 1468}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 50 and name HN ))
4.000 2.000 2.000 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.24031E-02 ppm1 4.683 ppm2 9.094 CV 1
ASSI { 1470}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 29 and name HN ))
4.700 2.800 1.300 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.75931E-03 ppm1 5.041 ppm2 9.337 CV 1
ASSI { 1471}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 26 and name HN ))
5.900 4.300 0.100 peak 1471 spectrum 1 weight 0.10000E+01 volume 0.33244E-03 ppm1 5.039 ppm2 9.672 CV 1
ASSI { 1472}
(( segid " " and resid 48 and name HH2 ))
(( segid " " and resid 48 and name HE1 ))
5.700 4.000 0.300 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.61900E-03 ppm1 6.523 ppm2 9.824 CV 1
ASSI { 1473}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HE1 ))
5.200 3.400 0.800 peak 1473 spectrum 1 weight 0.10000E+01 volume 0.40888E-03 ppm1 6.891 ppm2 9.822 CV 1
ASSI { 1474}
(( segid " " and resid 48 and name HZ2 ))
(( segid " " and resid 48 and name HE1 ))
2.700 0.900 0.900 peak 1474 spectrum 1 weight 0.10000E+01 volume 0.13147E-01 ppm1 7.125 ppm2 9.823 CV 1
ASSI { 1477}
(( segid " " and resid 48 and name HH2 ))
(( segid " " and resid 31 and name HN ))
4.600 2.700 1.400 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.10214E-02 ppm1 6.521 ppm2 9.196 CV 1
ASSI { 1479}
(( segid " " and resid 48 and name HZ3 ))
(( segid " " and resid 25 and name HN ))
5.400 3.600 0.600 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.74487E-03 ppm1 6.654 ppm2 9.244 CV 1
ASSI { 1483}
(( segid " " and resid 48 and name HZ3 ))
(( segid " " and resid 48 and name HN ))
5.200 3.400 0.800 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.10107E-02 ppm1 6.657 ppm2 9.094 CV 1
ASSI { 1484}
(( segid " " and resid 48 and name HZ2 ))
(( segid " " and resid 50 and name HN ))
5.400 3.700 0.600 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.54369E-03 ppm1 7.125 ppm2 9.090 CV 1
ASSI { 1487}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 14 and name HN ))
4.100 2.100 1.900 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.10918E-02 ppm1 7.118 ppm2 8.838 CV 1
ASSI { 1488}
(( segid " " and resid 48 and name HZ3 ))
(( segid " " and resid 24 and name HN ))
3.400 1.400 1.400 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.33908E-02 ppm1 6.657 ppm2 8.598 CV 1
ASSI { 1491}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 24 and name HN ))
3.600 1.600 1.600 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.35283E-02 ppm1 5.735 ppm2 8.596 CV 1
ASSI { 1492}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 22 and name HN ))
5.100 3.200 0.900 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.57842E-03 ppm1 5.725 ppm2 9.029 CV 1
ASSI { 1496}
( segid " " and resid 11 and name HD% )
(( segid " " and resid 17 and name HN ))
4.300 2.300 1.700 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.16916E-02 ppm1 6.931 ppm2 8.597 CV 1
ASSI { 1497}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 24 and name HN ))
4.900 3.000 1.100 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.39444E-03 ppm1 7.127 ppm2 8.596 CV 1
ASSI { 1498}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 13 and name HE ))
5.100 3.200 0.900 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.58427E-03 ppm1 7.119 ppm2 8.640 CV 1
ASSI { 1499}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 32 and name HN ))
4.200 2.200 1.800 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.26734E-02 ppm1 7.128 ppm2 8.677 CV 1
ASSI { 1500}
(( segid " " and resid 48 and name HE3 ))
(( segid " " and resid 25 and name HN ))
3.700 1.700 1.700 peak 1500 spectrum 1 weight 0.10000E+01 volume 0.47698E-02 ppm1 7.297 ppm2 9.239 CV 1
ASSI { 1501}
(( segid " " and resid 48 and name HE3 ))
(( segid " " and resid 48 and name HN ))
4.500 2.500 1.500 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.83324E-03 ppm1 7.299 ppm2 9.096 CV 1
ASSI { 1502}
(( segid " " and resid 8 and name HD2 ))
(( segid " " and resid 29 and name HN ))
4.400 2.400 1.600 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.83703E-03 ppm1 7.517 ppm2 9.335 CV 1
ASSI { 1505}
(( segid " " and resid 32 and name HE1 ))
(( segid " " and resid 20 and name HN ))
4.400 2.500 1.600 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.10702E-02 ppm1 7.478 ppm2 8.776 CV 1
ASSI { 1507}
(( segid " " and resid 48 and name HE3 ))
(( segid " " and resid 24 and name HN ))
4.200 2.200 1.800 peak 1507 spectrum 1 weight 0.10000E+01 volume 0.15351E-02 ppm1 7.296 ppm2 8.594 CV 1
ASSI { 1508}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 29 and name HN ))
5.300 3.500 0.700 peak 1508 spectrum 1 weight 0.10000E+01 volume 0.38241E-03 ppm1 8.247 ppm2 9.335 CV 1
ASSI { 1510}
(( segid " " and resid 8 and name HE1 ))
(( segid " " and resid 29 and name HN ))
5.900 4.400 0.100 peak 1510 spectrum 1 weight 0.10000E+01 volume 0.47835E-03 ppm1 8.611 ppm2 9.335 CV 1
ASSI { 1511}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HN ))
2.400 0.700 0.700 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.23914E-01 ppm1 8.244 ppm2 9.675 CV 1
ASSI { 1512}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 14 and name HN ))
3.800 1.900 1.900 peak 1512 spectrum 1 weight 0.10000E+01 volume 0.19980E-02 ppm1 8.173 ppm2 8.838 CV 1
ASSI { 1513}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 52 and name HN ))
4.500 2.500 1.500 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.21782E-02 ppm1 7.680 ppm2 8.354 CV 1
ASSI { 1515}
(( segid " " and resid 12 and name HG ))
(( segid " " and resid 12 and name HN ))
4.200 2.200 1.800 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.18137E-02 ppm1 7.401 ppm2 8.274 CV 1
ASSI { 1519}
(( segid " " and resid 48 and name HZ2 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.42780E-03 ppm1 7.120 ppm2 8.349 CV 1
ASSI { 1522}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 32 and name HN ))
3.700 1.800 1.800 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.20788E-02 ppm1 7.422 ppm2 8.680 CV 1
ASSI { 1523}
(( segid " " and resid 32 and name HE1 ))
(( segid " " and resid 22 and name HN ))
6.000 6.000 0.000 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.10702E-03 ppm1 7.478 ppm2 9.029 CV 1
ASSI { 1526}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HN ))
5.300 3.500 0.700 peak 1526 spectrum 1 weight 0.10000E+01 volume 0.41095E-03 ppm1 7.842 ppm2 8.407 CV 1
ASSI { 1534}
( segid " " and resid 11 and name HD% )
(( segid " " and resid 12 and name HN ))
4.100 2.100 1.900 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.18549E-02 ppm1 6.935 ppm2 8.277 CV 1
ASSI { 1542}
(( segid " " and resid 43 and name HG13))
( segid " " and resid 22 and name HD2%)
5.300 3.500 0.700 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.78820E-03 ppm1 1.086 ppm2 -0.634 CV 1
ASSI { 1543}
(( segid " " and resid 33 and name HG12))
( segid " " and resid 22 and name HD2%)
4.800 2.900 1.200 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.88105E-03 ppm1 1.463 ppm2 -0.632 CV 1
ASSI { 1545}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 21 and name HD2%)
5.700 4.100 0.300 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.52890E-03 ppm1 0.794 ppm2 -0.152 CV 1
ASSI { 1546}
( segid " " and resid 40 and name HD2%)
( segid " " and resid 22 and name HD1%)
4.400 2.400 1.600 peak 1546 spectrum 1 weight 0.10000E+01 volume 0.20716E-02 ppm1 0.712 ppm2 0.371 CV 1
ASSI { 1547}
(( segid " " and resid 43 and name HG13))
( segid " " and resid 22 and name HD1%)
5.200 3.400 0.800 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.11338E-02 ppm1 1.084 ppm2 0.369 CV 1
ASSI { 1548}
(( segid " " and resid 43 and name HG13))
( segid " " and resid 33 and name HD1%)
4.000 2.000 2.000 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.25664E-02 ppm1 1.081 ppm2 0.626 CV 1
ASSI { 1549}
( segid " " and resid 14 and name HG1%)
( segid " " and resid 36 and name HD2%)
4.900 3.000 1.100 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.10870E-02 ppm1 1.310 ppm2 0.543 CV 1
ASSI { 1550}
(( segid " " and resid 43 and name HG12))
( segid " " and resid 22 and name HD1%)
4.900 3.000 1.100 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.11685E-02 ppm1 1.587 ppm2 0.371 CV 1
ASSI { 1551}
(( segid " " and resid 43 and name HG12))
( segid " " and resid 33 and name HD1%)
3.800 1.800 1.800 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.51446E-02 ppm1 1.585 ppm2 0.630 CV 1
ASSI { 1553}
(( segid " " and resid 44 and name HG2 ))
( segid " " and resid 22 and name HD2%)
4.200 2.200 1.800 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.50964E-02 ppm1 1.848 ppm2 -0.633 CV 1
ASSI { 1554}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 22 and name HD2%)
3.900 1.900 1.900 peak 1554 spectrum 1 weight 0.10000E+01 volume 0.13456E-02 ppm1 1.767 ppm2 -0.635 CV 1
ASSI { 1555}
(( segid " " and resid 44 and name HB3 ))
( segid " " and resid 22 and name HD2%)
5.100 3.200 0.900 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.34203E-03 ppm1 1.971 ppm2 -0.635 CV 1
ASSI { 1556}
(( segid " " and resid 33 and name HB ))
( segid " " and resid 22 and name HD2%)
6.000 5.000 0.000 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.37484E-03 ppm1 2.092 ppm2 -0.636 CV 1
ASSI { 1559}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 22 and name HD2%)
5.000 3.200 1.000 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.11572E-02 ppm1 2.969 ppm2 -0.635 CV 1
ASSI { 1560}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 21 and name HD2%)
5.600 4.000 0.400 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.33687E-03 ppm1 2.977 ppm2 -0.151 CV 1
ASSI { 1562}
(( segid " " and resid 11 and name HB3 ))
( segid " " and resid 21 and name HD2%)
5.900 4.300 0.100 peak 1562 spectrum 1 weight 0.10000E+01 volume 0.43468E-03 ppm1 2.452 ppm2 -0.150 CV 1
ASSI { 1563}
(( segid " " and resid 44 and name HG2 ))
( segid " " and resid 22 and name HD1%)
3.700 1.700 1.700 peak 1563 spectrum 1 weight 0.10000E+01 volume 0.70841E-02 ppm1 1.848 ppm2 0.370 CV 1
ASSI { 1564}
(( segid " " and resid 10 and name HB3 ))
( segid " " and resid 21 and name HD1%)
4.100 2.100 1.900 peak 1564 spectrum 1 weight 0.10000E+01 volume 0.23240E-02 ppm1 1.839 ppm2 0.403 CV 1
OR { 1564}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 21 and name HD1%)
ASSI { 1565}
(( segid " " and resid 44 and name HB3 ))
( segid " " and resid 22 and name HD1%)
5.000 3.100 1.000 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.90546E-03 ppm1 1.971 ppm2 0.372 CV 1
ASSI { 1567}
(( segid " " and resid 10 and name HG3 ))
( segid " " and resid 21 and name HD1%)
4.100 2.100 1.900 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.28068E-02 ppm1 2.140 ppm2 0.403 CV 1
ASSI { 1569}
(( segid " " and resid 11 and name HB3 ))
( segid " " and resid 21 and name HD1%)
5.600 3.900 0.400 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.80814E-03 ppm1 2.468 ppm2 0.406 CV 1
ASSI { 1570}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 21 and name HD1%)
5.400 3.600 0.600 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.90168E-03 ppm1 2.709 ppm2 0.403 CV 1
ASSI { 1572}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 36 and name HD2%)
2.700 0.900 0.900 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.49176E-02 ppm1 2.969 ppm2 0.543 CV 1
ASSI { 1573}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 36 and name HD1%)
5.300 3.500 0.700 peak 1573 spectrum 1 weight 0.10000E+01 volume 0.10069E-02 ppm1 2.972 ppm2 0.827 CV 1
ASSI { 1574}
(( segid " " and resid 15 and name HB3 ))
( segid " " and resid 14 and name HG2%)
4.200 2.200 1.800 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.49692E-02 ppm1 3.007 ppm2 1.119 CV 1
ASSI { 1576}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 26 and name HG2%)
3.200 1.300 1.300 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.46150E-02 ppm1 2.807 ppm2 1.049 CV 1
ASSI { 1580}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 49 and name HB2 ))
3.600 1.600 1.600 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.15434E-02 ppm1 2.630 ppm2 1.169 CV 1
ASSI { 1582}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 54 and name HG2%)
5.600 3.900 0.400 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.55607E-03 ppm1 2.837 ppm2 0.996 CV 1
ASSI { 1583}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 54 and name HG2%)
4.600 2.700 1.400 peak 1583 spectrum 1 weight 0.10000E+01 volume 0.11128E-02 ppm1 2.633 ppm2 0.998 CV 1
ASSI { 1585}
(( segid " " and resid 31 and name HB3 ))
( segid " " and resid 36 and name HD1%)
5.500 3.700 0.500 peak 1585 spectrum 1 weight 0.10000E+01 volume 0.11737E-02 ppm1 2.421 ppm2 0.824 CV 1
ASSI { 1586}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 49 and name HD1%)
3.800 1.800 1.800 peak 1586 spectrum 1 weight 0.10000E+01 volume 0.26297E-02 ppm1 2.630 ppm2 0.809 CV 1
ASSI { 1587}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 49 and name HD2%)
3.500 1.600 1.600 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.94570E-03 ppm1 2.635 ppm2 0.734 CV 1
ASSI { 1589}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 49 and name HD1%)
3.200 1.300 1.300 peak 1589 spectrum 1 weight 0.10000E+01 volume 0.12301E-01 ppm1 2.809 ppm2 0.810 CV 1
ASSI { 1590}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 49 and name HD1%)
4.300 2.300 1.700 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.40992E-02 ppm1 2.742 ppm2 0.809 CV 1
ASSI { 1591}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 49 and name HB3 ))
4.500 2.500 1.500 peak 1591 spectrum 1 weight 0.10000E+01 volume 0.19313E-02 ppm1 2.835 ppm2 0.875 CV 1
ASSI { 1594}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 22 and name HB2 ))
4.300 2.400 1.700 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.92300E-03 ppm1 2.412 ppm2 1.232 CV 1
ASSI { 1595}
(( segid " " and resid 33 and name HB ))
( segid " " and resid 36 and name HD1%)
5.400 3.700 0.600 peak 1595 spectrum 1 weight 0.10000E+01 volume 0.50036E-03 ppm1 2.089 ppm2 0.827 CV 1
ASSI { 1598}
(( segid " " and resid 44 and name HG2 ))
( segid " " and resid 36 and name HD2%)
5.600 3.900 0.400 peak 1598 spectrum 1 weight 0.10000E+01 volume 0.25001E-03 ppm1 1.845 ppm2 0.544 CV 1
OR { 1598}
(( segid " " and resid 39 and name HB3 ))
( segid " " and resid 36 and name HD2%)
ASSI { 1599}
(( segid " " and resid 31 and name HB3 ))
( segid " " and resid 36 and name HD2%)
3.200 1.300 1.300 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.68640E-02 ppm1 2.417 ppm2 0.543 CV 1
ASSI { 1606}
(( segid " " and resid 55 and name HB2 ))
( segid " " and resid 58 and name HD1%)
4.100 2.100 1.900 peak 1606 spectrum 1 weight 0.10000E+01 volume 0.17992E-02 ppm1 2.921 ppm2 0.922 CV 1
OR { 1606}
(( segid " " and resid 55 and name HB3 ))
( segid " " and resid 58 and name HD1%)
ASSI { 1607}
(( segid " " and resid 53 and name HB3 ))
(( segid " " and resid 49 and name HB3 ))
3.900 1.900 1.900 peak 1607 spectrum 1 weight 0.10000E+01 volume 0.35042E-02 ppm1 2.630 ppm2 0.873 CV 1
ASSI { 1610}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 21 and name HB2 ))
4.500 2.600 1.500 peak 1610 spectrum 1 weight 0.10000E+01 volume 0.20771E-02 ppm1 3.342 ppm2 1.428 CV 1
ASSI { 1613}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 21 and name HB2 ))
4.500 2.500 1.500 peak 1613 spectrum 1 weight 0.10000E+01 volume 0.50174E-02 ppm1 3.510 ppm2 1.429 CV 1
ASSI { 1614}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 21 and name HG ))
5.900 4.400 0.100 peak 1614 spectrum 1 weight 0.10000E+01 volume 0.85938E-03 ppm1 3.514 ppm2 1.237 CV 1
ASSI { 1618}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 43 and name HG13))
3.900 1.900 1.900 peak 1618 spectrum 1 weight 0.10000E+01 volume 0.55229E-03 ppm1 3.412 ppm2 1.066 CV 1
ASSI { 1619}
(( segid " " and resid 44 and name HD3 ))
( segid " " and resid 43 and name HG2%)
3.500 1.500 1.500 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.13140E-01 ppm1 3.410 ppm2 0.890 CV 1
ASSI { 1620}
(( segid " " and resid 44 and name HD3 ))
( segid " " and resid 33 and name HG2%)
2.900 1.100 1.100 peak 1620 spectrum 1 weight 0.10000E+01 volume 0.57636E-02 ppm1 3.414 ppm2 0.772 CV 1
ASSI { 1623}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 22 and name HB3 ))
4.000 2.000 2.000 peak 1623 spectrum 1 weight 0.10000E+01 volume 0.64411E-02 ppm1 3.672 ppm2 0.773 CV 1
ASSI { 1624}
(( segid " " and resid 44 and name HD2 ))
( segid " " and resid 43 and name HG2%)
3.400 1.500 1.500 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.96186E-02 ppm1 3.670 ppm2 0.893 CV 1
ASSI { 1625}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 21 and name HB3 ))
3.400 1.400 1.400 peak 1625 spectrum 1 weight 0.10000E+01 volume 0.75793E-02 ppm1 3.514 ppm2 0.898 CV 1
ASSI { 1630}
(( segid " " and resid 41 and name HD3 ))
(( segid " " and resid 40 and name HB3 ))
5.100 3.300 0.900 peak 1630 spectrum 1 weight 0.10000E+01 volume 0.10272E-02 ppm1 3.793 ppm2 1.434 CV 1
ASSI { 1645}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 49 and name HG ))
5.100 3.300 0.900 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.42883E-03 ppm1 2.822 ppm2 1.570 CV 1
ASSI { 1650}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 13 and name HB2 ))
4.300 2.400 1.700 peak 1650 spectrum 1 weight 0.10000E+01 volume 0.84631E-03 ppm1 2.641 ppm2 1.977 CV 1
OR { 1650}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 13 and name HB2 ))
ASSI { 1655}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 47 and name HG2 ))
4.500 2.500 1.500 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.11844E-02 ppm1 2.808 ppm2 2.226 CV 1
OR { 1655}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 47 and name HG3 ))
ASSI { 1658}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 14 and name HB ))
3.000 1.100 1.100 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.16428E-01 ppm1 3.280 ppm2 2.284 CV 1
ASSI { 1667}
(( segid " " and resid 56 and name HD2 ))
(( segid " " and resid 55 and name HB2 ))
3.500 1.500 1.500 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.70807E-02 ppm1 3.753 ppm2 2.904 CV 1
OR { 1667}
(( segid " " and resid 56 and name HD3 ))
(( segid " " and resid 55 and name HB2 ))
OR { 1667}
(( segid " " and resid 56 and name HD2 ))
(( segid " " and resid 55 and name HB3 ))
OR { 1667}
(( segid " " and resid 56 and name HD3 ))
(( segid " " and resid 55 and name HB3 ))
ASSI { 1670}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 25 and name HB2 ))
4.700 2.800 1.300 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.14127E-02 ppm1 4.370 ppm2 2.785 CV 1
ASSI { 1671}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HB3 ))
5.800 4.200 0.200 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.73386E-03 ppm1 4.363 ppm2 2.954 CV 1
ASSI { 1672}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HB3 ))
5.500 3.800 0.500 peak 1672 spectrum 1 weight 0.10000E+01 volume 0.93469E-03 ppm1 4.467 ppm2 2.769 CV 1
OR { 1672}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HB2 ))
ASSI { 1673}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 11 and name HB2 ))
4.200 2.200 1.800 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.48729E-02 ppm1 4.174 ppm2 2.695 CV 1
ASSI { 1675}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 37 and name HB2 ))
4.400 2.400 1.600 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.80677E-03 ppm1 5.096 ppm2 2.910 CV 1
ASSI { 1677}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 37 and name HB2 ))
4.500 2.500 1.500 peak 1677 spectrum 1 weight 0.10000E+01 volume 0.38619E-02 ppm1 4.184 ppm2 2.905 CV 1
ASSI { 1680}
(( segid " " and resid 18 and name HA2 ))
(( segid " " and resid 17 and name HB3 ))
4.600 2.600 1.400 peak 1680 spectrum 1 weight 0.10000E+01 volume 0.11059E-02 ppm1 3.903 ppm2 2.962 CV 1
ASSI { 1681}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 8 and name HB2 ))
5.500 3.700 0.500 peak 1681 spectrum 1 weight 0.10000E+01 volume 0.45462E-03 ppm1 4.344 ppm2 3.285 CV 1
ASSI { 1682}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HB2 ))
5.300 3.500 0.700 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.84322E-03 ppm1 4.365 ppm2 3.200 CV 1
ASSI { 1683}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HB3 ))
4.600 2.700 1.400 peak 1683 spectrum 1 weight 0.10000E+01 volume 0.20097E-02 ppm1 4.432 ppm2 2.629 CV 1
OR { 1683}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HB2 ))
ASSI { 1684}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 30 and name HB3 ))
4.200 2.200 1.800 peak 1684 spectrum 1 weight 0.10000E+01 volume 0.30173E-02 ppm1 4.455 ppm2 3.321 CV 1
ASSI { 1687}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 35 and name HB2 ))
6.000 5.200 0.000 peak 1687 spectrum 1 weight 0.10000E+01 volume 0.67918E-03 ppm1 4.007 ppm2 3.270 CV 1
ASSI { 1692}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 12 and name HA ))
3.100 1.200 1.200 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.48282E-02 ppm1 5.534 ppm2 3.866 CV 1
ASSI { 1693}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 28 and name HB2 ))
3.000 1.200 1.200 peak 1693 spectrum 1 weight 0.10000E+01 volume 0.79542E-02 ppm1 4.719 ppm2 2.208 CV 1
ASSI { 1694}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 28 and name HB3 ))
3.100 1.200 1.200 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.51549E-02 ppm1 4.719 ppm2 1.915 CV 1
ASSI { 1697}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG2 ))
5.400 3.600 0.600 peak 1697 spectrum 1 weight 0.10000E+01 volume 0.15499E-02 ppm1 5.041 ppm2 1.786 CV 1
OR { 1697}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG3 ))
ASSI { 1702}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 21 and name HD2%)
2.600 0.800 0.800 peak 1702 spectrum 1 weight 0.10000E+01 volume 0.99006E-02 ppm1 3.890 ppm2 -0.152 CV 1
ASSI { 1703}
(( segid " " and resid 44 and name HD2 ))
( segid " " and resid 22 and name HD1%)
2.800 1.000 1.000 peak 1703 spectrum 1 weight 0.10000E+01 volume 0.51480E-02 ppm1 3.671 ppm2 0.372 CV 1
ASSI { 1705}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 22 and name HD1%)
4.200 2.200 1.800 peak 1705 spectrum 1 weight 0.10000E+01 volume 0.26318E-02 ppm1 3.928 ppm2 0.372 CV 1
ASSI { 1706}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 21 and name HD1%)
2.900 1.100 1.100 peak 1706 spectrum 1 weight 0.10000E+01 volume 0.77306E-02 ppm1 4.109 ppm2 0.405 CV 1
ASSI { 1708}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 33 and name HD1%)
2.500 0.800 0.800 peak 1708 spectrum 1 weight 0.10000E+01 volume 0.21741E-01 ppm1 4.407 ppm2 0.631 CV 1
ASSI { 1709}
(( segid " " and resid 11 and name HA ))
( segid " " and resid 21 and name HD1%)
2.800 1.000 1.000 peak 1709 spectrum 1 weight 0.10000E+01 volume 0.69603E-02 ppm1 4.465 ppm2 0.405 CV 1
ASSI { 1710}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 49 and name HD1%)
4.200 2.200 1.800 peak 1710 spectrum 1 weight 0.10000E+01 volume 0.36280E-02 ppm1 4.657 ppm2 0.810 CV 1
ASSI { 1711}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 49 and name HD2%)
5.400 3.600 0.600 peak 1711 spectrum 1 weight 0.10000E+01 volume 0.51171E-03 ppm1 4.657 ppm2 0.737 CV 1
ASSI { 1712}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 49 and name HD2%)
5.400 3.600 0.600 peak 1712 spectrum 1 weight 0.10000E+01 volume 0.55779E-03 ppm1 4.544 ppm2 0.739 CV 1
ASSI { 1713}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 40 and name HD2%)
5.600 4.000 0.400 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.94019E-03 ppm1 4.434 ppm2 0.696 CV 1
ASSI { 1717}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 54 and name HG2%)
3.600 1.700 1.700 peak 1717 spectrum 1 weight 0.10000E+01 volume 0.38894E-02 ppm1 4.191 ppm2 1.000 CV 1
ASSI { 1718}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 49 and name HD1%)
4.300 2.300 1.700 peak 1718 spectrum 1 weight 0.10000E+01 volume 0.15368E-02 ppm1 4.017 ppm2 0.810 CV 1
ASSI { 1720}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 49 and name HB3 ))
4.300 2.300 1.700 peak 1720 spectrum 1 weight 0.10000E+01 volume 0.27501E-02 ppm1 4.017 ppm2 0.875 CV 1
ASSI { 1724}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 26 and name HG2%)
4.300 2.300 1.700 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.28718E-03 ppm1 5.037 ppm2 1.045 CV 1
ASSI { 1727}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 21 and name HD2%)
4.000 2.000 2.000 peak 1727 spectrum 1 weight 0.10000E+01 volume 0.12146E-02 ppm1 5.537 ppm2 -0.152 CV 1
ASSI { 1728}
(( segid " " and resid 30 and name HA ))
( segid " " and resid 21 and name HD2%)
5.800 4.200 0.200 peak 1728 spectrum 1 weight 0.10000E+01 volume 0.32480E-03 ppm1 5.736 ppm2 -0.152 CV 1
ASSI { 1731}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 49 and name HG ))
4.300 2.300 1.700 peak 1731 spectrum 1 weight 0.10000E+01 volume 0.12831E-02 ppm1 4.537 ppm2 1.563 CV 1
ASSI { 1732}
(( segid " " and resid 48 and name HB2 ))
( segid " " and resid 22 and name HD2%)
4.800 2.800 1.200 peak 1732 spectrum 1 weight 0.10000E+01 volume 0.54438E-03 ppm1 3.215 ppm2 -0.634 CV 1
ASSI { 1733}
(( segid " " and resid 44 and name HD3 ))
( segid " " and resid 22 and name HD2%)
3.800 1.800 1.800 peak 1733 spectrum 1 weight 0.10000E+01 volume 0.69844E-02 ppm1 3.413 ppm2 -0.634 CV 1
ASSI { 1734}
(( segid " " and resid 44 and name HD2 ))
( segid " " and resid 22 and name HD2%)
2.700 0.900 0.900 peak 1734 spectrum 1 weight 0.10000E+01 volume 0.60249E-02 ppm1 3.674 ppm2 -0.634 CV 1
ASSI { 1735}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 22 and name HD2%)
3.800 1.800 1.800 peak 1735 spectrum 1 weight 0.10000E+01 volume 0.53612E-02 ppm1 3.926 ppm2 -0.634 CV 1
ASSI { 1736}
(( segid " " and resid 30 and name HB3 ))
( segid " " and resid 21 and name HD2%)
2.400 0.700 0.700 peak 1736 spectrum 1 weight 0.10000E+01 volume 0.11262E-01 ppm1 3.337 ppm2 -0.151 CV 1
ASSI { 1737}
(( segid " " and resid 30 and name HB2 ))
( segid " " and resid 21 and name HD2%)
3.300 1.400 1.400 peak 1737 spectrum 1 weight 0.10000E+01 volume 0.39857E-02 ppm1 3.511 ppm2 -0.151 CV 1
ASSI { 1738}
(( segid " " and resid 30 and name HB3 ))
( segid " " and resid 21 and name HD1%)
3.000 1.100 1.100 peak 1738 spectrum 1 weight 0.10000E+01 volume 0.86041E-02 ppm1 3.337 ppm2 0.407 CV 1
ASSI { 1741}
(( segid " " and resid 30 and name HB2 ))
( segid " " and resid 21 and name HD1%)
3.200 1.200 1.200 peak 1741 spectrum 1 weight 0.10000E+01 volume 0.97527E-02 ppm1 3.516 ppm2 0.405 CV 1
ASSI { 1742}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 36 and name HD2%)
4.400 2.400 1.600 peak 1742 spectrum 1 weight 0.10000E+01 volume 0.10348E-02 ppm1 3.882 ppm2 0.544 CV 1
ASSI { 1745}
( segid " " and resid 49 and name HD1%)
(( segid " " and resid 26 and name HN ))
4.000 2.000 2.000 peak 1745 spectrum 1 weight 0.10000E+01 volume 0.49555E-02 ppm1 0.825 ppm2 9.674 CV 1
ASSI { 1746}
( segid " " and resid 49 and name HD2%)
(( segid " " and resid 26 and name HN ))
5.000 3.200 1.000 peak 1746 spectrum 1 weight 0.10000E+01 volume 0.32405E-03 ppm1 0.752 ppm2 9.672 CV 1
ASSI { 1748}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 48 and name HZ2 ))
3.900 1.900 1.900 peak 1748 spectrum 1 weight 0.10000E+01 volume 0.41679E-02 ppm1 -0.616 ppm2 7.103 CV 1
ASSI { 1750}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 48 and name HZ3 ))
4.600 2.700 1.400 peak 1750 spectrum 1 weight 0.10000E+01 volume 0.13958E-02 ppm1 -0.616 ppm2 6.639 CV 1
ASSI { 1751}
( segid " " and resid 22 and name HD2%)
(( segid " " and resid 48 and name HH2 ))
4.700 2.800 1.300 peak 1751 spectrum 1 weight 0.10000E+01 volume 0.15613E-02 ppm1 -0.619 ppm2 6.506 CV 1
ASSI { 1753}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 48 and name HZ3 ))
4.400 2.400 1.600 peak 1753 spectrum 1 weight 0.10000E+01 volume 0.10076E-02 ppm1 0.395 ppm2 6.639 CV 1
ASSI { 1760}
(( segid " " and resid 19 and name HA1 ))
(( segid " " and resid 32 and name HE1 ))
4.500 2.500 1.500 peak 1760 spectrum 1 weight 0.10000E+01 volume 0.13869E-02 ppm1 4.550 ppm2 7.460 CV 1
ASSI { 1763}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 46 and name HN ))
3.700 1.700 1.700 peak 1763 spectrum 1 weight 0.10000E+01 volume 0.19107E-02 ppm1 1.972 ppm2 8.119 CV 1
ASSI { 1765}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 53 and name HN ))
4.500 2.500 1.500 peak 1765 spectrum 1 weight 0.10000E+01 volume 0.12920E-02 ppm1 1.015 ppm2 8.000 CV 1
ASSI { 1768}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 40 and name HN ))
3.700 1.700 1.700 peak 1768 spectrum 1 weight 0.10000E+01 volume 0.27050E-02 ppm1 3.888 ppm2 7.529 CV 1
ASSI { 1769}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 37 and name HN ))
4.900 3.000 1.100 peak 1769 spectrum 1 weight 0.10000E+01 volume 0.80745E-03 ppm1 5.098 ppm2 8.346 CV 1
ASSI { 1771}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 8 and name HD2 ))
5.100 3.200 0.900 peak 1771 spectrum 1 weight 0.10000E+01 volume 0.31978E-03 ppm1 5.734 ppm2 7.502 CV 1
ASSI { 1772}
(( segid " " and resid 49 and name HG ))
(( segid " " and resid 25 and name HN ))
5.600 3.900 0.400 peak 1772 spectrum 1 weight 0.10000E+01 volume 0.31916E-03 ppm1 1.581 ppm2 9.239 CV 1
ASSI { 1778}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 36 and name HD2%)
5.700 4.100 0.300 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.80023E-03 ppm1 4.439 ppm2 0.544 CV 1
ASSI { 1780}
(( segid " " and resid 11 and name HA ))
( segid " " and resid 21 and name HD2%)
4.200 2.200 1.800 peak 1780 spectrum 1 weight 0.10000E+01 volume 0.19801E-02 ppm1 4.477 ppm2 -0.151 CV 1
ASSI { 1781}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 27 and name HN ))
2.900 1.000 1.000 peak 1781 spectrum 1 weight 0.10000E+01 volume 0.78132E-02 ppm1 3.877 ppm2 8.225 CV 1
ASSI { 1784}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 50 and name HN ))
4.800 2.800 1.200 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.65477E-03 ppm1 8.018 ppm2 9.093 CV 1
ASSI { 1786}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 16 and name HN ))
6.000 6.000 0.000 peak 1786 spectrum 1 weight 0.10000E+01 volume 0.34114E-03 ppm1 2.713 ppm2 8.149 CV 1
ASSI { 1787}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 15 and name HN ))
4.800 2.900 1.200 peak 1787 spectrum 1 weight 0.10000E+01 volume 0.18371E-02 ppm1 3.289 ppm2 8.071 CV 1
ASSI { 1793}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 9 and name HN ))
5.400 3.700 0.600 peak 1793 spectrum 1 weight 0.10000E+01 volume 0.24392E-03 ppm1 7.601 ppm2 8.830 CV 1
ASSI { 1799}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 48 and name HZ3 ))
5.000 3.200 1.000 peak 1799 spectrum 1 weight 0.10000E+01 volume 0.43846E-03 ppm1 5.735 ppm2 6.636 CV 1
ASSI { 1800}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 48 and name HZ2 ))
4.100 2.100 1.900 peak 1800 spectrum 1 weight 0.10000E+01 volume 0.25283E-02 ppm1 0.714 ppm2 7.103 CV 1
ASSI { 1806}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 36 and name HD1%)
2.500 0.800 0.800 peak 1806 spectrum 1 weight 0.10000E+01 volume 0.14354E-01 ppm1 3.885 ppm2 0.829 CV 1
ASSI { 1807}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 40 and name HD1%)
4.400 2.500 1.600 peak 1807 spectrum 1 weight 0.10000E+01 volume 0.24237E-03 ppm1 4.196 ppm2 0.916 CV 1
ASSI { 1808}
(( segid " " and resid 35 and name HB2 ))
( segid " " and resid 14 and name HG1%)
3.500 1.600 1.600 peak 1808 spectrum 1 weight 0.10000E+01 volume 0.13150E-01 ppm1 3.284 ppm2 1.298 CV 1
ASSI { 1809}
(( segid " " and resid 44 and name HB3 ))
( segid " " and resid 40 and name HD2%)
5.600 3.900 0.400 peak 1809 spectrum 1 weight 0.10000E+01 volume 0.64686E-03 ppm1 1.974 ppm2 0.697 CV 1
ASSI { 1813}
( segid " " and resid 43 and name HG2%)
( segid " " and resid 22 and name HD1%)
3.400 1.400 1.400 peak 1813 spectrum 1 weight 0.10000E+01 volume 0.76412E-02 ppm1 0.908 ppm2 0.373 CV 1
ASSI { 1817}
(( segid " " and resid 12 and name HG ))
(( segid " " and resid 16 and name HN ))
4.800 2.900 1.200 peak 1817 spectrum 1 weight 0.10000E+01 volume 0.48592E-03 ppm1 7.404 ppm2 8.146 CV 1
ASSI { 1820}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 8 and name HD2 ))
5.600 4.000 0.400 peak 1820 spectrum 1 weight 0.10000E+01 volume 0.55538E-03 ppm1 1.932 ppm2 7.504 CV 1
ASSI { 1822}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 30 and name HB3 ))
6.000 4.500 0.000 peak 1822 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.534 ppm2 3.317 CV 1
ASSI { 1824}
(( segid " " and resid 16 and name HG3 ))
( segid " " and resid 11 and name HD% )
4.100 2.100 1.900 peak 1824 spectrum 1 weight 0.10000E+01 volume 0.21005E-02 ppm1 1.207 ppm2 6.919 CV 1
ASSI { 1825}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 31 and name HN ))
2.900 1.000 1.000 peak 1825 spectrum 1 weight 0.10000E+01 volume 0.67196E-02 ppm1 9.045 ppm2 9.198 CV 1
ASSI { 1830}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 12 and name HG ))
2.800 1.000 1.000 peak 1830 spectrum 1 weight 0.10000E+01 volume 0.83428E-02 ppm1 1.840 ppm2 7.385 CV 1
ASSI { 1833}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HE ))
5.100 3.200 0.900 peak 1833 spectrum 1 weight 0.10000E+01 volume 0.30121E-03 ppm1 1.994 ppm2 8.640 CV 1
ASSI { 1835}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 15 and name HN ))
4.400 2.400 1.600 peak 1835 spectrum 1 weight 0.10000E+01 volume 0.17222E-02 ppm1 3.354 ppm2 8.071 CV 1
ASSI { 1836}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 58 and name HN ))
5.100 3.200 0.900 peak 1836 spectrum 1 weight 0.10000E+01 volume 0.45222E-03 ppm1 2.913 ppm2 8.071 CV 1
OR { 1836}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 58 and name HN ))
ASSI { 1841}
(( segid " " and resid 13 and name HD3 ))
( segid " " and resid 31 and name HE% )
4.700 2.800 1.300 peak 1841 spectrum 1 weight 0.10000E+01 volume 0.53681E-03 ppm1 3.153 ppm2 6.879 CV 1
ASSI { 1844}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 35 and name HN ))
3.300 1.400 1.400 peak 1844 spectrum 1 weight 0.10000E+01 volume 0.47388E-02 ppm1 2.793 ppm2 7.405 CV 1
ASSI { 1847}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 1847 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.416 ppm2 8.355 CV 1
ASSI { 1848}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 13 and name HE ))
4.700 2.800 1.300 peak 1848 spectrum 1 weight 0.10000E+01 volume 0.57911E-03 ppm1 7.597 ppm2 8.637 CV 1
ASSI { 1849}
(( segid " " and resid 48 and name HD1 ))
(( segid " " and resid 49 and name HN ))
3.500 1.600 1.600 peak 1849 spectrum 1 weight 0.10000E+01 volume 0.36727E-02 ppm1 7.309 ppm2 6.870 CV 1
ASSI { 1855}
(( segid " " and resid 13 and name HB3 ))
( segid " " and resid 31 and name HE% )
4.200 2.200 1.800 peak 1855 spectrum 1 weight 0.10000E+01 volume 0.79886E-03 ppm1 1.375 ppm2 6.877 CV 1
ASSI { 1856}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HN ))
6.000 4.500 0.000 peak 1856 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.882 ppm2 8.683 CV 1
ASSI { 1857}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HN ))
6.000 4.500 0.000 peak 1857 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.937 ppm2 8.681 CV 1
ASSI { 1858}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HD3 ))
6.000 4.500 0.000 peak 1858 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.089 ppm2 3.684 CV 1
ASSI { 1859}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HD2 ))
6.000 4.500 0.000 peak 1859 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.089 ppm2 3.791 CV 1
ASSI { 1860}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HN ))
6.000 4.500 0.000 peak 1860 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.391 ppm2 9.033 CV 1
ASSI { 1862}
( segid " " and resid 49 and name HD2%)
(( segid " " and resid 25 and name HN ))
4.800 2.800 1.200 peak 1862 spectrum 1 weight 0.10000E+01 volume 0.34014E-03 ppm1 0.758 ppm2 9.238 CV 1
ASSI { 1863}
( segid " " and resid 49 and name HD1%)
(( segid " " and resid 25 and name HN ))
5.000 3.200 1.000 peak 1863 spectrum 1 weight 0.10000E+01 volume 0.17521E-02 ppm1 0.826 ppm2 9.238 CV 1
ASSI { 1864}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HN ))
2.800 1.000 1.000 peak 1864 spectrum 1 weight 0.10000E+01 volume 0.61075E-02 ppm1 1.249 ppm2 9.032 CV 1
ASSI { 1867}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 1867 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.839 ppm2 9.094 CV 1
ASSI { 1870}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HN ))
6.000 4.500 0.000 peak 1870 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.878 ppm2 8.596 CV 1
ASSI { 1871}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HN ))
6.000 4.500 0.000 peak 1871 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.739 ppm2 9.241 CV 1
ASSI { 1872}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HN ))
6.000 4.500 0.000 peak 1872 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.816 ppm2 9.242 CV 1
ASSI { 1873}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 33 and name HN ))
6.000 4.500 0.000 peak 1873 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.796 ppm2 9.202 CV 1
ASSI { 1874}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB3 ))
6.000 4.500 0.000 peak 1874 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.181 ppm2 1.950 CV 1
ASSI { 1875}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HG3 ))
6.000 4.500 0.000 peak 1875 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.181 ppm2 1.908 CV 1
ASSI { 1876}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HG2 ))
6.000 4.500 0.000 peak 1876 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.181 ppm2 2.070 CV 1
ASSI { 1877}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HN ))
6.000 4.500 0.000 peak 1877 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.336 ppm2 9.337 CV 1
ASSI { 1879}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 25 and name HN ))
6.000 4.500 0.000 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.879 ppm2 9.238 CV 1
ASSI { 1880}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 25 and name HN ))
5.400 3.700 0.600 peak 1880 spectrum 1 weight 0.10000E+01 volume 0.40201E-03 ppm1 4.359 ppm2 9.239 CV 1
ASSI { 1881}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 47 and name HN ))
6.000 4.500 0.000 peak 1881 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.906 ppm2 8.390 CV 1
ASSI { 1882}
(( segid " " and resid 48 and name HZ3 ))
(( segid " " and resid 31 and name HN ))
4.500 2.600 1.500 peak 1882 spectrum 1 weight 0.10000E+01 volume 0.63482E-03 ppm1 6.658 ppm2 9.195 CV 1
ASSI { 1883}
( segid " " and resid 11 and name HD% )
(( segid " " and resid 10 and name HN ))
4.300 2.300 1.700 peak 1883 spectrum 1 weight 0.10000E+01 volume 0.77994E-03 ppm1 6.936 ppm2 8.986 CV 1
ASSI { 1885}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 33 and name HN ))
5.400 3.600 0.600 peak 1885 spectrum 1 weight 0.10000E+01 volume 0.58392E-03 ppm1 7.424 ppm2 9.202 CV 1
ASSI { 1886}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 33 and name HN ))
6.000 4.500 0.000 peak 1886 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 8.690 ppm2 9.199 CV 1
ASSI { 1887}
(( segid " " and resid 12 and name HG ))
(( segid " " and resid 17 and name HN ))
3.400 1.400 1.400 peak 1887 spectrum 1 weight 0.10000E+01 volume 0.48626E-02 ppm1 7.406 ppm2 8.602 CV 1
ASSI { 1888}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HN ))
6.000 4.500 0.000 peak 1888 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.993 ppm2 8.601 CV 1
ASSI { 1889}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HN ))
6.000 4.500 0.000 peak 1889 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.095 ppm2 8.601 CV 1
ASSI { 1891}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HN ))
6.000 4.500 0.000 peak 1891 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.305 ppm2 8.600 CV 1
ASSI { 1892}
(( segid " " and resid 18 and name HA1 ))
(( segid " " and resid 18 and name HN ))
6.000 4.500 0.000 peak 1892 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.505 ppm2 8.589 CV 1
ASSI { 1894}
(( segid " " and resid 18 and name HA2 ))
(( segid " " and resid 18 and name HN ))
6.000 4.500 0.000 peak 1894 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.908 ppm2 8.589 CV 1
ASSI { 1895}
(( segid " " and resid 18 and name HA2 ))
(( segid " " and resid 19 and name HN ))
6.000 4.500 0.000 peak 1895 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.910 ppm2 8.641 CV 1
ASSI { 1896}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 3 and name HN ))
6.000 4.500 0.000 peak 1896 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.487 ppm2 8.539 CV 1
ASSI { 1897}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 9 and name HN ))
6.000 4.500 0.000 peak 1897 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.917 ppm2 8.829 CV 1
ASSI { 1898}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 9 and name HN ))
6.000 4.500 0.000 peak 1898 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.290 ppm2 8.830 CV 1
ASSI { 1899}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 14 and name HN ))
6.000 4.500 0.000 peak 1899 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.889 ppm2 8.842 CV 1
ASSI { 1900}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 8 and name HD2 ))
6.000 4.500 0.000 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.919 ppm2 7.504 CV 1
ASSI { 1901}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 8 and name HB3 ))
6.000 4.500 0.000 peak 1901 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.294 ppm2 2.903 CV 1
ASSI { 1903}
(( segid " " and resid 42 and name HG2 ))
(( segid " " and resid 43 and name HN ))
6.000 4.500 0.000 peak 1903 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.066 ppm2 8.677 CV 1
ASSI { 1904}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 17 and name HN ))
6.000 4.500 0.000 peak 1904 spectrum 1 weight 0.10000E+01 volume 0.47216E-50 ppm1 2.455 ppm2 8.602 CV 1
ASSI { 1906}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 18 and name HN ))
6.000 4.500 0.000 peak 1906 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.305 ppm2 8.589 CV 1
ASSI { 1907}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HN ))
6.000 4.500 0.000 peak 1907 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.342 ppm2 8.275 CV 1
ASSI { 1908}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HN ))
6.000 4.500 0.000 peak 1908 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.886 ppm2 8.275 CV 1
ASSI { 1909}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 13 and name HN ))
6.000 4.500 0.000 peak 1909 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.336 ppm2 8.276 CV 1
ASSI { 1910}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 1910 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.327 ppm2 8.560 CV 1
ASSI { 1911}
(( segid " " and resid 44 and name HB3 ))
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 1911 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.973 ppm2 8.560 CV 1
ASSI { 1912}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 17 and name HN ))
3.700 1.700 1.700 peak 1912 spectrum 1 weight 0.10000E+01 volume 0.35833E-02 ppm1 1.827 ppm2 8.606 CV 1
ASSI { 1913}
(( segid " " and resid 44 and name HG3 ))
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 1913 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.829 ppm2 8.561 CV 1
ASSI { 1915}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 3 and name HN ))
6.000 4.500 0.000 peak 1915 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.662 ppm2 8.539 CV 1
OR { 1915}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HN ))
ASSI { 1916}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 4 and name HN ))
3.900 1.900 1.900 peak 1916 spectrum 1 weight 0.10000E+01 volume 0.17463E-02 ppm1 1.658 ppm2 8.445 CV 1
OR { 1916}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 4 and name HN ))
ASSI { 1917}
(( segid " " and resid 2 and name HB3 ))
(( segid " " and resid 3 and name HN ))
6.000 4.500 0.000 peak 1917 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.985 ppm2 8.539 CV 1
OR { 1917}
(( segid " " and resid 2 and name HG2 ))
(( segid " " and resid 3 and name HN ))
ASSI { 1918}
(( segid " " and resid 3 and name HG ))
(( segid " " and resid 3 and name HN ))
6.000 4.500 0.000 peak 1918 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.608 ppm2 8.539 CV 1
ASSI { 1919}
( segid " " and resid 3 and name HD2%)
(( segid " " and resid 3 and name HN ))
6.000 4.500 0.000 peak 1919 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.859 ppm2 8.541 CV 1
ASSI { 1920}
( segid " " and resid 3 and name HD1%)
(( segid " " and resid 3 and name HN ))
6.000 4.500 0.000 peak 1920 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.889 ppm2 8.541 CV 1
ASSI { 1923}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HN ))
6.000 4.500 0.000 peak 1923 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.887 ppm2 6.871 CV 1
ASSI { 1924}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 49 and name HN ))
4.000 2.000 2.000 peak 1924 spectrum 1 weight 0.10000E+01 volume 0.47044E-03 ppm1 1.012 ppm2 6.869 CV 1
ASSI { 1925}
( segid " " and resid 49 and name HD1%)
(( segid " " and resid 49 and name HN ))
6.000 4.500 0.000 peak 1925 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.845 ppm2 6.871 CV 1
ASSI { 1926}
( segid " " and resid 3 and name HD1%)
(( segid " " and resid 4 and name HN ))
3.700 1.700 1.700 peak 1926 spectrum 1 weight 0.10000E+01 volume 0.75002E-03 ppm1 0.903 ppm2 8.446 CV 1
ASSI { 1927}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HN ))
6.000 4.500 0.000 peak 1927 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.362 ppm2 8.442 CV 1
ASSI { 1928}
( segid " " and resid 57 and name HB% )
(( segid " " and resid 57 and name HN ))
2.800 1.000 1.000 peak 1928 spectrum 1 weight 0.10000E+01 volume 0.15114E-01 ppm1 1.391 ppm2 8.232 CV 1
ASSI { 1931}
(( segid " " and resid 36 and name HG ))
(( segid " " and resid 37 and name HN ))
6.000 4.500 0.000 peak 1931 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.728 ppm2 8.348 CV 1
ASSI { 1932}
(( segid " " and resid 52 and name HB3 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 1932 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.850 ppm2 8.355 CV 1
ASSI { 1933}
(( segid " " and resid 52 and name HG3 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 1933 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.798 ppm2 8.354 CV 1
ASSI { 1934}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 1934 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.944 ppm2 8.356 CV 1
ASSI { 1935}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 15 and name HN ))
2.200 0.600 0.600 peak 1935 spectrum 1 weight 0.10000E+01 volume 0.18783E-01 ppm1 2.301 ppm2 8.071 CV 1
ASSI { 1936}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 15 and name HN ))
3.900 1.900 1.900 peak 1936 spectrum 1 weight 0.10000E+01 volume 0.14461E-02 ppm1 1.829 ppm2 8.068 CV 1
ASSI { 1937}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 1937 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.600 ppm2 8.072 CV 1
ASSI { 1938}
(( segid " " and resid 58 and name HG ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 1938 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.626 ppm2 8.073 CV 1
ASSI { 1939}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 1939 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.692 ppm2 8.072 CV 1
ASSI { 1941}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HN ))
6.000 4.500 0.000 peak 1941 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.818 ppm2 8.147 CV 1
ASSI { 1942}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 1942 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.681 ppm2 8.127 CV 1
ASSI { 1943}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 1943 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.302 ppm2 8.127 CV 1
ASSI { 1944}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 1944 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.864 ppm2 8.127 CV 1
ASSI { 1945}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 59 and name HN ))
6.000 4.500 0.000 peak 1945 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.342 ppm2 8.127 CV 1
ASSI { 1946}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 1946 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.342 ppm2 8.072 CV 1
ASSI { 1947}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 1947 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.287 ppm2 8.070 CV 1
ASSI { 1948}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HN ))
6.000 4.500 0.000 peak 1948 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.185 ppm2 8.349 CV 1
ASSI { 1949}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HN ))
6.000 4.500 0.000 peak 1949 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.194 ppm2 7.995 CV 1
ASSI { 1950}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 21 and name HN ))
6.000 4.500 0.000 peak 1950 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.189 ppm2 7.990 CV 1
ASSI { 1951}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HN ))
6.000 4.500 0.000 peak 1951 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.337 ppm2 8.455 CV 1
ASSI { 1952}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 16 and name HN ))
5.100 3.200 0.900 peak 1952 spectrum 1 weight 0.10000E+01 volume 0.45806E-03 ppm1 3.900 ppm2 8.150 CV 1
ASSI { 1953}
(( segid " " and resid 4 and name HA2 ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 1953 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.980 ppm2 8.258 CV 1
ASSI { 1954}
(( segid " " and resid 4 and name HA1 ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 1954 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.039 ppm2 8.258 CV 1
ASSI { 1955}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 1955 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.409 ppm2 8.258 CV 1
ASSI { 1956}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 1956 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.850 ppm2 8.258 CV 1
ASSI { 1957}
(( segid " " and resid 5 and name HB3 ))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 1957 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.776 ppm2 8.258 CV 1
ASSI { 1958}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 1958 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.670 ppm2 8.184 CV 1
ASSI { 1959}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 1959 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.585 ppm2 8.185 CV 1
ASSI { 1960}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 27 and name HN ))
6.000 4.500 0.000 peak 1960 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.663 ppm2 8.225 CV 1
ASSI { 1961}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.676 ppm2 8.263 CV 1
ASSI { 1962}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 1962 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.720 ppm2 8.264 CV 1
ASSI { 1963}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 16 and name HN ))
6.000 4.500 0.000 peak 1963 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.931 ppm2 8.148 CV 1
ASSI { 1964}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HN ))
6.000 4.500 0.000 peak 1964 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.931 ppm2 8.072 CV 1
ASSI { 1965}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 46 and name HN ))
6.000 4.500 0.000 peak 1965 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.770 ppm2 8.123 CV 1
ASSI { 1966}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HN ))
6.000 4.500 0.000 peak 1966 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.783 ppm2 8.561 CV 1
ASSI { 1967}
( segid " " and resid 11 and name HD% )
(( segid " " and resid 16 and name HN ))
3.900 1.900 1.900 peak 1967 spectrum 1 weight 0.10000E+01 volume 0.28680E-02 ppm1 6.934 ppm2 8.147 CV 1
ASSI { 1968}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 1968 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.088 ppm2 8.187 CV 1
ASSI { 1969}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HN ))
6.000 4.500 0.000 peak 1969 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.151 ppm2 8.187 CV 1
ASSI { 1970}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 1970 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.916 ppm2 8.266 CV 1
ASSI { 1971}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 1971 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.091 ppm2 8.269 CV 1
ASSI { 1973}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HN ))
6.000 4.500 0.000 peak 1973 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.973 ppm2 8.147 CV 1
OR { 1973}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HN ))
ASSI { 1974}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 16 and name HN ))
6.000 4.500 0.000 peak 1974 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.008 ppm2 8.148 CV 1
ASSI { 1975}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 16 and name HN ))
3.800 1.800 1.800 peak 1975 spectrum 1 weight 0.10000E+01 volume 0.46047E-02 ppm1 3.343 ppm2 8.149 CV 1
ASSI { 1976}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 16 and name HN ))
6.000 4.500 0.000 peak 1976 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.400 ppm2 8.149 CV 1
ASSI { 1977}
(( segid " " and resid 45 and name HD22))
(( segid " " and resid 45 and name HD21))
6.000 4.500 0.000 peak 1977 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.954 ppm2 7.609 CV 1
ASSI { 1978}
(( segid " " and resid 37 and name HD22))
(( segid " " and resid 37 and name HD21))
6.000 4.500 0.000 peak 1978 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.901 ppm2 7.603 CV 1
ASSI { 1979}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HN ))
2.100 0.500 0.500 peak 1979 spectrum 1 weight 0.10000E+01 volume 0.23254E-01 ppm1 6.513 ppm2 7.403 CV 1
ASSI { 1981}
(( segid " " and resid 48 and name HH2 ))
(( segid " " and resid 48 and name HE3 ))
4.800 2.900 1.200 peak 1981 spectrum 1 weight 0.10000E+01 volume 0.14385E-02 ppm1 6.520 ppm2 7.277 CV 1
ASSI { 1982}
(( segid " " and resid 48 and name HZ3 ))
(( segid " " and resid 48 and name HE3 ))
2.500 0.800 0.800 peak 1982 spectrum 1 weight 0.10000E+01 volume 0.16747E-01 ppm1 6.658 ppm2 7.277 CV 1
ASSI { 1983}
( segid " " and resid 11 and name HD% )
( segid " " and resid 11 and name HE% )
2.000 0.500 0.500 peak 1983 spectrum 1 weight 0.10000E+01 volume 0.54094E-01 ppm1 6.926 ppm2 7.281 CV 1
ASSI { 1984}
( segid " " and resid 31 and name HE% )
( segid " " and resid 31 and name HD% )
2.000 0.500 0.500 peak 1984 spectrum 1 weight 0.10000E+01 volume 0.45634E-01 ppm1 6.899 ppm2 7.104 CV 1
ASSI { 1985}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 35 and name HN ))
2.200 0.600 0.600 peak 1985 spectrum 1 weight 0.10000E+01 volume 0.12022E-01 ppm1 7.156 ppm2 7.404 CV 1
ASSI { 1986}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 11 and name HD% )
6.000 4.500 0.000 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.699 ppm2 6.916 CV 1
ASSI { 1987}
(( segid " " and resid 34 and name HD2 ))
(( segid " " and resid 34 and name HE1 ))
6.000 4.500 0.000 peak 1987 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.181 ppm2 7.630 CV 1
ASSI { 1988}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 31 and name HD% )
2.900 1.100 1.100 peak 1988 spectrum 1 weight 0.10000E+01 volume 0.67196E-02 ppm1 5.534 ppm2 7.105 CV 1
ASSI { 1989}
(( segid " " and resid 30 and name HA ))
( segid " " and resid 31 and name HD% )
3.400 1.500 1.500 peak 1989 spectrum 1 weight 0.10000E+01 volume 0.43330E-02 ppm1 5.733 ppm2 7.108 CV 1
ASSI { 1990}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 31 and name HE% )
5.400 3.700 0.600 peak 1990 spectrum 1 weight 0.10000E+01 volume 0.63344E-03 ppm1 5.536 ppm2 6.877 CV 1
ASSI { 1991}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 12 and name HG ))
5.200 3.400 0.800 peak 1991 spectrum 1 weight 0.10000E+01 volume 0.60387E-03 ppm1 5.303 ppm2 7.385 CV 1
ASSI { 1994}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HN ))
6.000 4.500 0.000 peak 1994 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.286 ppm2 7.405 CV 1
ASSI { 1995}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HE3 ))
6.000 4.500 0.000 peak 1995 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.969 ppm2 7.281 CV 1
ASSI { 1996}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HE3 ))
6.000 4.500 0.000 peak 1996 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.217 ppm2 7.280 CV 1
ASSI { 1997}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HD1 ))
6.000 4.500 0.000 peak 1997 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.969 ppm2 7.292 CV 1
ASSI { 1998}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HD1 ))
6.000 4.500 0.000 peak 1998 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.220 ppm2 7.291 CV 1
ASSI { 1999}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 31 and name HD% )
2.800 1.000 1.000 peak 1999 spectrum 1 weight 0.10000E+01 volume 0.68365E-02 ppm1 2.969 ppm2 7.105 CV 1
ASSI { 2001}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 34 and name HN ))
2.700 0.900 0.900 peak 2001 spectrum 1 weight 0.10000E+01 volume 0.78957E-02 ppm1 2.795 ppm2 7.135 CV 1
ASSI { 2002}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 2002 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.322 ppm2 7.135 CV 1
ASSI { 2003}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 2003 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.464 ppm2 7.135 CV 1
ASSI { 2004}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HD21))
6.000 4.500 0.000 peak 2004 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.922 ppm2 7.604 CV 1
ASSI { 2005}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 45 and name HD21))
6.000 4.500 0.000 peak 2005 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.771 ppm2 7.607 CV 1
OR { 2005}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HD21))
ASSI { 2007}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HE1 ))
3.700 1.700 1.700 peak 2007 spectrum 1 weight 0.10000E+01 volume 0.21091E-02 ppm1 3.327 ppm2 7.461 CV 1
ASSI { 2008}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 12 and name HG ))
6.000 4.500 0.000 peak 2008 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.405 ppm2 7.391 CV 1
ASSI { 2009}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 8 and name HD2 ))
5.400 3.600 0.600 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.77203E-03 ppm1 2.727 ppm2 7.504 CV 1
ASSI { 2010}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 11 and name HE% )
6.000 4.500 0.000 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.727 ppm2 7.282 CV 1
ASSI { 2012}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 8 and name HD2 ))
5.000 3.200 1.000 peak 2012 spectrum 1 weight 0.10000E+01 volume 0.58255E-03 ppm1 3.881 ppm2 7.505 CV 1
ASSI { 2014}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 35 and name HN ))
4.300 2.300 1.700 peak 2014 spectrum 1 weight 0.10000E+01 volume 0.12961E-02 ppm1 3.884 ppm2 7.403 CV 1
ASSI { 2015}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HN ))
6.000 4.500 0.000 peak 2015 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.884 ppm2 7.136 CV 1
ASSI { 2016}
(( segid " " and resid 29 and name HB3 ))
( segid " " and resid 31 and name HD% )
3.200 1.300 1.300 peak 2016 spectrum 1 weight 0.10000E+01 volume 0.63173E-02 ppm1 3.864 ppm2 7.108 CV 1
ASSI { 2017}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 37 and name HD21))
6.000 4.500 0.000 peak 2017 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.634 ppm2 7.600 CV 1
ASSI { 2018}
(( segid " " and resid 35 and name HB3 ))
( segid " " and resid 31 and name HD% )
5.100 3.200 0.900 peak 2018 spectrum 1 weight 0.10000E+01 volume 0.57258E-03 ppm1 2.878 ppm2 7.106 CV 1
ASSI { 2021}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 34 and name HD2 ))
4.200 2.200 1.800 peak 2021 spectrum 1 weight 0.10000E+01 volume 0.12339E-02 ppm1 4.452 ppm2 7.174 CV 1
ASSI { 2022}
(( segid " " and resid 33 and name HG13))
(( segid " " and resid 34 and name HD2 ))
5.600 3.900 0.400 peak 2022 spectrum 1 weight 0.10000E+01 volume 0.29430E-03 ppm1 1.299 ppm2 7.172 CV 1
ASSI { 2023}
(( segid " " and resid 33 and name HG12))
(( segid " " and resid 34 and name HD2 ))
6.000 4.600 0.000 peak 2023 spectrum 1 weight 0.10000E+01 volume 0.34905E-03 ppm1 1.470 ppm2 7.172 CV 1
ASSI { 2024}
(( segid " " and resid 39 and name HG2 ))
(( segid " " and resid 40 and name HN ))
6.000 4.500 0.000 peak 2024 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.085 ppm2 7.531 CV 1
OR { 2024}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 40 and name HN ))
ASSI { 2025}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 30 and name HN ))
5.300 3.500 0.700 peak 2025 spectrum 1 weight 0.10000E+01 volume 0.35971E-03 ppm1 1.372 ppm2 7.580 CV 1
ASSI { 2028}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 30 and name HN ))
3.300 1.400 1.400 peak 2028 spectrum 1 weight 0.10000E+01 volume 0.26940E-02 ppm1 1.704 ppm2 7.581 CV 1
ASSI { 2029}
(( segid " " and resid 9 and name HB2 ))
( segid " " and resid 11 and name HE% )
3.300 1.300 1.300 peak 2029 spectrum 1 weight 0.10000E+01 volume 0.42986E-02 ppm1 1.863 ppm2 7.288 CV 1
ASSI { 2030}
(( segid " " and resid 41 and name HG3 ))
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 2030 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.543 ppm2 6.982 CV 1
ASSI { 2031}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 42 and name HN ))
6.000 4.500 0.000 peak 2031 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.839 ppm2 6.980 CV 1
OR { 2031}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HN ))
ASSI { 2032}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 42 and name HN ))
6.000 4.700 0.000 peak 2032 spectrum 1 weight 0.10000E+01 volume 0.29867E-03 ppm1 1.758 ppm2 6.983 CV 1
ASSI { 2033}
(( segid " " and resid 14 and name HB ))
( segid " " and resid 31 and name HD% )
4.900 3.000 1.100 peak 2033 spectrum 1 weight 0.10000E+01 volume 0.67230E-03 ppm1 2.302 ppm2 7.105 CV 1
ASSI { 2034}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 12 and name HG ))
3.700 1.700 1.700 peak 2034 spectrum 1 weight 0.10000E+01 volume 0.50277E-02 ppm1 -0.136 ppm2 7.387 CV 1
ASSI { 2035}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 48 and name HZ2 ))
4.600 2.700 1.400 peak 2035 spectrum 1 weight 0.10000E+01 volume 0.53578E-03 ppm1 0.389 ppm2 7.103 CV 1
ASSI { 2036}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 34 and name HN ))
5.200 3.400 0.800 peak 2036 spectrum 1 weight 0.10000E+01 volume 0.12941E-02 ppm1 0.650 ppm2 7.135 CV 1
ASSI { 2037}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 34 and name HN ))
4.500 2.500 1.500 peak 2037 spectrum 1 weight 0.10000E+01 volume 0.21517E-02 ppm1 0.796 ppm2 7.135 CV 1
ASSI { 2038}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 42 and name HN ))
4.200 2.200 1.800 peak 2038 spectrum 1 weight 0.10000E+01 volume 0.14185E-02 ppm1 0.792 ppm2 6.982 CV 1
ASSI { 2041}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 35 and name HN ))
6.000 5.800 0.000 peak 2041 spectrum 1 weight 0.10000E+01 volume 0.26885E-03 ppm1 0.792 ppm2 7.405 CV 1
ASSI { 2043}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 48 and name HH2 ))
4.100 2.100 1.900 peak 2043 spectrum 1 weight 0.10000E+01 volume 0.34698E-02 ppm1 3.879 ppm2 6.501 CV 1
ASSI { 2047}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 31 and name HE% )
6.000 4.500 0.000 peak 2047 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.966 ppm2 6.876 CV 1
ASSI { 2048}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 49 and name HN ))
6.000 4.500 0.000 peak 2048 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.208 ppm2 6.878 CV 1
ASSI { 2049}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 48 and name HH2 ))
5.300 3.500 0.700 peak 2049 spectrum 1 weight 0.10000E+01 volume 0.33182E-03 ppm1 2.730 ppm2 6.509 CV 1
ASSI { 2051}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 37 and name HD22))
6.000 4.500 0.000 peak 2051 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.632 ppm2 6.891 CV 1
ASSI { 2052}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 49 and name HN ))
4.600 2.600 1.400 peak 2052 spectrum 1 weight 0.10000E+01 volume 0.12745E-02 ppm1 2.732 ppm2 6.882 CV 1
ASSI { 2053}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HD22))
6.000 4.500 0.000 peak 2053 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.920 ppm2 6.892 CV 1
ASSI { 2055}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 11 and name HD% )
3.000 1.100 1.100 peak 2055 spectrum 1 weight 0.10000E+01 volume 0.53784E-02 ppm1 3.911 ppm2 6.916 CV 1
ASSI { 2056}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HN ))
6.000 4.500 0.000 peak 2056 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.705 ppm2 6.687 CV 1
ASSI { 2057}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HN ))
6.000 4.500 0.000 peak 2057 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.887 ppm2 9.241 CV 1
ASSI { 2059}
(( segid " " and resid 13 and name HG3 ))
( segid " " and resid 11 and name HD% )
3.900 1.900 1.900 peak 2059 spectrum 1 weight 0.10000E+01 volume 0.29100E-02 ppm1 1.624 ppm2 6.918 CV 1
ASSI { 2062}
(( segid " " and resid 10 and name HG3 ))
( segid " " and resid 11 and name HD% )
3.800 1.800 1.800 peak 2062 spectrum 1 weight 0.10000E+01 volume 0.12593E-02 ppm1 2.144 ppm2 6.917 CV 1
ASSI { 2063}
(( segid " " and resid 31 and name HB3 ))
( segid " " and resid 31 and name HE% )
6.000 4.500 0.000 peak 2063 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.434 ppm2 6.878 CV 1
ASSI { 2064}
(( segid " " and resid 10 and name HG2 ))
( segid " " and resid 11 and name HD% )
6.000 5.900 0.000 peak 2064 spectrum 1 weight 0.10000E+01 volume 0.11300E-03 ppm1 2.271 ppm2 6.917 CV 1
ASSI { 2065}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 11 and name HN ))
6.000 4.500 0.000 peak 2065 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.827 ppm2 6.690 CV 1
OR { 2065}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 11 and name HN ))
ASSI { 2066}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 54 and name HN ))
6.000 4.500 0.000 peak 2066 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.014 ppm2 7.662 CV 1
ASSI { 2068}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 55 and name HN ))
6.000 4.500 0.000 peak 2068 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.014 ppm2 7.690 CV 1
ASSI { 2070}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HN ))
6.000 4.500 0.000 peak 2070 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.008 ppm2 7.665 CV 1
ASSI { 2071}
(( segid " " and resid 54 and name HB ))
(( segid " " and resid 54 and name HN ))
6.000 4.500 0.000 peak 2071 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.048 ppm2 7.665 CV 1
ASSI { 2072}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 55 and name HN ))
6.000 4.500 0.000 peak 2072 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.008 ppm2 7.688 CV 1
ASSI { 2073}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 8 and name HD2 ))
2.900 1.100 1.100 peak 2073 spectrum 1 weight 0.10000E+01 volume 0.85972E-02 ppm1 4.350 ppm2 7.503 CV 1
ASSI { 2074}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 32 and name HE1 ))
4.000 2.000 2.000 peak 2074 spectrum 1 weight 0.10000E+01 volume 0.21142E-02 ppm1 4.360 ppm2 7.461 CV 1
ASSI { 2078}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 8 and name HD2 ))
3.900 1.900 1.900 peak 2078 spectrum 1 weight 0.10000E+01 volume 0.22566E-02 ppm1 1.563 ppm2 7.504 CV 1
ASSI { 2079}
(( segid " " and resid 28 and name HD3 ))
(( segid " " and resid 28 and name HB3 ))
6.000 4.500 0.000 peak 2079 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.528 ppm2 1.909 CV 1
ASSI { 2080}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 28 and name HG3 ))
6.000 4.500 0.000 peak 2080 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.734 ppm2 1.784 CV 1
OR { 2080}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 2081}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 28 and name HB3 ))
6.000 4.500 0.000 peak 2081 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.736 ppm2 1.910 CV 1
ASSI { 2082}
(( segid " " and resid 28 and name HD2 ))
(( segid " " and resid 28 and name HB2 ))
6.000 4.500 0.000 peak 2082 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.736 ppm2 2.210 CV 1
ASSI { 2083}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 2083 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.728 ppm2 7.822 CV 1
OR { 2083}
(( segid " " and resid 61 and name HD3 ))
(( segid " " and resid 61 and name HN ))
ASSI { 2085}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HN ))
6.000 4.500 0.000 peak 2085 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.869 ppm2 8.456 CV 1
ASSI { 2086}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 13 and name HE ))
4.300 2.300 1.700 peak 2086 spectrum 1 weight 0.10000E+01 volume 0.50964E-03 ppm1 6.917 ppm2 8.637 CV 1
ASSI { 2087}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB2 ))
6.000 4.500 0.000 peak 2087 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.435 ppm2 4.311 CV 1
ASSI { 2088}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HD2 ))
6.000 4.500 0.000 peak 2088 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.754 ppm2 3.734 CV 1
OR { 2088}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HD3 ))
ASSI { 2089}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HD2 ))
6.000 4.500 0.000 peak 2089 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.408 ppm2 3.892 CV 1
ASSI { 2090}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB3 ))
6.000 4.500 0.000 peak 2090 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.431 ppm2 3.847 CV 1
ASSI { 2091}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB2 ))
6.000 4.500 0.000 peak 2091 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.410 ppm2 3.833 CV 1
ASSI { 2092}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HD2 ))
6.000 4.500 0.000 peak 2092 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.357 ppm2 3.719 CV 1
ASSI { 2093}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HD3 ))
6.000 4.500 0.000 peak 2093 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.386 ppm2 3.736 CV 1
OR { 2093}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HD2 ))
ASSI { 2094}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HD3 ))
6.000 4.500 0.000 peak 2094 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.403 ppm2 3.777 CV 1
ASSI { 2095}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HD2 ))
6.000 4.500 0.000 peak 2095 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.434 ppm2 3.780 CV 1
ASSI { 2097}
(( segid " " and resid 41 and name HD2 ))
(( segid " " and resid 41 and name HD3 ))
6.000 4.500 0.000 peak 2097 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.906 ppm2 3.780 CV 1
ASSI { 2098}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HD3 ))
6.000 4.500 0.000 peak 2098 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.795 ppm2 3.681 CV 1
ASSI { 2099}
(( segid " " and resid 38 and name HD2 ))
(( segid " " and resid 38 and name HD3 ))
6.000 4.500 0.000 peak 2099 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.807 ppm2 3.687 CV 1
ASSI { 2101}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB2 ))
6.000 4.500 0.000 peak 2101 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.886 ppm2 3.323 CV 1
ASSI { 2102}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HD2 ))
6.000 4.500 0.000 peak 2102 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.910 ppm2 3.277 CV 1
ASSI { 2103}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 8 and name HB2 ))
4.400 2.400 1.600 peak 2103 spectrum 1 weight 0.10000E+01 volume 0.23226E-02 ppm1 4.183 ppm2 3.276 CV 1
ASSI { 2104}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB2 ))
6.000 4.500 0.000 peak 2104 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.821 ppm2 3.454 CV 1
ASSI { 2105}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB2 ))
6.000 4.500 0.000 peak 2105 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.933 ppm2 3.388 CV 1
ASSI { 2106}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB2 ))
6.000 4.500 0.000 peak 2106 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.880 ppm2 3.309 CV 1
ASSI { 2108}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HB2 ))
6.000 4.500 0.000 peak 2108 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.476 ppm2 3.310 CV 1
ASSI { 2109}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HB3 ))
6.000 4.500 0.000 peak 2109 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.510 ppm2 3.319 CV 1
ASSI { 2110}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HB3 ))
6.000 4.500 0.000 peak 2110 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.280 ppm2 2.701 CV 1
ASSI { 2111}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HB3 ))
6.000 4.500 0.000 peak 2111 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.323 ppm2 2.783 CV 1
ASSI { 2112}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HB3 ))
6.000 4.500 0.000 peak 2112 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.277 ppm2 2.864 CV 1
ASSI { 2113}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HB3 ))
6.000 4.500 0.000 peak 2113 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.212 ppm2 2.948 CV 1
ASSI { 2114}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HB3 ))
6.000 4.500 0.000 peak 2114 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.464 ppm2 3.115 CV 1
ASSI { 2115}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HB3 ))
6.000 4.500 0.000 peak 2115 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.929 ppm2 2.609 CV 1
ASSI { 2116}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 53 and name HB3 ))
6.000 4.500 0.000 peak 2116 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.833 ppm2 2.619 CV 1
ASSI { 2117}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 53 and name HB3 ))
4.400 2.400 1.600 peak 2117 spectrum 1 weight 0.10000E+01 volume 0.28914E-02 ppm1 3.317 ppm2 2.616 CV 1
ASSI { 2118}
(( segid " " and resid 51 and name HD2 ))
(( segid " " and resid 51 and name HB2 ))
6.000 4.500 0.000 peak 2118 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.643 ppm2 2.448 CV 1
ASSI { 2119}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 14 and name HB ))
2.500 0.800 0.800 peak 2119 spectrum 1 weight 0.10000E+01 volume 0.68537E-02 ppm1 2.872 ppm2 2.283 CV 1
ASSI { 2120}
(( segid " " and resid 51 and name HD3 ))
(( segid " " and resid 51 and name HG2 ))
6.000 4.500 0.000 peak 2120 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.516 ppm2 2.070 CV 1
ASSI { 2121}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 44 and name HB2 ))
6.000 4.500 0.000 peak 2121 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.682 ppm2 2.311 CV 1
ASSI { 2122}
(( segid " " and resid 39 and name HD3 ))
(( segid " " and resid 39 and name HB2 ))
6.000 4.500 0.000 peak 2122 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.685 ppm2 2.302 CV 1
ASSI { 2123}
(( segid " " and resid 56 and name HD3 ))
(( segid " " and resid 56 and name HB2 ))
6.000 4.500 0.000 peak 2123 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.746 ppm2 2.299 CV 1
OR { 2123}
(( segid " " and resid 56 and name HD2 ))
(( segid " " and resid 56 and name HB2 ))
ASSI { 2124}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HB2 ))
6.000 4.500 0.000 peak 2124 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.799 ppm2 2.298 CV 1
ASSI { 2125}
(( segid " " and resid 41 and name HD3 ))
(( segid " " and resid 41 and name HB2 ))
6.000 4.500 0.000 peak 2125 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.796 ppm2 2.238 CV 1
ASSI { 2126}
(( segid " " and resid 39 and name HD3 ))
(( segid " " and resid 39 and name HG3 ))
6.000 4.500 0.000 peak 2126 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.682 ppm2 2.083 CV 1
OR { 2126}
(( segid " " and resid 39 and name HD3 ))
(( segid " " and resid 39 and name HG2 ))
ASSI { 2127}
(( segid " " and resid 38 and name HD3 ))
(( segid " " and resid 38 and name HG2 ))
6.000 4.500 0.000 peak 2127 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.701 ppm2 2.123 CV 1
ASSI { 2128}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HG2 ))
6.000 4.500 0.000 peak 2128 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.791 ppm2 2.083 CV 1
OR { 2128}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HG3 ))
ASSI { 2129}
(( segid " " and resid 38 and name HD2 ))
(( segid " " and resid 38 and name HG2 ))
6.000 4.500 0.000 peak 2129 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.804 ppm2 2.118 CV 1
ASSI { 2130}
(( segid " " and resid 41 and name HD2 ))
(( segid " " and resid 41 and name HG2 ))
6.000 4.500 0.000 peak 2130 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.908 ppm2 2.121 CV 1
ASSI { 2131}
(( segid " " and resid 41 and name HD2 ))
(( segid " " and resid 41 and name HB2 ))
6.000 4.500 0.000 peak 2131 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.906 ppm2 2.240 CV 1
ASSI { 2132}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB ))
6.000 4.500 0.000 peak 2132 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.008 ppm2 2.286 CV 1
ASSI { 2133}
(( segid " " and resid 41 and name HD3 ))
(( segid " " and resid 41 and name HG2 ))
6.000 4.500 0.000 peak 2133 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.792 ppm2 2.120 CV 1
ASSI { 2134}
(( segid " " and resid 51 and name HD2 ))
(( segid " " and resid 51 and name HG2 ))
6.000 4.500 0.000 peak 2134 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.643 ppm2 2.072 CV 1
ASSI { 2135}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB ))
6.000 4.500 0.000 peak 2135 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.887 ppm2 2.072 CV 1
ASSI { 2136}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB2 ))
6.000 4.500 0.000 peak 2136 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.911 ppm2 1.979 CV 1
ASSI { 2138}
(( segid " " and resid 38 and name HD3 ))
(( segid " " and resid 38 and name HB3 ))
6.000 4.500 0.000 peak 2138 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.701 ppm2 2.066 CV 1
ASSI { 2139}
(( segid " " and resid 38 and name HD3 ))
(( segid " " and resid 38 and name HG3 ))
6.000 4.500 0.000 peak 2139 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.703 ppm2 2.017 CV 1
ASSI { 2140}
(( segid " " and resid 39 and name HD3 ))
(( segid " " and resid 39 and name HB3 ))
6.000 4.500 0.000 peak 2140 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.685 ppm2 1.857 CV 1
ASSI { 2141}
(( segid " " and resid 56 and name HD3 ))
(( segid " " and resid 56 and name HB3 ))
6.000 4.500 0.000 peak 2141 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.750 ppm2 2.012 CV 1
OR { 2141}
(( segid " " and resid 56 and name HD2 ))
(( segid " " and resid 56 and name HB3 ))
ASSI { 2142}
(( segid " " and resid 56 and name HD3 ))
(( segid " " and resid 56 and name HG2 ))
6.000 4.500 0.000 peak 2142 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.751 ppm2 1.966 CV 1
OR { 2142}
(( segid " " and resid 56 and name HD2 ))
(( segid " " and resid 56 and name HG2 ))
ASSI { 2143}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HB3 ))
6.000 4.500 0.000 peak 2143 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.788 ppm2 1.857 CV 1
ASSI { 2144}
(( segid " " and resid 38 and name HD2 ))
(( segid " " and resid 38 and name HG3 ))
6.000 4.500 0.000 peak 2144 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.806 ppm2 2.019 CV 1
ASSI { 2145}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 44 and name HG2 ))
6.000 4.500 0.000 peak 2145 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.679 ppm2 1.831 CV 1
ASSI { 2146}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 44 and name HG3 ))
6.000 4.500 0.000 peak 2146 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.680 ppm2 1.808 CV 1
ASSI { 2147}
(( segid " " and resid 41 and name HD3 ))
(( segid " " and resid 40 and name HG ))
6.000 4.500 0.000 peak 2147 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.795 ppm2 1.745 CV 1
ASSI { 2148}
(( segid " " and resid 41 and name HD3 ))
(( segid " " and resid 41 and name HB3 ))
6.000 4.500 0.000 peak 2148 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.794 ppm2 1.841 CV 1
ASSI { 2149}
(( segid " " and resid 41 and name HD2 ))
(( segid " " and resid 41 and name HB3 ))
6.000 4.500 0.000 peak 2149 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.914 ppm2 1.839 CV 1
ASSI { 2150}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HB ))
6.000 4.500 0.000 peak 2150 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.918 ppm2 1.766 CV 1
ASSI { 2151}
(( segid " " and resid 56 and name HD2 ))
(( segid " " and resid 56 and name HG3 ))
6.000 4.500 0.000 peak 2151 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.750 ppm2 1.916 CV 1
OR { 2151}
(( segid " " and resid 56 and name HD3 ))
(( segid " " and resid 56 and name HG3 ))
ASSI { 2152}
(( segid " " and resid 51 and name HD2 ))
(( segid " " and resid 51 and name HG3 ))
6.000 4.500 0.000 peak 2152 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.641 ppm2 1.905 CV 1
ASSI { 2153}
(( segid " " and resid 1 and name HA2 ))
(( segid " " and resid 2 and name HG2 ))
6.000 4.500 0.000 peak 2153 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.018 ppm2 2.004 CV 1
OR { 2153}
(( segid " " and resid 1 and name HA1 ))
(( segid " " and resid 2 and name HG2 ))
ASSI { 2154}
(( segid " " and resid 1 and name HA2 ))
(( segid " " and resid 2 and name HB3 ))
6.000 4.500 0.000 peak 2154 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.018 ppm2 1.973 CV 1
OR { 2154}
(( segid " " and resid 1 and name HA1 ))
(( segid " " and resid 2 and name HB3 ))
ASSI { 2155}
(( segid " " and resid 1 and name HA2 ))
(( segid " " and resid 2 and name HG3 ))
6.000 4.500 0.000 peak 2155 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.018 ppm2 1.949 CV 1
OR { 2155}
(( segid " " and resid 1 and name HA1 ))
(( segid " " and resid 2 and name HG3 ))
ASSI { 2156}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HG2 ))
6.000 4.500 0.000 peak 2156 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.910 ppm2 1.694 CV 1
ASSI { 2157}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HG3 ))
6.000 4.500 0.000 peak 2157 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.910 ppm2 1.605 CV 1
ASSI { 2158}
(( segid " " and resid 41 and name HD2 ))
(( segid " " and resid 41 and name HG3 ))
6.000 4.500 0.000 peak 2158 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.907 ppm2 1.532 CV 1
ASSI { 2159}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HG13))
6.000 4.500 0.000 peak 2159 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.888 ppm2 1.275 CV 1
ASSI { 2160}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB3 ))
6.000 4.500 0.000 peak 2160 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.907 ppm2 1.364 CV 1
ASSI { 2161}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HG12))
6.000 4.500 0.000 peak 2161 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.888 ppm2 1.443 CV 1
ASSI { 2162}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HG12))
6.000 4.500 0.000 peak 2162 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.926 ppm2 1.580 CV 1
ASSI { 2163}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
6.000 4.500 0.000 peak 2163 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.337 ppm2 1.237 CV 1
ASSI { 2164}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HG ))
6.000 4.500 0.000 peak 2164 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.353 ppm2 1.236 CV 1
ASSI { 2165}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 57 and name HB% )
6.000 4.500 0.000 peak 2165 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.286 ppm2 1.378 CV 1
ASSI { 2166}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HG3 ))
6.000 4.500 0.000 peak 2166 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.301 ppm2 1.399 CV 1
OR { 2166}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 2167}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HG3 ))
6.000 4.500 0.000 peak 2167 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.176 ppm2 1.193 CV 1
ASSI { 2168}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 14 and name HG2%)
4.500 2.500 1.500 peak 2168 spectrum 1 weight 0.10000E+01 volume 0.19581E-02 ppm1 4.452 ppm2 1.119 CV 1
ASSI { 2170}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB2 ))
6.000 4.500 0.000 peak 2170 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.183 ppm2 1.457 CV 1
OR { 2170}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB3 ))
ASSI { 2171}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HD3 ))
6.000 4.500 0.000 peak 2171 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.176 ppm2 1.474 CV 1
ASSI { 2172}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HD2 ))
6.000 4.500 0.000 peak 2172 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.178 ppm2 1.619 CV 1
ASSI { 2173}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HD2 ))
6.000 4.500 0.000 peak 2173 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.301 ppm2 1.592 CV 1
OR { 2173}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HD3 ))
ASSI { 2174}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HB3 ))
6.000 4.500 0.000 peak 2174 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.340 ppm2 1.584 CV 1
ASSI { 2175}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HG ))
6.000 4.500 0.000 peak 2175 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.340 ppm2 1.603 CV 1
ASSI { 2176}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HG ))
6.000 4.500 0.000 peak 2176 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.367 ppm2 1.604 CV 1
ASSI { 2177}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HB2 ))
6.000 4.500 0.000 peak 2177 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.366 ppm2 1.638 CV 1
OR { 2177}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HB3 ))
ASSI { 2178}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HB2 ))
6.000 4.500 0.000 peak 2178 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.340 ppm2 1.676 CV 1
ASSI { 2179}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB3 ))
6.000 4.500 0.000 peak 2179 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.301 ppm2 1.670 CV 1
ASSI { 2180}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HG3 ))
6.000 4.500 0.000 peak 2180 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.413 ppm2 1.528 CV 1
ASSI { 2181}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB3 ))
6.000 4.500 0.000 peak 2181 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.174 ppm2 1.670 CV 1
ASSI { 2182}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB3 ))
6.000 4.500 0.000 peak 2182 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.186 ppm2 1.829 CV 1
ASSI { 2183}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HD2 ))
6.000 4.500 0.000 peak 2183 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.192 ppm2 1.695 CV 1
OR { 2183}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HD3 ))
ASSI { 2184}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HG ))
6.000 4.500 0.000 peak 2184 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.180 ppm2 1.719 CV 1
ASSI { 2185}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HB3 ))
6.000 4.500 0.000 peak 2185 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.191 ppm2 1.727 CV 1
ASSI { 2186}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HG2 ))
6.000 4.500 0.000 peak 2186 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.351 ppm2 1.783 CV 1
OR { 2186}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HG3 ))
ASSI { 2187}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB2 ))
6.000 4.500 0.000 peak 2187 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.402 ppm2 1.819 CV 1
OR { 2187}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB3 ))
ASSI { 2188}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB3 ))
6.000 4.500 0.000 peak 2188 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.403 ppm2 1.837 CV 1
ASSI { 2189}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB3 ))
6.000 4.500 0.000 peak 2189 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.171 ppm2 1.799 CV 1
ASSI { 2190}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB2 ))
6.000 4.500 0.000 peak 2190 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.186 ppm2 2.393 CV 1
ASSI { 2191}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HB2 ))
6.000 4.500 0.000 peak 2191 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.193 ppm2 1.825 CV 1
ASSI { 2192}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB2 ))
6.000 4.500 0.000 peak 2192 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.176 ppm2 1.859 CV 1
ASSI { 2193}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HG ))
6.000 4.500 0.000 peak 2193 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.836 ppm2 1.742 CV 1
ASSI { 2194}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HG ))
6.000 4.500 0.000 peak 2194 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.895 ppm2 1.573 CV 1
ASSI { 2195}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB3 ))
6.000 4.500 0.000 peak 2195 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.871 ppm2 1.548 CV 1
ASSI { 2196}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HB2 ))
6.000 4.500 0.000 peak 2196 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.835 ppm2 1.528 CV 1
ASSI { 2197}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HB3 ))
6.000 4.500 0.000 peak 2197 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.836 ppm2 1.445 CV 1
ASSI { 2198}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HB3 ))
6.000 4.500 0.000 peak 2198 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.193 ppm2 2.005 CV 1
ASSI { 2199}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HB2 ))
6.000 4.500 0.000 peak 2199 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.195 ppm2 2.083 CV 1
ASSI { 2200}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HG3 ))
6.000 4.500 0.000 peak 2200 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.195 ppm2 2.162 CV 1
ASSI { 2201}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB2 ))
6.000 4.500 0.000 peak 2201 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.171 ppm2 2.201 CV 1
ASSI { 2202}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HG2 ))
6.000 4.500 0.000 peak 2202 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.404 ppm2 2.123 CV 1
ASSI { 2203}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HG2 ))
6.000 4.500 0.000 peak 2203 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.433 ppm2 2.085 CV 1
OR { 2203}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HG3 ))
ASSI { 2204}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB3 ))
6.000 4.500 0.000 peak 2204 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.431 ppm2 1.857 CV 1
ASSI { 2207}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HG2 ))
6.000 4.500 0.000 peak 2207 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.403 ppm2 2.044 CV 1
ASSI { 2208}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HG3 ))
6.000 4.500 0.000 peak 2208 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.403 ppm2 2.005 CV 1
ASSI { 2209}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB3 ))
6.000 4.500 0.000 peak 2209 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.390 ppm2 2.013 CV 1
ASSI { 2210}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB2 ))
6.000 4.500 0.000 peak 2210 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.376 ppm2 1.976 CV 1
ASSI { 2211}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HG2 ))
6.000 4.500 0.000 peak 2211 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.389 ppm2 1.965 CV 1
ASSI { 2212}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB3 ))
6.000 4.500 0.000 peak 2212 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.474 ppm2 1.954 CV 1
ASSI { 2213}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HG3 ))
6.000 4.500 0.000 peak 2213 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.496 ppm2 1.950 CV 1
ASSI { 2214}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HB3 ))
6.000 4.500 0.000 peak 2214 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.496 ppm2 1.972 CV 1
ASSI { 2215}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HG2 ))
6.000 4.500 0.000 peak 2215 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.496 ppm2 2.006 CV 1
ASSI { 2216}
(( segid " " and resid 19 and name HA1 ))
(( segid " " and resid 20 and name HB3 ))
6.000 4.500 0.000 peak 2216 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.550 ppm2 2.003 CV 1
ASSI { 2217}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HG3 ))
6.000 4.500 0.000 peak 2217 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.391 ppm2 1.917 CV 1
ASSI { 2218}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB3 ))
6.000 4.500 0.000 peak 2218 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.359 ppm2 1.909 CV 1
ASSI { 2219}
(( segid " " and resid 19 and name HA1 ))
(( segid " " and resid 20 and name HB2 ))
6.000 4.500 0.000 peak 2219 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.552 ppm2 2.077 CV 1
ASSI { 2220}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HG2 ))
6.000 4.500 0.000 peak 2220 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.477 ppm2 1.831 CV 1
ASSI { 2221}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HG3 ))
6.000 4.500 0.000 peak 2221 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.476 ppm2 1.809 CV 1
ASSI { 2222}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB2 ))
6.000 4.500 0.000 peak 2222 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.358 ppm2 2.211 CV 1
ASSI { 2223}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HG2 ))
6.000 4.500 0.000 peak 2223 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.377 ppm2 2.227 CV 1
OR { 2223}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HG3 ))
ASSI { 2224}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB2 ))
6.000 4.500 0.000 peak 2224 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.408 ppm2 2.236 CV 1
ASSI { 2225}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB2 ))
6.000 4.500 0.000 peak 2225 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.389 ppm2 2.298 CV 1
ASSI { 2226}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB2 ))
6.000 4.500 0.000 peak 2226 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.437 ppm2 2.301 CV 1
ASSI { 2227}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB2 ))
6.000 4.500 0.000 peak 2227 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.479 ppm2 2.314 CV 1
ASSI { 2228}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HB2 ))
6.000 4.500 0.000 peak 2228 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.495 ppm2 2.311 CV 1
ASSI { 2230}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HB2 ))
6.000 4.500 0.000 peak 2230 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.778 ppm2 2.767 CV 1
OR { 2230}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HB3 ))
ASSI { 2231}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HB3 ))
6.000 4.500 0.000 peak 2231 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.728 ppm2 2.901 CV 1
ASSI { 2232}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB2 ))
6.000 4.500 0.000 peak 2232 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.748 ppm2 2.906 CV 1
OR { 2232}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB3 ))
ASSI { 2233}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB3 ))
6.000 4.500 0.000 peak 2233 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.881 ppm2 2.782 CV 1
ASSI { 2234}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
6.000 4.500 0.000 peak 2234 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.892 ppm2 2.791 CV 1
ASSI { 2235}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB3 ))
6.000 4.500 0.000 peak 2235 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.890 ppm2 2.724 CV 1
ASSI { 2236}
(( segid " " and resid 52 and name HD3 ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 2236 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.212 ppm2 1.775 CV 1
ASSI { 2237}
(( segid " " and resid 52 and name HD3 ))
(( segid " " and resid 52 and name HB3 ))
6.000 4.500 0.000 peak 2237 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.209 ppm2 1.827 CV 1
ASSI { 2238}
(( segid " " and resid 13 and name HD3 ))
(( segid " " and resid 13 and name HB2 ))
6.000 4.500 0.000 peak 2238 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.153 ppm2 1.978 CV 1
ASSI { 2239}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 44 and name HG3 ))
6.000 4.500 0.000 peak 2239 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.410 ppm2 1.809 CV 1
ASSI { 2240}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 44 and name HG2 ))
6.000 4.500 0.000 peak 2240 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.410 ppm2 1.832 CV 1
ASSI { 2241}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 44 and name HB3 ))
6.000 4.500 0.000 peak 2241 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.410 ppm2 1.951 CV 1
ASSI { 2242}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HG2 ))
6.000 4.500 0.000 peak 2242 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.342 ppm2 1.909 CV 1
ASSI { 2243}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 2243 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.344 ppm2 1.777 CV 1
ASSI { 2244}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HB3 ))
6.000 4.500 0.000 peak 2244 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.342 ppm2 1.825 CV 1
ASSI { 2245}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HD2 ))
6.000 4.500 0.000 peak 2245 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.972 ppm2 1.621 CV 1
OR { 2245}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HD2 ))
ASSI { 2246}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HB3 ))
6.000 4.500 0.000 peak 2246 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.980 ppm2 1.798 CV 1
OR { 2246}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HB3 ))
ASSI { 2247}
(( segid " " and resid 13 and name HD2 ))
(( segid " " and resid 13 and name HB2 ))
6.000 4.500 0.000 peak 2247 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.290 ppm2 1.979 CV 1
ASSI { 2248}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HG2 ))
6.000 4.500 0.000 peak 2248 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.457 ppm2 2.069 CV 1
ASSI { 2249}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HB3 ))
6.000 4.500 0.000 peak 2249 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.333 ppm2 1.949 CV 1
ASSI { 2250}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HG2 ))
6.000 4.500 0.000 peak 2250 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.335 ppm2 1.827 CV 1
ASSI { 2251}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HG3 ))
6.000 4.500 0.000 peak 2251 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.335 ppm2 1.814 CV 1
ASSI { 2252}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HG3 ))
6.000 4.500 0.000 peak 2252 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.457 ppm2 1.901 CV 1
ASSI { 2253}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HB3 ))
6.000 4.500 0.000 peak 2253 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.457 ppm2 1.954 CV 1
ASSI { 2254}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HB3 ))
6.000 4.500 0.000 peak 2254 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.457 ppm2 2.064 CV 1
ASSI { 2257}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HB2 ))
6.000 4.500 0.000 peak 2257 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.274 ppm2 1.815 CV 1
OR { 2257}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HB3 ))
ASSI { 2258}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HG3 ))
6.000 4.500 0.000 peak 2258 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.276 ppm2 2.126 CV 1
ASSI { 2259}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HG2 ))
6.000 4.500 0.000 peak 2259 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.225 ppm2 1.783 CV 1
OR { 2259}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HG3 ))
ASSI { 2260}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HB3 ))
6.000 4.500 0.000 peak 2260 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.888 ppm2 1.675 CV 1
ASSI { 2261}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 33 and name HG12))
6.000 4.500 0.000 peak 2261 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.085 ppm2 1.445 CV 1
ASSI { 2262}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HD3 ))
6.000 4.500 0.000 peak 2262 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.206 ppm2 1.474 CV 1
ASSI { 2263}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HB3 ))
6.000 4.500 0.000 peak 2263 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.241 ppm2 1.552 CV 1
ASSI { 2264}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HG3 ))
6.000 4.500 0.000 peak 2264 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.251 ppm2 1.544 CV 1
ASSI { 2265}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HG2 ))
6.000 4.500 0.000 peak 2265 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.813 ppm2 1.303 CV 1
ASSI { 2266}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HB3 ))
6.000 4.500 0.000 peak 2266 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.697 ppm2 1.367 CV 1
ASSI { 2267}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 40 and name HD2%)
2.300 0.700 0.700 peak 2267 spectrum 1 weight 0.10000E+01 volume 0.21617E-01 ppm1 1.759 ppm2 0.698 CV 1
ASSI { 2268}
(( segid " " and resid 44 and name HG2 ))
( segid " " and resid 40 and name HD2%)
6.000 4.500 0.000 peak 2268 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.845 ppm2 0.696 CV 1
ASSI { 2269}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 40 and name HD1%)
6.000 4.500 0.000 peak 2269 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.759 ppm2 0.916 CV 1
ASSI { 2270}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 43 and name HG2%)
6.000 4.500 0.000 peak 2270 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.784 ppm2 0.900 CV 1
ASSI { 2271}
(( segid " " and resid 49 and name HG ))
(( segid " " and resid 49 and name HB2 ))
6.000 4.500 0.000 peak 2271 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.587 ppm2 1.170 CV 1
ASSI { 2272}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HG2 ))
6.000 4.500 0.000 peak 2272 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.630 ppm2 1.305 CV 1
ASSI { 2273}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HG3 ))
6.000 4.500 0.000 peak 2273 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.630 ppm2 1.193 CV 1
ASSI { 2274}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HB3 ))
6.000 4.500 0.000 peak 2274 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.249 ppm2 0.777 CV 1
ASSI { 2275}
(( segid " " and resid 33 and name HG13))
( segid " " and resid 33 and name HG2%)
6.000 4.500 0.000 peak 2275 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.288 ppm2 0.776 CV 1
ASSI { 2276}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 21 and name HB3 ))
6.000 4.500 0.000 peak 2276 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.257 ppm2 0.897 CV 1
ASSI { 2277}
(( segid " " and resid 43 and name HG13))
( segid " " and resid 43 and name HD1%)
6.000 4.500 0.000 peak 2277 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.078 ppm2 0.774 CV 1
ASSI { 2278}
(( segid " " and resid 33 and name HG12))
( segid " " and resid 33 and name HG2%)
6.000 4.500 0.000 peak 2278 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.465 ppm2 0.777 CV 1
ASSI { 2279}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 40 and name HD1%)
6.000 4.500 0.000 peak 2279 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.460 ppm2 0.921 CV 1
ASSI { 2280}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HB3 ))
6.000 4.500 0.000 peak 2280 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.452 ppm2 0.905 CV 1
ASSI { 2281}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HG2 ))
6.000 4.500 0.000 peak 2281 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.496 ppm2 1.302 CV 1
ASSI { 2282}
(( segid " " and resid 33 and name HG12))
(( segid " " and resid 33 and name HG13))
6.000 4.500 0.000 peak 2282 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.467 ppm2 1.281 CV 1
ASSI { 2283}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HG ))
6.000 4.500 0.000 peak 2283 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.454 ppm2 1.243 CV 1
ASSI { 2284}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HG3 ))
6.000 4.500 0.000 peak 2284 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.491 ppm2 1.192 CV 1
ASSI { 2285}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HG3 ))
6.000 4.500 0.000 peak 2285 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.317 ppm2 1.192 CV 1
ASSI { 2286}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HG ))
6.000 4.500 0.000 peak 2286 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.792 ppm2 0.586 CV 1
ASSI { 2287}
( segid " " and resid 33 and name HG2%)
( segid " " and resid 33 and name HD1%)
6.000 4.500 0.000 peak 2287 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.794 ppm2 0.629 CV 1
ASSI { 2288}
(( segid " " and resid 36 and name HB2 ))
( segid " " and resid 36 and name HD2%)
6.000 4.500 0.000 peak 2288 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.471 ppm2 0.543 CV 1
OR { 2288}
(( segid " " and resid 36 and name HB3 ))
( segid " " and resid 36 and name HD2%)
ASSI { 2289}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HG2 ))
6.000 4.500 0.000 peak 2289 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.976 ppm2 1.303 CV 1
OR { 2289}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HG2 ))
ASSI { 2290}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HD3 ))
6.000 4.500 0.000 peak 2290 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.976 ppm2 1.477 CV 1
OR { 2290}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HD3 ))
ASSI { 2291}
(( segid " " and resid 16 and name HE2 ))
(( segid " " and resid 16 and name HG3 ))
6.000 4.500 0.000 peak 2291 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.978 ppm2 1.190 CV 1
OR { 2291}
(( segid " " and resid 16 and name HE3 ))
(( segid " " and resid 16 and name HG3 ))
ASSI { 2294}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 43 and name HG2%)
6.000 4.500 0.000 peak 2294 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.909 ppm2 0.913 CV 1
ASSI { 2296}
(( segid " " and resid 58 and name HA ))
( segid " " and resid 58 and name HD2%)
6.000 4.500 0.000 peak 2296 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.334 ppm2 0.860 CV 1
ASSI { 2297}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 49 and name HD2%)
6.000 4.500 0.000 peak 2297 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.897 ppm2 0.736 CV 1
ASSI { 2298}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 49 and name HD1%)
6.000 4.500 0.000 peak 2298 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.895 ppm2 0.811 CV 1
ASSI { 2299}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB3 ))
6.000 4.500 0.000 peak 2299 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.899 ppm2 0.875 CV 1
ASSI { 2300}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB2 ))
6.000 4.500 0.000 peak 2300 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.899 ppm2 1.163 CV 1
ASSI { 2301}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 14 and name HG2%)
6.000 4.500 0.000 peak 2301 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.928 ppm2 1.120 CV 1
ASSI { 2302}
( segid " " and resid 43 and name HG2%)
( segid " " and resid 33 and name HD1%)
4.800 2.900 1.200 peak 2302 spectrum 1 weight 0.10000E+01 volume 0.42539E-03 ppm1 0.913 ppm2 0.631 CV 1
ASSI { 2304}
( segid " " and resid 26 and name HG2%)
( segid " " and resid 49 and name HD1%)
2.800 1.000 1.000 peak 2304 spectrum 1 weight 0.10000E+01 volume 0.17205E-01 ppm1 1.062 ppm2 0.808 CV 1
ASSI { 2305}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 49 and name HD1%)
6.000 4.500 0.000 peak 2305 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.183 ppm2 0.810 CV 1
ASSI { 2306}
( segid " " and resid 40 and name HD1%)
( segid " " and resid 36 and name HD2%)
5.300 3.600 0.700 peak 2306 spectrum 1 weight 0.10000E+01 volume 0.36074E-03 ppm1 0.943 ppm2 0.540 CV 1
ASSI { 2307}
(( segid " " and resid 43 and name HG12))
( segid " " and resid 43 and name HG2%)
6.000 4.500 0.000 peak 2307 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.594 ppm2 0.892 CV 1
ASSI { 2308}
(( segid " " and resid 49 and name HG ))
(( segid " " and resid 49 and name HB3 ))
6.000 4.500 0.000 peak 2308 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.588 ppm2 0.876 CV 1
ASSI { 2309}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 40 and name HD1%)
6.000 4.500 0.000 peak 2309 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.534 ppm2 0.916 CV 1
ASSI { 2310}
(( segid " " and resid 49 and name HG ))
( segid " " and resid 49 and name HD1%)
6.000 4.500 0.000 peak 2310 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.589 ppm2 0.815 CV 1
ASSI { 2311}
(( segid " " and resid 43 and name HG12))
( segid " " and resid 43 and name HD1%)
6.000 4.500 0.000 peak 2311 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.594 ppm2 0.780 CV 1
ASSI { 2312}
(( segid " " and resid 49 and name HG ))
( segid " " and resid 49 and name HD2%)
6.000 4.500 0.000 peak 2312 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.587 ppm2 0.736 CV 1
ASSI { 2314}
(( segid " " and resid 51 and name HG3 ))
( segid " " and resid 36 and name HD2%)
2.900 1.100 1.100 peak 2314 spectrum 1 weight 0.10000E+01 volume 0.12552E-01 ppm1 1.932 ppm2 0.544 CV 1
ASSI { 2316}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 22 and name HD1%)
4.400 2.400 1.600 peak 2316 spectrum 1 weight 0.10000E+01 volume 0.12291E-02 ppm1 1.778 ppm2 0.371 CV 1
ASSI { 2317}
(( segid " " and resid 44 and name HG3 ))
( segid " " and resid 22 and name HD2%)
4.300 2.300 1.700 peak 2317 spectrum 1 weight 0.10000E+01 volume 0.15482E-02 ppm1 1.827 ppm2 -0.633 CV 1
OR { 2317}
(( segid " " and resid 44 and name HG2 ))
( segid " " and resid 22 and name HD2%)
ASSI { 2318}
(( segid " " and resid 44 and name HG3 ))
( segid " " and resid 22 and name HD1%)
6.000 4.500 0.000 peak 2318 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.827 ppm2 0.371 CV 1
OR { 2318}
(( segid " " and resid 44 and name HG2 ))
( segid " " and resid 22 and name HD1%)
ASSI { 2319}
(( segid " " and resid 33 and name HB ))
( segid " " and resid 22 and name HD1%)
6.000 6.000 0.000 peak 2319 spectrum 1 weight 0.10000E+01 volume 0.11692E-03 ppm1 2.096 ppm2 0.371 CV 1
ASSI { 2320}
(( segid " " and resid 18 and name HA1 ))
( segid " " and resid 21 and name HD2%)
4.300 2.300 1.700 peak 2320 spectrum 1 weight 0.10000E+01 volume 0.16844E-02 ppm1 4.511 ppm2 -0.151 CV 1
ASSI { 2321}
(( segid " " and resid 30 and name HA ))
( segid " " and resid 21 and name HD1%)
5.600 4.000 0.400 peak 2321 spectrum 1 weight 0.10000E+01 volume 0.69500E-03 ppm1 5.729 ppm2 0.405 CV 1
ASSI { 2322}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
6.000 4.500 0.000 peak 2322 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.729 ppm2 3.494 CV 1
ASSI { 2323}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HN ))
6.000 4.500 0.000 peak 2323 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.510 ppm2 7.580 CV 1
ASSI { 2324}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 49 and name HD2%)
4.500 2.600 1.500 peak 2324 spectrum 1 weight 0.10000E+01 volume 0.12291E-02 ppm1 2.745 ppm2 0.733 CV 1
ASSI { 2325}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 49 and name HD2%)
3.200 1.300 1.300 peak 2325 spectrum 1 weight 0.10000E+01 volume 0.31748E-02 ppm1 2.817 ppm2 0.735 CV 1
ASSI { 2327}
(( segid " " and resid 35 and name HB3 ))
( segid " " and resid 14 and name HG2%)
3.100 1.200 1.200 peak 2327 spectrum 1 weight 0.10000E+01 volume 0.58461E-02 ppm1 2.879 ppm2 1.120 CV 1
ASSI { 2328}
(( segid " " and resid 13 and name HD2 ))
( segid " " and resid 14 and name HG2%)
6.000 4.500 0.000 peak 2328 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.283 ppm2 1.120 CV 1
ASSI { 2329}
(( segid " " and resid 15 and name HB2 ))
( segid " " and resid 14 and name HG2%)
4.700 2.700 1.300 peak 2329 spectrum 1 weight 0.10000E+01 volume 0.27174E-02 ppm1 3.395 ppm2 1.119 CV 1
ASSI { 2330}
(( segid " " and resid 44 and name HG3 ))
( segid " " and resid 40 and name HD2%)
6.000 4.500 0.000 peak 2330 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.826 ppm2 0.696 CV 1
ASSI { 2331}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 54 and name HG2%)
3.400 1.400 1.400 peak 2331 spectrum 1 weight 0.10000E+01 volume 0.61419E-02 ppm1 1.189 ppm2 0.996 CV 1
ASSI { 2332}
(( segid " " and resid 47 and name HG3 ))
( segid " " and resid 49 and name HD1%)
4.900 3.000 1.100 peak 2332 spectrum 1 weight 0.10000E+01 volume 0.74211E-03 ppm1 2.240 ppm2 0.807 CV 1
OR { 2332}
(( segid " " and resid 47 and name HG2 ))
( segid " " and resid 49 and name HD1%)
ASSI { 2335}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 33 and name HD1%)
6.000 4.500 0.000 peak 2335 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.767 ppm2 0.628 CV 1
ASSI { 2339}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 26 and name HG2%)
4.000 2.000 2.000 peak 2339 spectrum 1 weight 0.10000E+01 volume 0.53269E-02 ppm1 2.737 ppm2 1.049 CV 1
ASSI { 2341}
(( segid " " and resid 58 and name HA ))
( segid " " and resid 58 and name HD1%)
6.000 4.500 0.000 peak 2341 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.335 ppm2 0.920 CV 1
ASSI { 2342}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB3 ))
6.000 4.500 0.000 peak 2342 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.353 ppm2 0.891 CV 1
ASSI { 2343}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 3 and name HD1%)
6.000 4.500 0.000 peak 2343 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.368 ppm2 0.883 CV 1
ASSI { 2344}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 3 and name HD2%)
6.000 4.500 0.000 peak 2344 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.365 ppm2 0.845 CV 1
ASSI { 2345}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 36 and name HB3 ))
6.000 4.500 0.000 peak 2345 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.925 ppm2 1.464 CV 1
OR { 2345}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 36 and name HB2 ))
ASSI { 2346}
(( segid " " and resid 35 and name HB3 ))
( segid " " and resid 14 and name HG1%)
3.100 1.200 1.200 peak 2346 spectrum 1 weight 0.10000E+01 volume 0.64411E-02 ppm1 2.882 ppm2 1.298 CV 1
ASSI { 2347}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HG ))
6.000 4.500 0.000 peak 2347 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.433 ppm2 1.713 CV 1
ASSI { 2348}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HB2 ))
6.000 4.500 0.000 peak 2348 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.437 ppm2 1.450 CV 1
OR { 2348}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HB3 ))
ASSI { 2352}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 49 and name HB2 ))
4.000 2.000 2.000 peak 2352 spectrum 1 weight 0.10000E+01 volume 0.20506E-02 ppm1 4.013 ppm2 1.171 CV 1
ASSI { 2355}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 37 and name HB3 ))
6.000 4.500 0.000 peak 2355 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.097 ppm2 2.612 CV 1
ASSI { 2356}
(( segid " " and resid 18 and name HA1 ))
( segid " " and resid 21 and name HD1%)
6.000 4.500 0.000 peak 2356 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.510 ppm2 0.407 CV 1
ASSI { 2359}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HE ))
6.000 4.500 0.000 peak 2359 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.914 ppm2 8.638 CV 1
ASSI { 2360}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HB3 ))
6.000 4.500 0.000 peak 2360 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.462 ppm2 2.421 CV 1
ASSI { 2361}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HB3 ))
6.000 4.500 0.000 peak 2361 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.308 ppm2 2.421 CV 1
ASSI { 2362}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 2362 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.437 ppm2 9.092 CV 1
ASSI { 2364}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 30 and name HA ))
4.800 2.900 1.200 peak 2364 spectrum 1 weight 0.10000E+01 volume 0.52925E-03 ppm1 0.914 ppm2 5.724 CV 1
ASSI { 2368}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 32 and name HD2 ))
6.000 5.500 0.000 peak 2368 spectrum 1 weight 0.10000E+01 volume 0.12160E-03 ppm1 -0.132 ppm2 7.627 CV 1
ASSI { 2369}
(( segid " " and resid 33 and name HG12))
(( segid " " and resid 32 and name HD2 ))
6.000 4.600 0.000 peak 2369 spectrum 1 weight 0.10000E+01 volume 0.14767E-03 ppm1 1.460 ppm2 7.628 CV 1
ASSI { 2370}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 48 and name HZ3 ))
6.000 4.700 0.000 peak 2370 spectrum 1 weight 0.10000E+01 volume 0.26768E-03 ppm1 1.252 ppm2 6.640 CV 1
ASSI { 2371}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 42 and name HN ))
3.300 1.400 1.400 peak 2371 spectrum 1 weight 0.10000E+01 volume 0.39616E-02 ppm1 1.446 ppm2 6.983 CV 1
ASSI { 2372}
(( segid " " and resid 52 and name HG3 ))
(( segid " " and resid 53 and name HN ))
4.300 2.300 1.700 peak 2372 spectrum 1 weight 0.10000E+01 volume 0.10248E-02 ppm1 1.797 ppm2 8.002 CV 1
ASSI { 2374}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 57 and name HN ))
5.500 3.800 0.500 peak 2374 spectrum 1 weight 0.10000E+01 volume 0.52753E-03 ppm1 2.017 ppm2 8.231 CV 1
ASSI { 2375}
(( segid " " and resid 28 and name HD3 ))
(( segid " " and resid 27 and name HN ))
5.900 4.300 0.100 peak 2375 spectrum 1 weight 0.10000E+01 volume 0.26328E-03 ppm1 3.528 ppm2 8.226 CV 1
ASSI { 2378}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 29 and name HN ))
6.000 4.900 0.000 peak 2378 spectrum 1 weight 0.10000E+01 volume 0.35352E-03 ppm1 2.222 ppm2 9.335 CV 1
ASSI { 2380}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 31 and name HN ))
4.500 2.500 1.500 peak 2380 spectrum 1 weight 0.10000E+01 volume 0.21889E-03 ppm1 6.893 ppm2 9.197 CV 1
ASSI { 2381}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 31 and name HD% )
6.000 5.400 0.000 peak 2381 spectrum 1 weight 0.10000E+01 volume 0.18680E-03 ppm1 4.009 ppm2 7.106 CV 1
ASSI { 2382}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 48 and name HH2 ))
6.000 6.000 0.000 peak 2382 spectrum 1 weight 0.10000E+01 volume 0.24564E-03 ppm1 5.532 ppm2 6.500 CV 1
ASSI { 2383}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 49 and name HN ))
5.500 3.800 0.500 peak 2383 spectrum 1 weight 0.10000E+01 volume 0.34664E-03 ppm1 4.686 ppm2 6.876 CV 1
ASSI { 2384}
(( segid " " and resid 11 and name HA ))
( segid " " and resid 11 and name HD% )
3.800 1.800 1.800 peak 2384 spectrum 1 weight 0.10000E+01 volume 0.50964E-02 ppm1 4.461 ppm2 6.918 CV 1
ASSI { 2386}
(( segid " " and resid 14 and name HB ))
( segid " " and resid 31 and name HE% )
6.000 4.600 0.000 peak 2386 spectrum 1 weight 0.10000E+01 volume 0.26645E-03 ppm1 2.301 ppm2 6.879 CV 1
ASSI { 2387}
( segid " " and resid 14 and name HG2%)
(( segid " " and resid 16 and name HN ))
6.000 4.900 0.000 peak 2387 spectrum 1 weight 0.10000E+01 volume 0.38241E-03 ppm1 1.131 ppm2 8.148 CV 1
ASSI { 2388}
( segid " " and resid 14 and name HG2%)
( segid " " and resid 31 and name HE% )
6.000 4.500 0.000 peak 2388 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.133 ppm2 6.879 CV 1
ASSI { 2391}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 7 and name HD2 ))
5.100 3.300 0.900 peak 2391 spectrum 1 weight 0.10000E+01 volume 0.60490E-03 ppm1 2.638 ppm2 7.021 CV 1
OR { 2391}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 7 and name HD2 ))
ASSI { 2393}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 29 and name HN ))
4.800 2.900 1.200 peak 2393 spectrum 1 weight 0.10000E+01 volume 0.14406E-03 ppm1 7.125 ppm2 9.337 CV 1
ASSI { 2394}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 48 and name HE1 ))
6.000 6.000 0.000 peak 2394 spectrum 1 weight 0.10000E+01 volume 0.15021E-03 ppm1 1.454 ppm2 9.822 CV 1
ASSI { 2395}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 14 and name HN ))
5.700 4.000 0.300 peak 2395 spectrum 1 weight 0.10000E+01 volume 0.59665E-03 ppm1 4.923 ppm2 8.835 CV 1
ASSI { 2396}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 32 and name HN ))
5.900 4.400 0.100 peak 2396 spectrum 1 weight 0.10000E+01 volume 0.27841E-03 ppm1 6.509 ppm2 8.677 CV 1
ASSI { 2397}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 23 and name HN ))
6.000 4.600 0.000 peak 2397 spectrum 1 weight 0.10000E+01 volume 0.17621E-03 ppm1 5.731 ppm2 8.447 CV 1
ASSI { 2398}
(( segid " " and resid 48 and name HE3 ))
(( segid " " and resid 23 and name HN ))
5.300 3.500 0.700 peak 2398 spectrum 1 weight 0.10000E+01 volume 0.27325E-03 ppm1 7.297 ppm2 8.451 CV 1
ASSI { 2399}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 18 and name HN ))
3.800 1.800 1.800 peak 2399 spectrum 1 weight 0.10000E+01 volume 0.64789E-03 ppm1 0.424 ppm2 8.594 CV 1
ASSI { 2400}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 18 and name HN ))
4.300 2.300 1.700 peak 2400 spectrum 1 weight 0.10000E+01 volume 0.29602E-03 ppm1 -0.129 ppm2 8.595 CV 1
ASSI { 2401}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 40 and name HN ))
4.200 2.200 1.800 peak 2401 spectrum 1 weight 0.10000E+01 volume 0.35386E-03 ppm1 6.997 ppm2 7.531 CV 1
ASSI { 2402}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 55 and name HB3 ))
4.900 3.000 1.100 peak 2402 spectrum 1 weight 0.10000E+01 volume 0.12170E-02 ppm1 4.007 ppm2 2.904 CV 1
OR { 2402}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 55 and name HB2 ))
ASSI { 2405}
(( segid " " and resid 28 and name HD3 ))
(( segid " " and resid 27 and name HB2 ))
3.800 1.800 1.800 peak 2405 spectrum 1 weight 0.10000E+01 volume 0.45222E-02 ppm1 3.527 ppm2 3.259 CV 1
ASSI { 2406}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 50 and name HA ))
5.800 4.200 0.200 peak 2406 spectrum 1 weight 0.10000E+01 volume 0.36555E-03 ppm1 3.878 ppm2 3.458 CV 1
ASSI { 2408}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 12 and name HB3 ))
6.000 4.500 0.000 peak 2408 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.535 ppm2 1.819 CV 1
ASSI { 2409}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 49 and name HB2 ))
6.000 5.100 0.000 peak 2409 spectrum 1 weight 0.10000E+01 volume 0.59837E-03 ppm1 4.533 ppm2 1.171 CV 1
ASSI { 2410}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 47 and name HB3 ))
4.200 2.300 1.800 peak 2410 spectrum 1 weight 0.10000E+01 volume 0.64204E-03 ppm1 4.535 ppm2 1.881 CV 1
ASSI { 2412}
(( segid " " and resid 52 and name HD3 ))
(( segid " " and resid 52 and name HB2 ))
6.000 4.500 0.000 peak 2412 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.209 ppm2 2.388 CV 1
ASSI { 2413}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HB2 ))
6.000 4.500 0.000 peak 2413 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.342 ppm2 2.391 CV 1
ASSI { 2414}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG2 ))
6.000 4.500 0.000 peak 2414 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.186 ppm2 1.920 CV 1
ASSI { 2415}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG3 ))
6.000 4.500 0.000 peak 2415 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.186 ppm2 1.775 CV 1
ASSI { 2416}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HG2 ))
6.000 4.500 0.000 peak 2416 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.413 ppm2 1.909 CV 1
ASSI { 2417}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HB3 ))
6.000 4.500 0.000 peak 2417 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.414 ppm2 1.827 CV 1
ASSI { 2418}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HD3 ))
6.000 4.500 0.000 peak 2418 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.360 ppm2 3.189 CV 1
ASSI { 2419}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 44 and name HG3 ))
3.600 1.600 1.600 peak 2419 spectrum 1 weight 0.10000E+01 volume 0.26706E-02 ppm1 2.966 ppm2 1.827 CV 1
OR { 2419}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 44 and name HG2 ))
ASSI { 2420}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 14 and name HG1%)
5.700 4.000 0.300 peak 2420 spectrum 1 weight 0.10000E+01 volume 0.63001E-03 ppm1 5.541 ppm2 1.298 CV 1
ASSI { 2421}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 14 and name HG1%)
4.400 2.400 1.600 peak 2421 spectrum 1 weight 0.10000E+01 volume 0.10716E-02 ppm1 4.447 ppm2 1.297 CV 1
ASSI { 2422}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 2422 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.890 ppm2 9.100 CV 1
ASSI { 2423}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 9 and name HN ))
6.000 4.500 0.000 peak 2423 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.671 ppm2 8.829 CV 1
ASSI { 2424}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
6.000 4.500 0.000 peak 2424 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.868 ppm2 8.598 CV 1
ASSI { 2425}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 8 and name HD2 ))
5.100 3.200 0.900 peak 2425 spectrum 1 weight 0.10000E+01 volume 0.31889E-03 ppm1 4.863 ppm2 7.504 CV 1
ASSI { 2426}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 40 and name HD1%)
6.000 4.500 0.000 peak 2426 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.829 ppm2 0.918 CV 1
ASSI { 2427}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HG13))
6.000 5.700 0.000 peak 2427 spectrum 1 weight 0.10000E+01 volume 0.25438E-03 ppm1 4.412 ppm2 1.069 CV 1
ASSI { 2428}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 47 and name HB3 ))
5.300 3.500 0.700 peak 2428 spectrum 1 weight 0.10000E+01 volume 0.65442E-03 ppm1 2.802 ppm2 1.889 CV 1
ASSI { 2433}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 16 and name HG2 ))
4.500 2.500 1.500 peak 2433 spectrum 1 weight 0.10000E+01 volume 0.63069E-03 ppm1 3.891 ppm2 1.298 CV 1
ASSI { 2435}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 47 and name HG3 ))
4.200 2.200 1.800 peak 2435 spectrum 1 weight 0.10000E+01 volume 0.33206E-03 ppm1 4.533 ppm2 2.224 CV 1
OR { 2435}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 47 and name HG2 ))
ASSI { 2438}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
4.900 2.900 1.100 peak 2438 spectrum 1 weight 0.10000E+01 volume 0.64617E-03 ppm1 8.132 ppm2 8.392 CV 1
ASSI { 2439}
(( segid " " and resid 61 and name HD3 ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 2439 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.723 ppm2 7.824 CV 1
OR { 2439}
(( segid " " and resid 61 and name HD2 ))
(( segid " " and resid 61 and name HN ))
ASSI { 2440}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 2440 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.756 ppm2 7.823 CV 1
ASSI { 2441}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 2441 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.852 ppm2 7.824 CV 1
ASSI { 2445}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 12 and name HG ))
6.000 5.200 0.000 peak 2445 spectrum 1 weight 0.10000E+01 volume 0.32601E-03 ppm1 0.424 ppm2 7.386 CV 1
ASSI { 2446}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 48 and name HH2 ))
6.000 4.700 0.000 peak 2446 spectrum 1 weight 0.10000E+01 volume 0.10578E-03 ppm1 0.392 ppm2 6.504 CV 1
ASSI { 2447}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 25 and name HN ))
6.000 5.400 0.000 peak 2447 spectrum 1 weight 0.10000E+01 volume 0.11761E-03 ppm1 6.884 ppm2 9.242 CV 1
ASSI { 2448}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 22 and name HN ))
5.400 3.700 0.600 peak 2448 spectrum 1 weight 0.10000E+01 volume 0.70360E-03 ppm1 3.510 ppm2 9.031 CV 1
ASSI { 2449}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 22 and name HN ))
5.200 3.400 0.800 peak 2449 spectrum 1 weight 0.10000E+01 volume 0.37518E-03 ppm1 3.341 ppm2 9.032 CV 1
ASSI { 2452}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 2452 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.943 ppm2 8.074 CV 1
ASSI { 2453}
( segid " " and resid 58 and name HD2%)
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 2453 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.879 ppm2 8.074 CV 1
ASSI { 2455}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 32 and name HE1 ))
6.000 6.000 0.000 peak 2455 spectrum 1 weight 0.10000E+01 volume 0.81846E-04 ppm1 3.888 ppm2 7.461 CV 1
ASSI { 2456}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 48 and name HZ3 ))
4.700 2.800 1.300 peak 2456 spectrum 1 weight 0.10000E+01 volume 0.30898E-03 ppm1 0.792 ppm2 6.641 CV 1
ASSI { 2457}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 11 and name HN ))
5.000 3.200 1.000 peak 2457 spectrum 1 weight 0.10000E+01 volume 0.11434E-03 ppm1 3.903 ppm2 6.686 CV 1
ASSI { 2459}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 34 and name HD2 ))
6.000 5.500 0.000 peak 2459 spectrum 1 weight 0.10000E+01 volume 0.26122E-03 ppm1 0.646 ppm2 7.175 CV 1
ASSI { 2460}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 34 and name HD2 ))
6.000 6.000 0.000 peak 2460 spectrum 1 weight 0.10000E+01 volume 0.64651E-04 ppm1 0.785 ppm2 7.175 CV 1
ASSI { 2461}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 34 and name HD2 ))
6.000 4.500 0.000 peak 2461 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.316 ppm2 7.175 CV 1
ASSI { 2462}
(( segid " " and resid 10 and name HG3 ))
( segid " " and resid 11 and name HE% )
5.300 3.500 0.700 peak 2462 spectrum 1 weight 0.10000E+01 volume 0.26872E-03 ppm1 2.148 ppm2 7.283 CV 1
ASSI { 2463}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 11 and name HE% )
6.000 5.700 0.000 peak 2463 spectrum 1 weight 0.10000E+01 volume 0.17999E-03 ppm1 2.224 ppm2 7.284 CV 1
ASSI { 2465}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 48 and name HD1 ))
5.500 3.800 0.500 peak 2465 spectrum 1 weight 0.10000E+01 volume 0.64926E-03 ppm1 3.402 ppm2 7.291 CV 1
ASSI { 2467}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 18 and name HA2 ))
5.200 3.400 0.800 peak 2467 spectrum 1 weight 0.10000E+01 volume 0.98937E-03 ppm1 5.307 ppm2 3.903 CV 1
ASSI { 2469}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 11 and name HB2 ))
5.300 3.500 0.700 peak 2469 spectrum 1 weight 0.10000E+01 volume 0.35902E-03 ppm1 5.310 ppm2 2.697 CV 1
ASSI { 2470}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 11 and name HB3 ))
4.400 2.500 1.600 peak 2470 spectrum 1 weight 0.10000E+01 volume 0.57258E-03 ppm1 5.308 ppm2 2.447 CV 1
ASSI { 2471}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 48 and name HB2 ))
4.200 2.200 1.800 peak 2471 spectrum 1 weight 0.10000E+01 volume 0.15767E-02 ppm1 4.680 ppm2 3.194 CV 1
ASSI { 2472}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 35 and name HB3 ))
5.600 4.000 0.400 peak 2472 spectrum 1 weight 0.10000E+01 volume 0.42333E-03 ppm1 5.537 ppm2 2.857 CV 1
ASSI { 2473}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HB3 ))
5.100 3.300 0.900 peak 2473 spectrum 1 weight 0.10000E+01 volume 0.73077E-03 ppm1 5.730 ppm2 2.406 CV 1
ASSI { 2474}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 13 and name HG2 ))
6.000 4.500 0.000 peak 2474 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.538 ppm2 1.700 CV 1
OR { 2474}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 9 and name HB3 ))
ASSI { 2475}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 40 and name HN ))
3.300 1.400 1.400 peak 2475 spectrum 1 weight 0.10000E+01 volume 0.37003E-02 ppm1 0.847 ppm2 7.532 CV 1
ASSI { 2476}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 40 and name HN ))
6.000 5.800 0.000 peak 2476 spectrum 1 weight 0.10000E+01 volume 0.18453E-03 ppm1 0.564 ppm2 7.533 CV 1
ASSI { 2477}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 40 and name HN ))
4.800 2.900 1.200 peak 2477 spectrum 1 weight 0.10000E+01 volume 0.71323E-03 ppm1 6.515 ppm2 7.532 CV 1
ASSI { 2478}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 48 and name HH2 ))
5.300 3.500 0.700 peak 2478 spectrum 1 weight 0.10000E+01 volume 0.41817E-03 ppm1 0.715 ppm2 6.502 CV 1
ASSI { 2479}
(( segid " " and resid 49 and name HG ))
(( segid " " and resid 26 and name HN ))
6.000 5.600 0.000 peak 2479 spectrum 1 weight 0.10000E+01 volume 0.18893E-03 ppm1 1.581 ppm2 9.676 CV 1
ASSI { 2481}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 12 and name HN ))
3.100 1.200 1.200 peak 2481 spectrum 1 weight 0.10000E+01 volume 0.47973E-02 ppm1 8.631 ppm2 8.277 CV 1
ASSI { 2482}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 27 and name HN ))
4.700 2.800 1.300 peak 2482 spectrum 1 weight 0.10000E+01 volume 0.12500E-02 ppm1 8.607 ppm2 8.220 CV 1
ASSI { 2483}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 15 and name HN ))
4.200 2.200 1.800 peak 2483 spectrum 1 weight 0.10000E+01 volume 0.20991E-02 ppm1 8.633 ppm2 8.071 CV 1
ASSI { 2484}
(( segid " " and resid 12 and name HG ))
(( segid " " and resid 15 and name HN ))
6.000 4.500 0.000 peak 2484 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.410 ppm2 8.074 CV 1
ASSI { 2485}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HN ))
2.800 1.000 1.000 peak 2485 spectrum 1 weight 0.10000E+01 volume 0.69672E-02 ppm1 8.174 ppm2 8.073 CV 1
ASSI { 2486}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 58 and name HN ))
4.100 2.100 1.900 peak 2486 spectrum 1 weight 0.10000E+01 volume 0.19371E-02 ppm1 8.264 ppm2 8.072 CV 1
ASSI { 2487}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 16 and name HN ))
4.300 2.300 1.700 peak 2487 spectrum 1 weight 0.10000E+01 volume 0.13250E-02 ppm1 8.299 ppm2 8.151 CV 1
ASSI { 2488}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HN ))
6.000 4.500 0.000 peak 2488 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.839 ppm2 7.528 CV 1
ASSI { 2489}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HN ))
6.000 4.500 0.000 peak 2489 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.895 ppm2 6.870 CV 1
ASSI { 2490}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HN ))
6.000 4.500 0.000 peak 2490 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.759 ppm2 7.689 CV 1
ASSI { 2492}
(( segid " " and resid 60 and name HA1 ))
(( segid " " and resid 60 and name HN ))
6.000 4.500 0.000 peak 2492 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.963 ppm2 8.409 CV 1
OR { 2492}
(( segid " " and resid 60 and name HA2 ))
(( segid " " and resid 60 and name HN ))
ASSI { 2493}
(( segid " " and resid 2 and name HD3 ))
(( segid " " and resid 2 and name HG2 ))
6.000 4.500 0.000 peak 2493 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.588 ppm2 1.999 CV 1
OR { 2493}
(( segid " " and resid 2 and name HD2 ))
(( segid " " and resid 2 and name HG2 ))
ASSI { 2495}
(( segid " " and resid 2 and name HD2 ))
(( segid " " and resid 2 and name HG3 ))
6.000 4.500 0.000 peak 2495 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.594 ppm2 1.957 CV 1
OR { 2495}
(( segid " " and resid 2 and name HD3 ))
(( segid " " and resid 2 and name HG3 ))
ASSI { 2496}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HD2 ))
6.000 4.500 0.000 peak 2496 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.488 ppm2 1.615 CV 1
ASSI { 2498}
(( segid " " and resid 51 and name HD3 ))
(( segid " " and resid 51 and name HB3 ))
6.000 4.500 0.000 peak 2498 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.515 ppm2 1.950 CV 1
ASSI { 2500}
(( segid " " and resid 51 and name HD3 ))
(( segid " " and resid 51 and name HG3 ))
6.000 4.500 0.000 peak 2500 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.515 ppm2 1.908 CV 1
ASSI { 2501}
(( segid " " and resid 51 and name HD2 ))
(( segid " " and resid 51 and name HB3 ))
6.000 4.500 0.000 peak 2501 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.640 ppm2 1.950 CV 1
ASSI { 2502}
(( segid " " and resid 51 and name HD2 ))
(( segid " " and resid 51 and name HD3 ))
6.000 4.500 0.000 peak 2502 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.645 ppm2 3.492 CV 1
ASSI { 2503}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HB2 ))
6.000 4.500 0.000 peak 2503 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.995 ppm2 3.086 CV 1
ASSI { 2504}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 25 and name HB2 ))
3.600 1.600 1.600 peak 2504 spectrum 1 weight 0.10000E+01 volume 0.33883E-02 ppm1 4.665 ppm2 2.798 CV 1
ASSI { 2506}
(( segid " " and resid 55 and name HB2 ))
( segid " " and resid 57 and name HB% )
5.200 3.400 0.800 peak 2506 spectrum 1 weight 0.10000E+01 volume 0.50552E-03 ppm1 2.927 ppm2 1.378 CV 1
OR { 2506}
(( segid " " and resid 55 and name HB3 ))
( segid " " and resid 57 and name HB% )
ASSI { 2507}
(( segid " " and resid 10 and name HG2 ))
( segid " " and resid 21 and name HD1%)
5.700 4.100 0.300 peak 2507 spectrum 1 weight 0.10000E+01 volume 0.37931E-03 ppm1 2.264 ppm2 0.407 CV 1
ASSI { 2508}
(( segid " " and resid 32 and name HB3 ))
( segid " " and resid 21 and name HD2%)
6.000 4.600 0.000 peak 2508 spectrum 1 weight 0.10000E+01 volume 0.16180E-03 ppm1 2.799 ppm2 -0.148 CV 1
ASSI { 2511}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 25 and name HN ))
3.400 1.400 1.400 peak 2511 spectrum 1 weight 0.10000E+01 volume 0.31366E-02 ppm1 9.112 ppm2 9.241 CV 1
ASSI { 2512}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 26 and name HN ))
4.200 2.200 1.800 peak 2512 spectrum 1 weight 0.10000E+01 volume 0.31799E-03 ppm1 9.113 ppm2 9.675 CV 1
ASSI { 2513}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 25 and name HN ))
5.200 3.400 0.800 peak 2513 spectrum 1 weight 0.10000E+01 volume 0.77857E-03 ppm1 8.244 ppm2 9.242 CV 1
ASSI { 2514}
(( segid " " and resid 36 and name HG ))
(( segid " " and resid 33 and name HN ))
4.900 3.000 1.100 peak 2514 spectrum 1 weight 0.10000E+01 volume 0.83187E-03 ppm1 1.738 ppm2 9.200 CV 1
ASSI { 2516}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HN ))
2.200 0.600 0.600 peak 2516 spectrum 1 weight 0.10000E+01 volume 0.32652E-01 ppm1 4.409 ppm2 8.676 CV 1
ASSI { 2517}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 13 and name HE ))
4.100 2.100 1.900 peak 2517 spectrum 1 weight 0.10000E+01 volume 0.17817E-02 ppm1 5.535 ppm2 8.644 CV 1
ASSI { 2518}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HN ))
6.000 4.500 0.000 peak 2518 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.889 ppm2 9.096 CV 1
ASSI { 2519}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 14 and name HN ))
4.100 2.100 1.900 peak 2519 spectrum 1 weight 0.10000E+01 volume 0.38172E-03 ppm1 6.901 ppm2 8.838 CV 1
ASSI { 2521}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 30 and name HN ))
4.200 2.300 1.800 peak 2521 spectrum 1 weight 0.10000E+01 volume 0.81192E-03 ppm1 7.121 ppm2 7.581 CV 1
ASSI { 2523}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 16 and name HN ))
4.800 2.900 1.200 peak 2523 spectrum 1 weight 0.10000E+01 volume 0.67058E-03 ppm1 2.464 ppm2 8.150 CV 1
ASSI { 2526}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 42 and name HN ))
4.500 2.500 1.500 peak 2526 spectrum 1 weight 0.10000E+01 volume 0.18673E-02 ppm1 0.926 ppm2 6.981 CV 1
ASSI { 2529}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 32 and name HE1 ))
6.000 4.500 0.000 peak 2529 spectrum 1 weight 0.10000E+01 volume 0.47216E-50 ppm1 2.793 ppm2 7.461 CV 1
ASSI { 2535}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 48 and name HH2 ))
4.100 2.100 1.900 peak 2535 spectrum 1 weight 0.10000E+01 volume 0.26163E-02 ppm1 2.972 ppm2 6.504 CV 1
OR { 2535}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 36 and name HN ))
ASSI { 2536}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 48 and name HZ3 ))
5.500 3.800 0.500 peak 2536 spectrum 1 weight 0.10000E+01 volume 0.82774E-03 ppm1 2.971 ppm2 6.641 CV 1
ASSI { 2539}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HB3 ))
6.000 5.000 0.000 peak 2539 spectrum 1 weight 0.10000E+01 volume 0.34203E-03 ppm1 4.997 ppm2 2.066 CV 1
ASSI { 2540}
(( segid " " and resid 55 and name HB3 ))
( segid " " and resid 54 and name HG2%)
3.500 1.500 1.500 peak 2540 spectrum 1 weight 0.10000E+01 volume 0.99109E-03 ppm1 2.916 ppm2 0.999 CV 1
OR { 2540}
(( segid " " and resid 55 and name HB2 ))
( segid " " and resid 54 and name HG2%)
ASSI { 2541}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 36 and name HD2%)
4.300 2.300 1.700 peak 2541 spectrum 1 weight 0.10000E+01 volume 0.17745E-02 ppm1 3.475 ppm2 0.545 CV 1
ASSI { 2544}
(( segid " " and resid 48 and name HB2 ))
( segid " " and resid 22 and name HD1%)
3.600 1.600 1.600 peak 2544 spectrum 1 weight 0.10000E+01 volume 0.29973E-02 ppm1 3.214 ppm2 0.371 CV 1
ASSI { 2545}
(( segid " " and resid 44 and name HD3 ))
( segid " " and resid 22 and name HD1%)
3.200 1.300 1.300 peak 2545 spectrum 1 weight 0.10000E+01 volume 0.83703E-02 ppm1 3.411 ppm2 0.372 CV 1
ASSI { 2546}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 14 and name HN ))
5.900 4.400 0.100 peak 2546 spectrum 1 weight 0.10000E+01 volume 0.29409E-03 ppm1 -0.136 ppm2 8.840 CV 1
ASSI { 2547}
( segid " " and resid 54 and name HG2%)
(( segid " " and resid 50 and name HN ))
4.400 2.400 1.600 peak 2547 spectrum 1 weight 0.10000E+01 volume 0.25523E-03 ppm1 1.017 ppm2 9.093 CV 1
ASSI { 2549}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 14 and name HN ))
3.200 1.300 1.300 peak 2549 spectrum 1 weight 0.10000E+01 volume 0.49348E-02 ppm1 3.898 ppm2 8.840 CV 1
ASSI { 2550}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 32 and name HN ))
5.500 3.800 0.500 peak 2550 spectrum 1 weight 0.10000E+01 volume 0.37828E-03 ppm1 2.306 ppm2 8.678 CV 1
ASSI { 2551}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 24 and name HN ))
4.600 2.600 1.400 peak 2551 spectrum 1 weight 0.10000E+01 volume 0.16737E-02 ppm1 2.235 ppm2 8.601 CV 1
ASSI { 2552}
(( segid " " and resid 14 and name HB ))
(( segid " " and resid 16 and name HN ))
4.900 3.000 1.100 peak 2552 spectrum 1 weight 0.10000E+01 volume 0.13326E-02 ppm1 2.300 ppm2 8.147 CV 1
ASSI { 2553}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 19 and name HN ))
4.000 2.000 2.000 peak 2553 spectrum 1 weight 0.10000E+01 volume 0.10616E-02 ppm1 1.247 ppm2 8.645 CV 1
ASSI { 2554}
( segid " " and resid 14 and name HG1%)
(( segid " " and resid 15 and name HN ))
3.500 1.500 1.500 peak 2554 spectrum 1 weight 0.10000E+01 volume 0.65511E-02 ppm1 1.311 ppm2 8.072 CV 1
ASSI { 2555}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 32 and name HN ))
5.500 3.700 0.500 peak 2555 spectrum 1 weight 0.10000E+01 volume 0.17607E-03 ppm1 0.553 ppm2 8.678 CV 1
ASSI { 2557}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 40 and name HN ))
4.400 2.400 1.600 peak 2557 spectrum 1 weight 0.10000E+01 volume 0.20217E-02 ppm1 0.792 ppm2 7.532 CV 1
ASSI { 2559}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 40 and name HN ))
4.200 2.200 1.800 peak 2559 spectrum 1 weight 0.10000E+01 volume 0.23838E-02 ppm1 1.860 ppm2 7.531 CV 1
ASSI { 2561}
(( segid " " and resid 41 and name HG2 ))
(( segid " " and resid 42 and name HN ))
3.800 1.800 1.800 peak 2561 spectrum 1 weight 0.10000E+01 volume 0.17397E-02 ppm1 2.137 ppm2 6.981 CV 1
ASSI { 2562}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 11 and name HD% )
5.600 3.900 0.400 peak 2562 spectrum 1 weight 0.10000E+01 volume 0.55848E-03 ppm1 2.217 ppm2 6.917 CV 1
ASSI { 2563}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 8 and name HD2 ))
3.700 1.700 1.700 peak 2563 spectrum 1 weight 0.10000E+01 volume 0.26012E-02 ppm1 2.232 ppm2 7.502 CV 1
ASSI { 2565}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 30 and name HN ))
4.000 2.000 2.000 peak 2565 spectrum 1 weight 0.10000E+01 volume 0.20114E-02 ppm1 2.652 ppm2 7.581 CV 1
OR { 2565}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 30 and name HN ))
ASSI { 2566}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HG ))
3.200 1.300 1.300 peak 2566 spectrum 1 weight 0.10000E+01 volume 0.70601E-02 ppm1 3.346 ppm2 7.387 CV 1
ASSI { 2569}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 38 and name HD2 ))
3.400 1.400 1.400 peak 2569 spectrum 1 weight 0.10000E+01 volume 0.60387E-02 ppm1 4.997 ppm2 3.790 CV 1
ASSI { 2571}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HD3 ))
2.300 0.600 0.600 peak 2571 spectrum 1 weight 0.10000E+01 volume 0.12690E-01 ppm1 3.932 ppm2 3.394 CV 1
ASSI { 2572}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 50 and name HA ))
5.200 3.400 0.800 peak 2572 spectrum 1 weight 0.10000E+01 volume 0.46356E-03 ppm1 4.186 ppm2 3.457 CV 1
ASSI { 2576}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HB3 ))
5.400 3.600 0.600 peak 2576 spectrum 1 weight 0.10000E+01 volume 0.16022E-02 ppm1 5.040 ppm2 1.914 CV 1
ASSI { 2578}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 40 and name HB3 ))
5.200 3.400 0.800 peak 2578 spectrum 1 weight 0.10000E+01 volume 0.17576E-03 ppm1 3.135 ppm2 1.447 CV 1
OR { 2578}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 33 and name HG12))
ASSI { 2579}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 33 and name HG13))
6.000 4.600 0.000 peak 2579 spectrum 1 weight 0.10000E+01 volume 0.25981E-03 ppm1 3.129 ppm2 1.284 CV 1
ASSI { 2584}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 22 and name HB3 ))
4.500 2.600 1.500 peak 2584 spectrum 1 weight 0.10000E+01 volume 0.37965E-03 ppm1 2.416 ppm2 0.772 CV 1
ASSI { 2585}
(( segid " " and resid 48 and name HB3 ))
( segid " " and resid 22 and name HD1%)
4.000 2.000 2.000 peak 2585 spectrum 1 weight 0.10000E+01 volume 0.36659E-02 ppm1 2.975 ppm2 0.370 CV 1
ASSI { 2588}
(( segid " " and resid 38 and name HD2 ))
( segid " " and resid 40 and name HD1%)
3.600 1.600 1.600 peak 2588 spectrum 1 weight 0.10000E+01 volume 0.56226E-02 ppm1 3.795 ppm2 0.916 CV 1
ASSI { 2589}
(( segid " " and resid 41 and name HD3 ))
( segid " " and resid 40 and name HD2%)
4.000 2.000 2.000 peak 2589 spectrum 1 weight 0.10000E+01 volume 0.47044E-03 ppm1 3.796 ppm2 0.696 CV 1
ASSI { 2590}
(( segid " " and resid 18 and name HA2 ))
( segid " " and resid 21 and name HD1%)
3.400 1.400 1.400 peak 2590 spectrum 1 weight 0.10000E+01 volume 0.43605E-02 ppm1 3.912 ppm2 0.404 CV 1
ASSI { 2591}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 21 and name HD1%)
5.200 3.400 0.800 peak 2591 spectrum 1 weight 0.10000E+01 volume 0.74177E-03 ppm1 4.180 ppm2 0.407 CV 1
ASSI { 2593}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 36 and name HD1%)
3.600 1.600 1.600 peak 2593 spectrum 1 weight 0.10000E+01 volume 0.26087E-02 ppm1 4.433 ppm2 0.832 CV 1
ASSI { 2594}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 21 and name HD2%)
5.300 3.500 0.700 peak 2594 spectrum 1 weight 0.10000E+01 volume 0.88483E-03 ppm1 4.188 ppm2 -0.152 CV 1
ASSI { 2595}
(( segid " " and resid 31 and name HB3 ))
( segid " " and resid 22 and name HD2%)
6.000 5.200 0.000 peak 2595 spectrum 1 weight 0.10000E+01 volume 0.15750E-03 ppm1 2.423 ppm2 -0.632 CV 1
ASSI { 2596}
( segid " " and resid 31 and name HE% )
(( segid " " and resid 29 and name HN ))
3.900 1.900 1.900 peak 2596 spectrum 1 weight 0.10000E+01 volume 0.54644E-03 ppm1 6.895 ppm2 9.338 CV 1
ASSI { 2597}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 17 and name HN ))
3.500 1.500 1.500 peak 2597 spectrum 1 weight 0.10000E+01 volume 0.67334E-02 ppm1 3.342 ppm2 8.605 CV 1
OR { 2597}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 18 and name HN ))
ASSI { 2598}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 12 and name HN ))
5.700 4.000 0.300 peak 2598 spectrum 1 weight 0.10000E+01 volume 0.42608E-03 ppm1 5.538 ppm2 8.275 CV 1
ASSI { 2600}
( segid " " and resid 36 and name HD2%)
(( segid " " and resid 35 and name HN ))
5.700 4.000 0.300 peak 2600 spectrum 1 weight 0.10000E+01 volume 0.48454E-03 ppm1 0.559 ppm2 7.401 CV 1
ASSI { 2601}
( segid " " and resid 21 and name HD1%)
( segid " " and resid 11 and name HD% )
4.000 2.000 2.000 peak 2601 spectrum 1 weight 0.10000E+01 volume 0.42333E-03 ppm1 0.419 ppm2 6.915 CV 1
ASSI { 2602}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 11 and name HN ))
3.100 1.200 1.200 peak 2602 spectrum 1 weight 0.10000E+01 volume 0.48626E-02 ppm1 0.419 ppm2 6.687 CV 1
ASSI { 2604}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 11 and name HN ))
4.600 2.600 1.400 peak 2604 spectrum 1 weight 0.10000E+01 volume 0.84631E-03 ppm1 3.332 ppm2 6.687 CV 1
ASSI { 2606}
(( segid " " and resid 47 and name HG2 ))
( segid " " and resid 49 and name HD2%)
6.000 4.500 0.000 peak 2606 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.239 ppm2 0.736 CV 1
OR { 2606}
(( segid " " and resid 47 and name HG3 ))
( segid " " and resid 49 and name HD2%)
ASSI { 2607}
(( segid " " and resid 44 and name HD2 ))
(( segid " " and resid 43 and name HG13))
4.300 2.300 1.700 peak 2607 spectrum 1 weight 0.10000E+01 volume 0.30156E-03 ppm1 3.671 ppm2 1.072 CV 1
ASSI { 2608}
(( segid " " and resid 44 and name HD2 ))
( segid " " and resid 33 and name HD1%)
4.200 2.200 1.800 peak 2608 spectrum 1 weight 0.10000E+01 volume 0.35833E-03 ppm1 3.673 ppm2 0.632 CV 1
ASSI { 2609}
( segid " " and resid 43 and name HG2%)
( segid " " and resid 22 and name HD2%)
3.500 1.500 1.500 peak 2609 spectrum 1 weight 0.10000E+01 volume 0.51721E-02 ppm1 0.915 ppm2 -0.633 CV 1
ASSI { 2610}
(( segid " " and resid 9 and name HG2 ))
( segid " " and resid 11 and name HE% )
5.200 3.400 0.800 peak 2610 spectrum 1 weight 0.10000E+01 volume 0.36899E-03 ppm1 2.642 ppm2 7.282 CV 1
OR { 2610}
(( segid " " and resid 9 and name HG3 ))
( segid " " and resid 11 and name HE% )
ASSI { 2611}
(( segid " " and resid 32 and name HE1 ))
(( segid " " and resid 32 and name HD2 ))
6.000 4.500 0.000 peak 2611 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.475 ppm2 7.631 CV 1
ASSI { 2612}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 34 and name HN ))
6.000 6.000 0.000 peak 2612 spectrum 1 weight 0.10000E+01 volume 0.16434E-03 ppm1 4.447 ppm2 7.136 CV 1
ASSI { 2613}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 8 and name HN ))
6.000 4.500 0.000 peak 2613 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.290 ppm2 8.266 CV 1
ASSI { 2614}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 14 and name HN ))
6.000 5.600 0.000 peak 2614 spectrum 1 weight 0.10000E+01 volume 0.26913E-03 ppm1 2.999 ppm2 8.841 CV 1
ASSI { 2615}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 12 and name HN ))
2.500 0.800 0.800 peak 2615 spectrum 1 weight 0.10000E+01 volume 0.12672E-01 ppm1 1.831 ppm2 8.278 CV 1
ASSI { 2616}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HB3 ))
6.000 4.500 0.000 peak 2616 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.341 ppm2 1.807 CV 1
ASSI { 2617}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB3 ))
6.000 4.500 0.000 peak 2617 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.887 ppm2 1.807 CV 1
ASSI { 2619}
(( segid " " and resid 12 and name HB3 ))
( segid " " and resid 21 and name HD2%)
2.800 1.000 1.000 peak 2619 spectrum 1 weight 0.10000E+01 volume 0.11785E-01 ppm1 1.834 ppm2 -0.150 CV 1
ASSI { 2620}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HN ))
6.000 4.500 0.000 peak 2620 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.904 ppm2 8.260 CV 1
ASSI { 2624}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HN ))
6.000 4.500 0.000 peak 2624 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.489 ppm2 8.150 CV 1
ASSI { 2625}
(( segid " " and resid 44 and name HD3 ))
(( segid " " and resid 43 and name HG12))
6.000 6.000 0.000 peak 2625 spectrum 1 weight 0.10000E+01 volume 0.54403E-04 ppm1 3.410 ppm2 1.585 CV 1
ASSI { 2627}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 2627 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 6.890 ppm2 9.088 CV 1
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