NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
17377 |
2cnr   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
set message=off echo=off end
!
! REMARK Streptomyces coelicolor FAS ACP NOE lists
!
! Unambiguous NOEs from ARIA1.2
ASSI { 3}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 55 and name HZ ))
3.400 1.500 1.500 peak 3 spectrum 1 weight 0.10000E+01 volume 0.13626E-02 ppm1 8.380 ppm2 7.470 CV 1
ASSI { 4}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HN ))
2.700 0.900 0.900 peak 4 spectrum 1 weight 0.10000E+01 volume 0.33679E-02 ppm1 8.380 ppm2 9.262 CV 1
ASSI { 5}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 13 and name HN ))
4.600 2.700 1.400 peak 5 spectrum 1 weight 0.10000E+01 volume 0.29804E-03 ppm1 8.383 ppm2 8.969 CV 1
ASSI { 6}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 10 and name HB% )
2.800 1.000 1.000 peak 6 spectrum 1 weight 0.10000E+01 volume 0.39477E-02 ppm1 8.380 ppm2 1.528 CV 1
ASSI { 7}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 55 and name HE% )
4.700 2.800 1.300 peak 7 spectrum 1 weight 0.10000E+01 volume 0.43385E-03 ppm1 8.380 ppm2 7.131 CV 1
ASSI { 8}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HA1 ))
2.300 0.700 0.700 peak 8 spectrum 1 weight 0.10000E+01 volume 0.67914E-02 ppm1 8.380 ppm2 3.869 CV 1
ASSI { 10}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HN ))
2.700 0.900 0.900 peak 10 spectrum 1 weight 0.10000E+01 volume 0.31909E-02 ppm1 8.380 ppm2 7.746 CV 1
ASSI { 11}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HB2 ))
5.200 3.300 0.800 peak 11 spectrum 1 weight 0.10000E+01 volume 0.34318E-03 ppm1 8.382 ppm2 2.122 CV 1
ASSI { 12}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA ))
3.700 1.700 1.700 peak 12 spectrum 1 weight 0.10000E+01 volume 0.97924E-03 ppm1 8.380 ppm2 4.230 CV 1
ASSI { 15}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 19 and name HB ))
4.600 2.600 1.400 peak 15 spectrum 1 weight 0.10000E+01 volume 0.57449E-03 ppm1 7.864 ppm2 1.639 CV 1
ASSI { 16}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 16 and name HG1%)
3.700 1.700 1.700 peak 16 spectrum 1 weight 0.10000E+01 volume 0.61988E-03 ppm1 7.861 ppm2 0.988 CV 1
ASSI { 17}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA ))
4.200 2.200 1.800 peak 17 spectrum 1 weight 0.10000E+01 volume 0.79372E-03 ppm1 7.863 ppm2 4.811 CV 1
ASSI { 18}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 20 and name HB% )
2.700 0.900 0.900 peak 18 spectrum 1 weight 0.10000E+01 volume 0.14620E-02 ppm1 7.863 ppm2 1.543 CV 1
ASSI { 19}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 17 and name HA ))
3.100 1.200 1.200 peak 19 spectrum 1 weight 0.10000E+01 volume 0.13863E-02 ppm1 7.863 ppm2 4.636 CV 1
ASSI { 20}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 22 and name HN ))
2.100 0.600 0.600 peak 20 spectrum 1 weight 0.10000E+01 volume 0.23461E-02 ppm1 7.863 ppm2 6.413 CV 1
ASSI { 21}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HN ))
2.400 0.700 0.700 peak 21 spectrum 1 weight 0.10000E+01 volume 0.55031E-02 ppm1 7.863 ppm2 8.695 CV 1
ASSI { 26}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HN ))
2.500 0.800 0.800 peak 26 spectrum 1 weight 0.10000E+01 volume 0.57562E-02 ppm1 8.736 ppm2 8.395 CV 1
ASSI { 27}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HB ))
4.300 2.300 1.700 peak 27 spectrum 1 weight 0.10000E+01 volume 0.45983E-03 ppm1 8.732 ppm2 4.366 CV 1
ASSI { 29}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 72 and name HB1 ))
3.300 1.400 1.400 peak 29 spectrum 1 weight 0.10000E+01 volume 0.20269E-02 ppm1 8.735 ppm2 2.958 CV 1
ASSI { 31}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 72 and name HB2 ))
2.800 1.000 1.000 peak 31 spectrum 1 weight 0.10000E+01 volume 0.39540E-02 ppm1 8.734 ppm2 3.182 CV 1
ASSI { 33}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 73 and name HN ))
4.200 2.200 1.800 peak 33 spectrum 1 weight 0.10000E+01 volume 0.49372E-03 ppm1 8.735 ppm2 8.021 CV 1
ASSI { 36}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HB1 ))
2.800 1.000 1.000 peak 36 spectrum 1 weight 0.10000E+01 volume 0.18052E-02 ppm1 8.758 ppm2 3.151 CV 1
ASSI { 42}
(( segid " " and resid 5 and name HE21))
(( segid " " and resid 29 and name HG ))
5.100 3.300 0.900 peak 42 spectrum 1 weight 0.10000E+01 volume 0.27912E-03 ppm1 6.835 ppm2 1.779 CV 1
ASSI { 43}
(( segid " " and resid 5 and name HE21))
(( segid " " and resid 5 and name HN ))
5.500 3.800 0.500 peak 43 spectrum 1 weight 0.10000E+01 volume 0.21980E-03 ppm1 6.839 ppm2 9.229 CV 1
ASSI { 45}
(( segid " " and resid 5 and name HE22))
( segid " " and resid 9 and name HG1%)
4.100 2.100 1.900 peak 45 spectrum 1 weight 0.10000E+01 volume 0.12039E-02 ppm1 7.519 ppm2 0.894 CV 1
ASSI { 47}
(( segid " " and resid 5 and name HE22))
(( segid " " and resid 29 and name HG ))
5.400 3.700 0.600 peak 47 spectrum 1 weight 0.10000E+01 volume 0.23662E-03 ppm1 7.520 ppm2 1.751 CV 1
ASSI { 48}
(( segid " " and resid 5 and name HE22))
(( segid " " and resid 5 and name HB2 ))
4.100 2.100 1.900 peak 48 spectrum 1 weight 0.10000E+01 volume 0.20275E-02 ppm1 7.519 ppm2 2.215 CV 1
ASSI { 51}
(( segid " " and resid 5 and name HE21))
( segid " " and resid 9 and name HG1%)
3.600 1.600 1.600 peak 51 spectrum 1 weight 0.10000E+01 volume 0.12943E-02 ppm1 6.835 ppm2 0.897 CV 1
ASSI { 52}
(( segid " " and resid 5 and name HE21))
(( segid " " and resid 5 and name HB2 ))
4.100 2.100 1.900 peak 52 spectrum 1 weight 0.10000E+01 volume 0.13255E-02 ppm1 6.835 ppm2 2.217 CV 1
ASSI { 53}
(( segid " " and resid 5 and name HE21))
(( segid " " and resid 5 and name HA ))
5.200 3.400 0.800 peak 53 spectrum 1 weight 0.10000E+01 volume 0.25874E-03 ppm1 6.833 ppm2 3.685 CV 1
ASSI { 54}
(( segid " " and resid 5 and name HE22))
( segid " " and resid 29 and name HD1%)
3.900 1.900 1.900 peak 54 spectrum 1 weight 0.10000E+01 volume 0.84395E-03 ppm1 7.517 ppm2 0.829 CV 1
ASSI { 55}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 7 and name HN ))
3.700 1.700 1.700 peak 55 spectrum 1 weight 0.10000E+01 volume 0.79377E-03 ppm1 8.594 ppm2 7.700 CV 1
ASSI { 57}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 7 and name HB1 ))
3.600 1.600 1.600 peak 57 spectrum 1 weight 0.10000E+01 volume 0.16646E-02 ppm1 8.595 ppm2 2.124 CV 1
ASSI { 60}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 7 and name HB2 ))
2.600 0.800 0.800 peak 60 spectrum 1 weight 0.10000E+01 volume 0.36417E-02 ppm1 8.595 ppm2 2.494 CV 1
ASSI { 61}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HA ))
2.300 0.600 0.600 peak 61 spectrum 1 weight 0.10000E+01 volume 0.79954E-02 ppm1 8.595 ppm2 4.840 CV 1
ASSI { 62}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 69 and name HA ))
4.400 2.400 1.600 peak 62 spectrum 1 weight 0.10000E+01 volume 0.35546E-03 ppm1 9.359 ppm2 5.278 CV 1
ASSI { 63}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 29 and name HB1 ))
4.900 3.000 1.100 peak 63 spectrum 1 weight 0.10000E+01 volume 0.52717E-03 ppm1 9.358 ppm2 1.466 CV 1
ASSI { 67}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HB ))
3.400 1.500 1.500 peak 67 spectrum 1 weight 0.10000E+01 volume 0.28655E-02 ppm1 9.359 ppm2 2.264 CV 1
ASSI { 68}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 29 and name HA ))
3.100 1.200 1.200 peak 68 spectrum 1 weight 0.10000E+01 volume 0.23679E-02 ppm1 9.359 ppm2 3.575 CV 1
ASSI { 69}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 71 and name HA2 ))
2.600 0.800 0.800 peak 69 spectrum 1 weight 0.10000E+01 volume 0.53304E-02 ppm1 9.359 ppm2 4.016 CV 1
ASSI { 70}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 69 and name HB ))
2.700 0.900 0.900 peak 70 spectrum 1 weight 0.10000E+01 volume 0.24846E-02 ppm1 9.359 ppm2 4.365 CV 1
ASSI { 71}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 71 and name HA1 ))
2.400 0.700 0.700 peak 71 spectrum 1 weight 0.10000E+01 volume 0.30623E-02 ppm1 9.358 ppm2 3.804 CV 1
ASSI { 74}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 29 and name HB2 ))
5.800 4.300 0.200 peak 74 spectrum 1 weight 0.10000E+01 volume 0.35142E-03 ppm1 9.357 ppm2 1.759 CV 1
ASSI { 76}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HA ))
3.800 1.800 1.800 peak 76 spectrum 1 weight 0.10000E+01 volume 0.47998E-03 ppm1 9.356 ppm2 3.327 CV 1
ASSI { 78}
(( segid " " and resid 81 and name HE22))
( segid " " and resid 78 and name HD2%)
3.400 1.500 1.500 peak 78 spectrum 1 weight 0.10000E+01 volume 0.71038E-03 ppm1 7.704 ppm2 0.824 CV 1
ASSI { 82}
(( segid " " and resid 81 and name HE22))
( segid " " and resid 2 and name HB% )
3.700 1.700 1.700 peak 82 spectrum 1 weight 0.10000E+01 volume 0.79016E-03 ppm1 7.704 ppm2 1.532 CV 1
ASSI { 83}
(( segid " " and resid 81 and name HE21))
( segid " " and resid 8 and name HG2%)
3.300 3.300 2.700 peak 83 spectrum 1 weight 0.10000E+01 volume 0.38971E-03 ppm1 7.757 ppm2 0.520 CV 1
ASSI { 85}
(( segid " " and resid 81 and name HE22))
( segid " " and resid 8 and name HG2%)
3.100 3.100 2.900 peak 85 spectrum 1 weight 0.10000E+01 volume 0.54725E-03 ppm1 7.704 ppm2 0.520 CV 1
ASSI { 86}
(( segid " " and resid 81 and name HE22))
(( segid " " and resid 3 and name HN ))
3.400 1.400 1.400 peak 86 spectrum 1 weight 0.10000E+01 volume 0.75039E-03 ppm1 7.703 ppm2 8.855 CV 1
ASSI { 87}
(( segid " " and resid 81 and name HE21))
( segid " " and resid 2 and name HB% )
4.200 2.300 1.800 peak 87 spectrum 1 weight 0.10000E+01 volume 0.61697E-03 ppm1 7.758 ppm2 1.530 CV 1
ASSI { 90}
(( segid " " and resid 81 and name HE21))
(( segid " " and resid 3 and name HN ))
4.900 3.000 1.100 peak 90 spectrum 1 weight 0.10000E+01 volume 0.34749E-03 ppm1 7.759 ppm2 8.866 CV 1
ASSI { 92}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
3.100 1.200 1.200 peak 92 spectrum 1 weight 0.10000E+01 volume 0.11410E-02 ppm1 8.355 ppm2 3.581 CV 1
ASSI { 93}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 29 and name HD2%)
5.200 3.400 0.800 peak 93 spectrum 1 weight 0.10000E+01 volume 0.35301E-03 ppm1 8.355 ppm2 0.902 CV 1
ASSI { 94}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB1 ))
3.400 1.400 1.400 peak 94 spectrum 1 weight 0.10000E+01 volume 0.21981E-02 ppm1 8.355 ppm2 1.497 CV 1
ASSI { 95}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HD1 ))
4.600 2.700 1.400 peak 95 spectrum 1 weight 0.10000E+01 volume 0.10231E-02 ppm1 8.355 ppm2 1.373 CV 1
ASSI { 96}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB2 ))
3.000 1.100 1.100 peak 96 spectrum 1 weight 0.10000E+01 volume 0.21965E-02 ppm1 8.354 ppm2 2.781 CV 1
ASSI { 97}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB1 ))
3.100 1.200 1.200 peak 97 spectrum 1 weight 0.10000E+01 volume 0.29430E-02 ppm1 8.355 ppm2 2.596 CV 1
ASSI { 98}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 28 and name HB2 ))
2.800 1.000 1.000 peak 98 spectrum 1 weight 0.10000E+01 volume 0.22386E-02 ppm1 8.355 ppm2 2.082 CV 1
ASSI { 100}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HN ))
2.500 0.800 0.800 peak 100 spectrum 1 weight 0.10000E+01 volume 0.43663E-02 ppm1 8.355 ppm2 7.500 CV 1
ASSI { 101}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB2 ))
3.000 1.100 1.100 peak 101 spectrum 1 weight 0.10000E+01 volume 0.33852E-02 ppm1 8.354 ppm2 1.748 CV 1
ASSI { 102}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 28 and name HA ))
4.900 3.000 1.100 peak 102 spectrum 1 weight 0.10000E+01 volume 0.36667E-03 ppm1 8.355 ppm2 4.648 CV 1
ASSI { 103}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 55 and name HB2 ))
4.300 2.300 1.700 peak 103 spectrum 1 weight 0.10000E+01 volume 0.28632E-03 ppm1 7.763 ppm2 3.446 CV 1
ASSI { 104}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 53 and name HA ))
3.800 1.800 1.800 peak 104 spectrum 1 weight 0.10000E+01 volume 0.61727E-03 ppm1 8.203 ppm2 4.162 CV 1
ASSI { 105}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HG1 ))
3.400 1.500 1.500 peak 105 spectrum 1 weight 0.10000E+01 volume 0.51868E-03 ppm1 8.207 ppm2 0.704 CV 1
ASSI { 106}
(( segid " " and resid 55 and name HN ))
( segid " " and resid 57 and name HG1%)
3.900 1.900 1.900 peak 106 spectrum 1 weight 0.10000E+01 volume 0.73539E-03 ppm1 8.207 ppm2 0.949 CV 1
ASSI { 107}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HB2 ))
2.700 0.900 0.900 peak 107 spectrum 1 weight 0.10000E+01 volume 0.19620E-02 ppm1 8.207 ppm2 3.448 CV 1
ASSI { 108}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HB2 ))
3.600 1.700 1.700 peak 108 spectrum 1 weight 0.10000E+01 volume 0.16274E-02 ppm1 8.206 ppm2 1.556 CV 1
ASSI { 110}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HA ))
3.300 1.400 1.400 peak 110 spectrum 1 weight 0.10000E+01 volume 0.16584E-02 ppm1 8.206 ppm2 3.950 CV 1
ASSI { 111}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HB1 ))
3.400 1.500 1.500 peak 111 spectrum 1 weight 0.10000E+01 volume 0.27829E-02 ppm1 8.206 ppm2 1.076 CV 1
ASSI { 112}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 56 and name HA ))
5.100 3.200 0.900 peak 112 spectrum 1 weight 0.10000E+01 volume 0.58826E-03 ppm1 8.210 ppm2 4.528 CV 1
ASSI { 113}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 56 and name HN ))
2.500 0.800 0.800 peak 113 spectrum 1 weight 0.10000E+01 volume 0.52663E-02 ppm1 8.206 ppm2 7.873 CV 1
ASSI { 114}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HB1 ))
3.500 1.600 1.600 peak 114 spectrum 1 weight 0.10000E+01 volume 0.35656E-02 ppm1 8.206 ppm2 2.750 CV 1
ASSI { 115}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HA ))
3.000 1.200 1.200 peak 115 spectrum 1 weight 0.10000E+01 volume 0.21656E-02 ppm1 8.206 ppm2 4.872 CV 1
ASSI { 116}
(( segid " " and resid 55 and name HN ))
( segid " " and resid 55 and name HD% )
3.100 1.200 1.200 peak 116 spectrum 1 weight 0.10000E+01 volume 0.27888E-02 ppm1 8.206 ppm2 7.469 CV 1
ASSI { 117}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.400 1.400 1.400 peak 117 spectrum 1 weight 0.10000E+01 volume 0.79544E-03 ppm1 7.439 ppm2 2.301 CV 1
ASSI { 119}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HG ))
4.800 2.900 1.200 peak 119 spectrum 1 weight 0.10000E+01 volume 0.70421E-03 ppm1 7.440 ppm2 1.464 CV 1
ASSI { 120}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HB2 ))
4.200 2.200 1.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.50669E-03 ppm1 7.764 ppm2 3.262 CV 1
ASSI { 121}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 33 and name HA ))
4.600 2.700 1.400 peak 121 spectrum 1 weight 0.10000E+01 volume 0.46330E-03 ppm1 7.440 ppm2 4.083 CV 1
ASSI { 122}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HA ))
3.000 1.100 1.100 peak 122 spectrum 1 weight 0.10000E+01 volume 0.13289E-02 ppm1 7.440 ppm2 4.456 CV 1
ASSI { 123}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 55 and name HB1 ))
4.400 2.400 1.600 peak 123 spectrum 1 weight 0.10000E+01 volume 0.46485E-03 ppm1 7.768 ppm2 2.776 CV 1
ASSI { 124}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HN ))
2.700 0.900 0.900 peak 124 spectrum 1 weight 0.10000E+01 volume 0.38908E-02 ppm1 7.440 ppm2 8.328 CV 1
ASSI { 125}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HA ))
2.200 0.600 0.600 peak 125 spectrum 1 weight 0.10000E+01 volume 0.14969E-01 ppm1 7.440 ppm2 4.325 CV 1
ASSI { 126}
(( segid " " and resid 57 and name HN ))
( segid " " and resid 57 and name HG1%)
2.600 0.800 0.800 peak 126 spectrum 1 weight 0.10000E+01 volume 0.38986E-02 ppm1 7.764 ppm2 0.959 CV 1
ASSI { 127}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
2.400 0.700 0.700 peak 127 spectrum 1 weight 0.10000E+01 volume 0.40443E-02 ppm1 7.440 ppm2 7.295 CV 1
ASSI { 128}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HA ))
2.700 0.900 0.900 peak 128 spectrum 1 weight 0.10000E+01 volume 0.55155E-02 ppm1 7.764 ppm2 4.527 CV 1
ASSI { 129}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 52 and name HA ))
3.200 1.300 1.300 peak 129 spectrum 1 weight 0.10000E+01 volume 0.42324E-02 ppm1 7.763 ppm2 4.176 CV 1
ASSI { 130}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB1 ))
3.700 1.700 1.700 peak 130 spectrum 1 weight 0.10000E+01 volume 0.21129E-02 ppm1 7.439 ppm2 2.548 CV 1
ASSI { 131}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 36 and name HN ))
3.600 1.600 1.600 peak 131 spectrum 1 weight 0.10000E+01 volume 0.78414E-03 ppm1 7.439 ppm2 7.815 CV 1
ASSI { 132}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB2 ))
3.400 1.500 1.500 peak 132 spectrum 1 weight 0.10000E+01 volume 0.14223E-02 ppm1 7.440 ppm2 3.138 CV 1
ASSI { 135}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HB ))
3.100 1.200 1.200 peak 135 spectrum 1 weight 0.10000E+01 volume 0.15491E-02 ppm1 7.763 ppm2 2.010 CV 1
ASSI { 136}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HA ))
2.800 1.000 1.000 peak 136 spectrum 1 weight 0.10000E+01 volume 0.29774E-02 ppm1 7.763 ppm2 4.725 CV 1
ASSI { 138}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 53 and name HG1 ))
3.300 3.300 2.700 peak 138 spectrum 1 weight 0.10000E+01 volume 0.40161E-03 ppm1 7.765 ppm2 2.313 CV 1
ASSI { 139}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 36 and name HA ))
3.900 1.900 1.900 peak 139 spectrum 1 weight 0.10000E+01 volume 0.55791E-03 ppm1 7.440 ppm2 5.054 CV 1
ASSI { 140}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB1 ))
4.000 2.000 2.000 peak 140 spectrum 1 weight 0.10000E+01 volume 0.64238E-03 ppm1 7.440 ppm2 1.702 CV 1
ASSI { 142}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 37 and name HD1%)
3.400 1.400 1.400 peak 142 spectrum 1 weight 0.10000E+01 volume 0.32025E-03 ppm1 7.441 ppm2 0.571 CV 1
ASSI { 143}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HB ))
4.800 2.900 1.200 peak 143 spectrum 1 weight 0.10000E+01 volume 0.40595E-03 ppm1 7.440 ppm2 1.984 CV 1
ASSI { 148}
(( segid " " and resid 17 and name HD21))
( segid " " and resid 24 and name HG1%)
3.900 1.900 1.900 peak 148 spectrum 1 weight 0.10000E+01 volume 0.69242E-03 ppm1 6.858 ppm2 0.994 CV 1
ASSI { 151}
(( segid " " and resid 17 and name HD22))
(( segid " " and resid 24 and name HN ))
4.800 2.800 1.200 peak 151 spectrum 1 weight 0.10000E+01 volume 0.56309E-03 ppm1 8.079 ppm2 8.519 CV 1
ASSI { 152}
(( segid " " and resid 17 and name HD22))
(( segid " " and resid 17 and name HN ))
6.000 5.100 0.000 peak 152 spectrum 1 weight 0.10000E+01 volume 0.30481E-03 ppm1 8.080 ppm2 8.696 CV 1
ASSI { 154}
(( segid " " and resid 17 and name HD21))
(( segid " " and resid 17 and name HD22))
2.100 0.600 0.600 peak 154 spectrum 1 weight 0.10000E+01 volume 0.65072E-02 ppm1 6.853 ppm2 8.084 CV 1
ASSI { 155}
(( segid " " and resid 17 and name HD21))
(( segid " " and resid 17 and name HA ))
3.400 1.500 1.500 peak 155 spectrum 1 weight 0.10000E+01 volume 0.10017E-02 ppm1 6.859 ppm2 4.636 CV 1
ASSI { 156}
(( segid " " and resid 17 and name HD22))
( segid " " and resid 24 and name HG1%)
4.400 2.400 1.600 peak 156 spectrum 1 weight 0.10000E+01 volume 0.76643E-03 ppm1 8.078 ppm2 0.990 CV 1
ASSI { 162}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB1 ))
2.700 0.900 0.900 peak 162 spectrum 1 weight 0.10000E+01 volume 0.52268E-02 ppm1 8.467 ppm2 3.916 CV 1
OR { 162}
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(( segid " " and resid 41 and name HB2 ))
ASSI { 163}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HA ))
2.600 0.800 0.800 peak 163 spectrum 1 weight 0.10000E+01 volume 0.52727E-02 ppm1 8.467 ppm2 4.615 CV 1
ASSI { 164}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB2 ))
3.100 1.200 1.200 peak 164 spectrum 1 weight 0.10000E+01 volume 0.58184E-02 ppm1 8.467 ppm2 3.139 CV 1
ASSI { 165}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB1 ))
2.900 1.000 1.000 peak 165 spectrum 1 weight 0.10000E+01 volume 0.26160E-02 ppm1 8.467 ppm2 2.784 CV 1
ASSI { 166}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HA ))
2.800 1.000 1.000 peak 166 spectrum 1 weight 0.10000E+01 volume 0.35275E-02 ppm1 8.465 ppm2 3.987 CV 1
ASSI { 168}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HN ))
3.000 1.100 1.100 peak 168 spectrum 1 weight 0.10000E+01 volume 0.22036E-02 ppm1 8.467 ppm2 7.873 CV 1
ASSI { 169}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 34 and name HG2%)
4.400 2.500 1.600 peak 169 spectrum 1 weight 0.10000E+01 volume 0.29878E-03 ppm1 8.467 ppm2 1.305 CV 1
ASSI { 170}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HN ))
4.700 2.700 1.300 peak 170 spectrum 1 weight 0.10000E+01 volume 0.37947E-03 ppm1 8.466 ppm2 8.147 CV 1
ASSI { 172}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 63 and name HA ))
3.400 1.400 1.400 peak 172 spectrum 1 weight 0.10000E+01 volume 0.13053E-02 ppm1 7.249 ppm2 4.682 CV 1
ASSI { 173}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HB1 ))
4.700 2.700 1.300 peak 173 spectrum 1 weight 0.10000E+01 volume 0.70372E-03 ppm1 7.248 ppm2 0.915 CV 1
ASSI { 174}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HA ))
4.700 2.800 1.300 peak 174 spectrum 1 weight 0.10000E+01 volume 0.54202E-03 ppm1 7.247 ppm2 4.505 CV 1
ASSI { 175}
(( segid " " and resid 66 and name HN ))
( segid " " and resid 67 and name HD2%)
4.400 2.400 1.600 peak 175 spectrum 1 weight 0.10000E+01 volume 0.77215E-03 ppm1 7.248 ppm2 0.537 CV 1
ASSI { 177}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HA ))
3.300 1.300 1.300 peak 177 spectrum 1 weight 0.10000E+01 volume 0.15466E-02 ppm1 7.248 ppm2 4.023 CV 1
ASSI { 178}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HD1 ))
3.600 1.600 1.600 peak 178 spectrum 1 weight 0.10000E+01 volume 0.10613E-02 ppm1 7.248 ppm2 1.380 CV 1
ASSI { 179}
(( segid " " and resid 66 and name HD21))
(( segid " " and resid 66 and name HB1 ))
3.200 1.300 1.300 peak 179 spectrum 1 weight 0.10000E+01 volume 0.17952E-02 ppm1 7.009 ppm2 2.774 CV 1
ASSI { 180}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HN ))
2.700 0.900 0.900 peak 180 spectrum 1 weight 0.10000E+01 volume 0.29404E-02 ppm1 7.248 ppm2 7.435 CV 1
ASSI { 181}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HB1 ))
3.000 1.100 1.100 peak 181 spectrum 1 weight 0.10000E+01 volume 0.35773E-02 ppm1 7.248 ppm2 1.813 CV 1
OR { 181}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HB2 ))
ASSI { 182}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HN ))
2.100 0.600 0.600 peak 182 spectrum 1 weight 0.10000E+01 volume 0.92289E-02 ppm1 7.249 ppm2 7.751 CV 1
ASSI { 183}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HA ))
2.800 1.000 1.000 peak 183 spectrum 1 weight 0.10000E+01 volume 0.34572E-02 ppm1 7.249 ppm2 4.876 CV 1
ASSI { 184}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HB2 ))
2.600 0.900 0.900 peak 184 spectrum 1 weight 0.10000E+01 volume 0.35015E-02 ppm1 7.249 ppm2 3.078 CV 1
ASSI { 185}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HB1 ))
2.700 0.900 0.900 peak 185 spectrum 1 weight 0.10000E+01 volume 0.56773E-02 ppm1 7.249 ppm2 2.773 CV 1
ASSI { 186}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 63 and name HB2 ))
4.500 2.500 1.500 peak 186 spectrum 1 weight 0.10000E+01 volume 0.41849E-03 ppm1 7.253 ppm2 2.401 CV 1
OR { 186}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 63 and name HB1 ))
ASSI { 187}
(( segid " " and resid 66 and name HN ))
( segid " " and resid 67 and name HD1%)
5.100 3.200 0.900 peak 187 spectrum 1 weight 0.10000E+01 volume 0.52016E-03 ppm1 7.249 ppm2 0.464 CV 1
ASSI { 188}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HB2 ))
5.000 3.200 1.000 peak 188 spectrum 1 weight 0.10000E+01 volume 0.72543E-03 ppm1 7.250 ppm2 2.117 CV 1
ASSI { 190}
(( segid " " and resid 66 and name HD21))
(( segid " " and resid 63 and name HA ))
4.000 2.000 2.000 peak 190 spectrum 1 weight 0.10000E+01 volume 0.66336E-03 ppm1 7.009 ppm2 4.694 CV 1
ASSI { 191}
(( segid " " and resid 66 and name HD22))
(( segid " " and resid 66 and name HB2 ))
4.100 2.100 1.900 peak 191 spectrum 1 weight 0.10000E+01 volume 0.13417E-02 ppm1 7.752 ppm2 3.075 CV 1
ASSI { 192}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HD21))
4.300 2.400 1.700 peak 192 spectrum 1 weight 0.10000E+01 volume 0.71215E-03 ppm1 7.248 ppm2 7.009 CV 1
ASSI { 193}
(( segid " " and resid 66 and name HD22))
(( segid " " and resid 63 and name HA ))
4.600 2.600 1.400 peak 193 spectrum 1 weight 0.10000E+01 volume 0.84202E-03 ppm1 7.751 ppm2 4.687 CV 1
ASSI { 194}
(( segid " " and resid 80 and name HN ))
( segid " " and resid 57 and name HG1%)
4.600 2.700 1.400 peak 194 spectrum 1 weight 0.10000E+01 volume 0.38515E-03 ppm1 7.714 ppm2 0.962 CV 1
ASSI { 195}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HB1 ))
3.700 1.700 1.700 peak 195 spectrum 1 weight 0.10000E+01 volume 0.23648E-02 ppm1 7.715 ppm2 2.545 CV 1
ASSI { 197}
(( segid " " and resid 66 and name HN ))
( segid " " and resid 64 and name HG1%)
4.900 3.000 1.100 peak 197 spectrum 1 weight 0.10000E+01 volume 0.35058E-03 ppm1 7.249 ppm2 0.771 CV 1
ASSI { 198}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 32 and name HB2 ))
3.400 1.400 1.400 peak 198 spectrum 1 weight 0.10000E+01 volume 0.10455E-02 ppm1 7.804 ppm2 4.099 CV 1
ASSI { 205}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 34 and name HN ))
5.100 3.200 0.900 peak 205 spectrum 1 weight 0.10000E+01 volume 0.28026E-03 ppm1 7.804 ppm2 8.760 CV 1
ASSI { 206}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HB2 ))
2.700 0.900 0.900 peak 206 spectrum 1 weight 0.10000E+01 volume 0.18303E-02 ppm1 7.804 ppm2 3.071 CV 1
ASSI { 208}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HB1 ))
3.000 1.100 1.100 peak 208 spectrum 1 weight 0.10000E+01 volume 0.11407E-02 ppm1 7.803 ppm2 2.445 CV 1
ASSI { 210}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 37 and name HN ))
2.400 0.700 0.700 peak 210 spectrum 1 weight 0.10000E+01 volume 0.39344E-02 ppm1 7.805 ppm2 7.312 CV 1
ASSI { 211}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 32 and name HN ))
3.600 1.700 1.700 peak 211 spectrum 1 weight 0.10000E+01 volume 0.72113E-03 ppm1 7.806 ppm2 10.107 CV 1
ASSI { 216}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 37 and name HD2%)
5.100 3.200 0.900 peak 216 spectrum 1 weight 0.10000E+01 volume 0.28109E-03 ppm1 7.807 ppm2 0.774 CV 1
ASSI { 217}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 77 and name HG2%)
4.700 2.700 1.300 peak 217 spectrum 1 weight 0.10000E+01 volume 0.33207E-03 ppm1 8.309 ppm2 0.532 CV 1
ASSI { 218}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HN ))
2.500 0.800 0.800 peak 218 spectrum 1 weight 0.10000E+01 volume 0.36453E-02 ppm1 8.309 ppm2 8.519 CV 1
ASSI { 219}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 63 and name HA ))
4.300 2.300 1.700 peak 219 spectrum 1 weight 0.10000E+01 volume 0.45325E-03 ppm1 7.429 ppm2 4.692 CV 1
ASSI { 220}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HB1 ))
3.000 1.200 1.200 peak 220 spectrum 1 weight 0.10000E+01 volume 0.35490E-02 ppm1 8.309 ppm2 2.218 CV 1
ASSI { 221}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 80 and name HN ))
2.600 0.900 0.900 peak 221 spectrum 1 weight 0.10000E+01 volume 0.36951E-02 ppm1 8.309 ppm2 7.718 CV 1
ASSI { 223}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HB1 ))
3.200 1.300 1.300 peak 223 spectrum 1 weight 0.10000E+01 volume 0.37840E-02 ppm1 8.309 ppm2 1.647 CV 1
ASSI { 224}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HB2 ))
2.600 0.900 0.900 peak 224 spectrum 1 weight 0.10000E+01 volume 0.37910E-02 ppm1 8.309 ppm2 1.772 CV 1
ASSI { 225}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HB2 ))
2.400 0.700 0.700 peak 225 spectrum 1 weight 0.10000E+01 volume 0.67850E-02 ppm1 8.309 ppm2 2.525 CV 1
ASSI { 226}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 76 and name HA ))
3.400 1.500 1.500 peak 226 spectrum 1 weight 0.10000E+01 volume 0.11144E-02 ppm1 8.308 ppm2 4.197 CV 1
ASSI { 227}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HA ))
3.000 1.100 1.100 peak 227 spectrum 1 weight 0.10000E+01 volume 0.17417E-02 ppm1 8.310 ppm2 3.907 CV 1
ASSI { 228}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HA ))
2.700 0.900 0.900 peak 228 spectrum 1 weight 0.10000E+01 volume 0.38638E-02 ppm1 7.427 ppm2 4.023 CV 1
ASSI { 229}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HB1 ))
2.400 0.700 0.700 peak 229 spectrum 1 weight 0.10000E+01 volume 0.77462E-02 ppm1 7.428 ppm2 1.808 CV 1
OR { 229}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HB2 ))
ASSI { 231}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 64 and name HG1%)
3.600 1.600 1.600 peak 231 spectrum 1 weight 0.10000E+01 volume 0.15591E-02 ppm1 7.428 ppm2 0.769 CV 1
ASSI { 232}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 78 and name HD1%)
2.800 2.800 3.200 peak 232 spectrum 1 weight 0.10000E+01 volume 0.91535E-03 ppm1 8.310 ppm2 0.822 CV 1
ASSI { 234}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HB ))
2.600 0.800 0.800 peak 234 spectrum 1 weight 0.10000E+01 volume 0.33250E-02 ppm1 7.428 ppm2 2.069 CV 1
ASSI { 237}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 64 and name HG2%)
4.400 2.400 1.600 peak 237 spectrum 1 weight 0.10000E+01 volume 0.90854E-03 ppm1 7.428 ppm2 0.919 CV 1
ASSI { 238}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 62 and name HA ))
3.800 1.800 1.800 peak 238 spectrum 1 weight 0.10000E+01 volume 0.53250E-03 ppm1 7.428 ppm2 4.325 CV 1
ASSI { 240}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HN ))
3.100 1.200 1.200 peak 240 spectrum 1 weight 0.10000E+01 volume 0.17737E-02 ppm1 8.775 ppm2 8.605 CV 1
ASSI { 241}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HA ))
2.800 0.900 0.900 peak 241 spectrum 1 weight 0.10000E+01 volume 0.43374E-02 ppm1 8.776 ppm2 4.324 CV 1
ASSI { 242}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HN ))
2.600 0.800 0.800 peak 242 spectrum 1 weight 0.10000E+01 volume 0.43920E-02 ppm1 8.775 ppm2 7.557 CV 1
ASSI { 243}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB2 ))
2.500 0.800 0.800 peak 243 spectrum 1 weight 0.10000E+01 volume 0.61628E-02 ppm1 8.776 ppm2 2.628 CV 1
ASSI { 244}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB1 ))
2.900 1.000 1.000 peak 244 spectrum 1 weight 0.10000E+01 volume 0.52678E-02 ppm1 8.776 ppm2 2.499 CV 1
ASSI { 245}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HA ))
3.700 1.700 1.700 peak 245 spectrum 1 weight 0.10000E+01 volume 0.89605E-03 ppm1 8.776 ppm2 4.777 CV 1
ASSI { 246}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 60 and name HB1 ))
3.400 1.500 1.500 peak 246 spectrum 1 weight 0.10000E+01 volume 0.15756E-02 ppm1 8.775 ppm2 1.918 CV 1
ASSI { 247}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 70 and name HA ))
4.200 2.200 1.800 peak 247 spectrum 1 weight 0.10000E+01 volume 0.35889E-03 ppm1 8.656 ppm2 3.328 CV 1
ASSI { 248}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 75 and name HB1 ))
5.700 4.000 0.300 peak 248 spectrum 1 weight 0.10000E+01 volume 0.34749E-03 ppm1 8.658 ppm2 1.946 CV 1
ASSI { 249}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 73 and name HB% )
2.800 1.000 1.000 peak 249 spectrum 1 weight 0.10000E+01 volume 0.29057E-02 ppm1 8.656 ppm2 1.534 CV 1
ASSI { 251}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 75 and name HN ))
2.700 0.900 0.900 peak 251 spectrum 1 weight 0.10000E+01 volume 0.33472E-02 ppm1 8.656 ppm2 8.156 CV 1
ASSI { 252}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 73 and name HN ))
2.600 0.800 0.800 peak 252 spectrum 1 weight 0.10000E+01 volume 0.44521E-02 ppm1 8.655 ppm2 8.008 CV 1
ASSI { 254}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HA ))
2.700 0.900 0.900 peak 254 spectrum 1 weight 0.10000E+01 volume 0.28877E-02 ppm1 8.657 ppm2 3.683 CV 1
ASSI { 255}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HB ))
2.600 0.900 0.900 peak 255 spectrum 1 weight 0.10000E+01 volume 0.68452E-02 ppm1 8.656 ppm2 4.184 CV 1
ASSI { 257}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 70 and name HG2%)
3.400 1.400 1.400 peak 257 spectrum 1 weight 0.10000E+01 volume 0.12922E-02 ppm1 8.657 ppm2 0.619 CV 1
ASSI { 261}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 37 and name HD2%)
2.800 2.800 3.200 peak 261 spectrum 1 weight 0.10000E+01 volume 0.74975E-03 ppm1 7.311 ppm2 0.770 CV 1
ASSI { 262}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HA ))
2.800 1.000 1.000 peak 262 spectrum 1 weight 0.10000E+01 volume 0.12315E-02 ppm1 7.310 ppm2 4.452 CV 1
ASSI { 263}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 33 and name HA ))
3.400 1.500 1.500 peak 263 spectrum 1 weight 0.10000E+01 volume 0.86265E-03 ppm1 7.312 ppm2 4.095 CV 1
ASSI { 264}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HG ))
3.700 1.700 1.700 peak 264 spectrum 1 weight 0.10000E+01 volume 0.21053E-02 ppm1 7.310 ppm2 1.462 CV 1
ASSI { 266}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 37 and name HD1%)
4.300 2.300 1.700 peak 266 spectrum 1 weight 0.10000E+01 volume 0.61993E-03 ppm1 7.309 ppm2 0.586 CV 1
ASSI { 269}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB1 ))
4.100 2.100 1.900 peak 269 spectrum 1 weight 0.10000E+01 volume 0.75271E-03 ppm1 7.313 ppm2 1.700 CV 1
ASSI { 272}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 39 and name HN ))
4.700 2.800 1.300 peak 272 spectrum 1 weight 0.10000E+01 volume 0.23110E-03 ppm1 7.312 ppm2 8.333 CV 1
ASSI { 274}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HA ))
4.200 2.200 1.800 peak 274 spectrum 1 weight 0.10000E+01 volume 0.36927E-03 ppm1 7.307 ppm2 5.058 CV 1
ASSI { 276}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HB1 ))
2.100 0.500 0.500 peak 276 spectrum 1 weight 0.10000E+01 volume 0.86842E-02 ppm1 8.852 ppm2 2.068 CV 1
ASSI { 279}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HG2 ))
2.900 1.100 1.100 peak 279 spectrum 1 weight 0.10000E+01 volume 0.11005E-02 ppm1 8.849 ppm2 2.484 CV 1
ASSI { 280}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HN ))
2.600 0.900 0.900 peak 280 spectrum 1 weight 0.10000E+01 volume 0.27266E-02 ppm1 8.848 ppm2 9.241 CV 1
ASSI { 282}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HB2 ))
4.100 2.100 1.900 peak 282 spectrum 1 weight 0.10000E+01 volume 0.14952E-02 ppm1 8.848 ppm2 2.205 CV 1
ASSI { 283}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 7 and name HN ))
2.700 0.900 0.900 peak 283 spectrum 1 weight 0.10000E+01 volume 0.39267E-02 ppm1 8.849 ppm2 7.699 CV 1
ASSI { 284}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HA ))
3.500 1.600 1.600 peak 284 spectrum 1 weight 0.10000E+01 volume 0.94988E-03 ppm1 8.847 ppm2 3.691 CV 1
ASSI { 285}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HA ))
2.400 0.700 0.700 peak 285 spectrum 1 weight 0.10000E+01 volume 0.51558E-02 ppm1 7.594 ppm2 4.143 CV 1
ASSI { 286}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HN ))
2.500 0.800 0.800 peak 286 spectrum 1 weight 0.10000E+01 volume 0.49094E-02 ppm1 7.594 ppm2 8.925 CV 1
ASSI { 287}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 51 and name HA ))
3.600 1.700 1.700 peak 287 spectrum 1 weight 0.10000E+01 volume 0.12892E-02 ppm1 7.594 ppm2 3.968 CV 1
ASSI { 288}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 4 and name HB ))
2.700 0.900 0.900 peak 288 spectrum 1 weight 0.10000E+01 volume 0.31914E-02 ppm1 8.848 ppm2 4.739 CV 1
ASSI { 289}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB2 ))
2.200 0.600 0.600 peak 289 spectrum 1 weight 0.10000E+01 volume 0.88495E-02 ppm1 7.594 ppm2 2.135 CV 1
ASSI { 290}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HG2 ))
2.600 0.900 0.900 peak 290 spectrum 1 weight 0.10000E+01 volume 0.47514E-02 ppm1 7.594 ppm2 2.494 CV 1
ASSI { 292}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 54 and name HN ))
2.300 0.700 0.700 peak 292 spectrum 1 weight 0.10000E+01 volume 0.47834E-02 ppm1 7.594 ppm2 8.164 CV 1
ASSI { 293}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB2 ))
3.000 1.100 1.100 peak 293 spectrum 1 weight 0.10000E+01 volume 0.93113E-02 ppm1 8.848 ppm2 2.096 CV 1
ASSI { 295}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 50 and name HA ))
3.200 1.300 1.300 peak 295 spectrum 1 weight 0.10000E+01 volume 0.14247E-02 ppm1 7.594 ppm2 4.263 CV 1
ASSI { 297}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 4 and name HA ))
5.200 3.400 0.800 peak 297 spectrum 1 weight 0.10000E+01 volume 0.33003E-03 ppm1 8.850 ppm2 4.424 CV 1
ASSI { 298}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 43 and name HB1 ))
3.400 3.400 2.600 peak 298 spectrum 1 weight 0.10000E+01 volume 0.31292E-03 ppm1 6.927 ppm2 3.699 CV 1
ASSI { 300}
(( segid " " and resid 6 and name HN ))
( segid " " and resid 4 and name HG2%)
5.400 3.700 0.600 peak 300 spectrum 1 weight 0.10000E+01 volume 0.32133E-03 ppm1 8.848 ppm2 1.366 CV 1
ASSI { 301}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 9 and name HN ))
4.300 2.300 1.700 peak 301 spectrum 1 weight 0.10000E+01 volume 0.37254E-03 ppm1 8.845 ppm2 8.421 CV 1
ASSI { 302}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 19 and name HD1%)
3.900 1.900 1.900 peak 302 spectrum 1 weight 0.10000E+01 volume 0.75562E-03 ppm1 6.927 ppm2 0.808 CV 1
ASSI { 303}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 43 and name HN ))
4.200 2.200 1.800 peak 303 spectrum 1 weight 0.10000E+01 volume 0.37086E-03 ppm1 6.926 ppm2 8.390 CV 1
ASSI { 309}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 48 and name HN ))
2.700 0.900 0.900 peak 309 spectrum 1 weight 0.10000E+01 volume 0.43263E-02 ppm1 6.926 ppm2 8.029 CV 1
ASSI { 311}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HA ))
3.300 1.400 1.400 peak 311 spectrum 1 weight 0.10000E+01 volume 0.10422E-02 ppm1 6.926 ppm2 3.517 CV 1
ASSI { 313}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 44 and name HN ))
3.900 1.900 1.900 peak 313 spectrum 1 weight 0.10000E+01 volume 0.43309E-03 ppm1 6.927 ppm2 8.607 CV 1
ASSI { 314}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 61 and name HN ))
4.800 2.800 1.200 peak 314 spectrum 1 weight 0.10000E+01 volume 0.24059E-03 ppm1 7.548 ppm2 8.607 CV 1
ASSI { 316}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 16 and name HA ))
4.700 2.800 1.300 peak 316 spectrum 1 weight 0.10000E+01 volume 0.12658E-02 ppm1 8.175 ppm2 3.557 CV 1
ASSI { 317}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 19 and name HG11))
4.000 2.000 2.000 peak 317 spectrum 1 weight 0.10000E+01 volume 0.21161E-02 ppm1 8.174 ppm2 1.345 CV 1
ASSI { 318}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB ))
2.100 2.100 3.900 peak 318 spectrum 1 weight 0.10000E+01 volume 0.10888E-01 ppm1 8.174 ppm2 1.646 CV 1
ASSI { 319}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
2.600 0.800 0.800 peak 319 spectrum 1 weight 0.10000E+01 volume 0.40118E-02 ppm1 8.174 ppm2 3.949 CV 1
ASSI { 320}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 64 and name HG2%)
4.300 2.300 1.700 peak 320 spectrum 1 weight 0.10000E+01 volume 0.94836E-03 ppm1 7.548 ppm2 0.921 CV 1
ASSI { 321}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HB1 ))
2.600 0.800 0.800 peak 321 spectrum 1 weight 0.10000E+01 volume 0.20694E-02 ppm1 8.175 ppm2 2.174 CV 1
ASSI { 322}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 47 and name HG2%)
2.700 0.900 0.900 peak 322 spectrum 1 weight 0.10000E+01 volume 0.22512E-02 ppm1 8.174 ppm2 0.963 CV 1
ASSI { 323}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 18 and name HB2 ))
4.200 2.200 1.800 peak 323 spectrum 1 weight 0.10000E+01 volume 0.22090E-02 ppm1 8.174 ppm2 2.272 CV 1
ASSI { 326}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 19 and name HD1%)
3.300 1.400 1.400 peak 326 spectrum 1 weight 0.10000E+01 volume 0.10311E-02 ppm1 8.174 ppm2 0.794 CV 1
ASSI { 327}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 60 and name HB1 ))
4.200 2.200 1.800 peak 327 spectrum 1 weight 0.10000E+01 volume 0.16661E-02 ppm1 7.548 ppm2 1.918 CV 1
OR { 327}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 60 and name HG1 ))
ASSI { 328}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 60 and name HD2 ))
4.800 2.900 1.200 peak 328 spectrum 1 weight 0.10000E+01 volume 0.41321E-03 ppm1 7.551 ppm2 3.864 CV 1
ASSI { 329}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB1 ))
2.500 0.800 0.800 peak 329 spectrum 1 weight 0.10000E+01 volume 0.61949E-02 ppm1 7.548 ppm2 2.408 CV 1
OR { 329}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB2 ))
ASSI { 330}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HA ))
3.500 1.600 1.600 peak 330 spectrum 1 weight 0.10000E+01 volume 0.10311E-02 ppm1 7.549 ppm2 4.325 CV 1
ASSI { 331}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 60 and name HG2 ))
4.600 2.700 1.400 peak 331 spectrum 1 weight 0.10000E+01 volume 0.91426E-03 ppm1 7.551 ppm2 2.036 CV 1
ASSI { 333}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 76 and name HE% )
5.800 4.200 0.200 peak 333 spectrum 1 weight 0.10000E+01 volume 0.23603E-03 ppm1 7.544 ppm2 6.565 CV 1
ASSI { 334}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HA ))
3.000 1.100 1.100 peak 334 spectrum 1 weight 0.10000E+01 volume 0.21765E-02 ppm1 7.549 ppm2 4.682 CV 1
ASSI { 335}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 64 and name HA ))
4.700 2.800 1.300 peak 335 spectrum 1 weight 0.10000E+01 volume 0.42682E-03 ppm1 7.546 ppm2 3.083 CV 1
ASSI { 336}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 59 and name HD1%)
4.800 2.800 1.200 peak 336 spectrum 1 weight 0.10000E+01 volume 0.64179E-03 ppm1 7.549 ppm2 0.221 CV 1
ASSI { 338}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 28 and name HN ))
4.100 2.100 1.900 peak 338 spectrum 1 weight 0.10000E+01 volume 0.46352E-03 ppm1 7.494 ppm2 6.311 CV 1
ASSI { 339}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 70 and name HG1%)
3.400 1.400 1.400 peak 339 spectrum 1 weight 0.10000E+01 volume 0.10165E-02 ppm1 7.496 ppm2 0.440 CV 1
ASSI { 340}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 32 and name HN ))
4.900 3.000 1.100 peak 340 spectrum 1 weight 0.10000E+01 volume 0.42107E-03 ppm1 7.495 ppm2 10.111 CV 1
ASSI { 341}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 29 and name HA ))
3.800 1.800 1.800 peak 341 spectrum 1 weight 0.10000E+01 volume 0.60602E-03 ppm1 7.498 ppm2 3.569 CV 1
ASSI { 342}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 70 and name HB ))
4.400 2.400 1.600 peak 342 spectrum 1 weight 0.10000E+01 volume 0.99701E-03 ppm1 7.496 ppm2 2.267 CV 1
ASSI { 344}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 71 and name HN ))
4.600 2.600 1.400 peak 344 spectrum 1 weight 0.10000E+01 volume 0.21168E-03 ppm1 7.496 ppm2 9.365 CV 1
ASSI { 346}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HB1 ))
2.700 0.900 0.900 peak 346 spectrum 1 weight 0.10000E+01 volume 0.15006E-02 ppm1 7.496 ppm2 1.809 CV 1
ASSI { 348}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 28 and name HB2 ))
2.600 0.800 0.800 peak 348 spectrum 1 weight 0.10000E+01 volume 0.43666E-02 ppm1 7.496 ppm2 2.075 CV 1
ASSI { 349}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HG2 ))
3.100 1.200 1.200 peak 349 spectrum 1 weight 0.10000E+01 volume 0.95467E-03 ppm1 7.496 ppm2 1.565 CV 1
ASSI { 350}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HA ))
2.800 1.000 1.000 peak 350 spectrum 1 weight 0.10000E+01 volume 0.27558E-02 ppm1 7.495 ppm2 4.371 CV 1
ASSI { 351}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HA ))
3.700 1.700 1.700 peak 351 spectrum 1 weight 0.10000E+01 volume 0.97352E-03 ppm1 7.497 ppm2 4.487 CV 1
ASSI { 352}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 37 and name HD1%)
5.200 3.400 0.800 peak 352 spectrum 1 weight 0.10000E+01 volume 0.46860E-03 ppm1 7.497 ppm2 0.598 CV 1
ASSI { 353}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 70 and name HN ))
4.700 2.800 1.300 peak 353 spectrum 1 weight 0.10000E+01 volume 0.31439E-03 ppm1 7.493 ppm2 8.082 CV 1
ASSI { 355}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HG1 ))
4.200 2.200 1.800 peak 355 spectrum 1 weight 0.10000E+01 volume 0.89946E-03 ppm1 7.498 ppm2 1.508 CV 1
ASSI { 356}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HE2 ))
5.500 3.800 0.500 peak 356 spectrum 1 weight 0.10000E+01 volume 0.38732E-03 ppm1 7.496 ppm2 3.016 CV 1
ASSI { 357}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HD1 ))
3.400 1.500 1.500 peak 357 spectrum 1 weight 0.10000E+01 volume 0.30815E-02 ppm1 7.491 ppm2 1.406 CV 1
ASSI { 358}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HE1 ))
5.500 3.700 0.500 peak 358 spectrum 1 weight 0.10000E+01 volume 0.38732E-03 ppm1 7.498 ppm2 2.988 CV 1
ASSI { 359}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 43 and name HN ))
4.100 2.100 1.900 peak 359 spectrum 1 weight 0.10000E+01 volume 0.42414E-03 ppm1 7.168 ppm2 8.392 CV 1
ASSI { 360}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HB2 ))
4.800 2.800 1.200 peak 360 spectrum 1 weight 0.10000E+01 volume 0.33508E-03 ppm1 7.167 ppm2 2.342 CV 1
OR { 360}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HG1 ))
ASSI { 361}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HA ))
2.500 0.800 0.800 peak 361 spectrum 1 weight 0.10000E+01 volume 0.35174E-02 ppm1 7.168 ppm2 3.519 CV 1
ASSI { 362}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB2 ))
3.100 1.200 1.200 peak 362 spectrum 1 weight 0.10000E+01 volume 0.19720E-02 ppm1 7.168 ppm2 2.007 CV 1
ASSI { 363}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB ))
2.100 0.600 0.600 peak 363 spectrum 1 weight 0.10000E+01 volume 0.81385E-02 ppm1 7.168 ppm2 2.224 CV 1
ASSI { 365}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HN ))
2.900 1.000 1.000 peak 365 spectrum 1 weight 0.10000E+01 volume 0.29612E-02 ppm1 7.168 ppm2 8.617 CV 1
ASSI { 366}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 45 and name HG1%)
3.800 1.800 1.800 peak 366 spectrum 1 weight 0.10000E+01 volume 0.23605E-02 ppm1 7.168 ppm2 0.949 CV 1
ASSI { 367}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HN ))
2.300 0.700 0.700 peak 367 spectrum 1 weight 0.10000E+01 volume 0.43323E-02 ppm1 7.168 ppm2 6.925 CV 1
ASSI { 368}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
3.000 1.100 1.100 peak 368 spectrum 1 weight 0.10000E+01 volume 0.17523E-02 ppm1 7.168 ppm2 4.015 CV 1
ASSI { 369}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB1 ))
3.700 1.700 1.700 peak 369 spectrum 1 weight 0.10000E+01 volume 0.14808E-02 ppm1 7.169 ppm2 1.865 CV 1
ASSI { 370}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 43 and name HA ))
3.400 3.400 2.600 peak 370 spectrum 1 weight 0.10000E+01 volume 0.16316E-02 ppm1 7.168 ppm2 4.289 CV 1
ASSI { 371}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB1 ))
4.700 2.800 1.300 peak 371 spectrum 1 weight 0.10000E+01 volume 0.35381E-03 ppm1 7.497 ppm2 2.599 CV 1
ASSI { 373}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 48 and name HN ))
4.100 2.100 1.900 peak 373 spectrum 1 weight 0.10000E+01 volume 0.53753E-03 ppm1 7.169 ppm2 8.022 CV 1
ASSI { 382}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HG2 ))
4.300 2.400 1.700 peak 382 spectrum 1 weight 0.10000E+01 volume 0.38623E-03 ppm1 10.106 ppm2 1.574 CV 1
ASSI { 384}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 24 and name HG2%)
2.900 1.100 1.100 peak 384 spectrum 1 weight 0.10000E+01 volume 0.29088E-02 ppm1 9.255 ppm2 0.996 CV 1
OR { 384}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 24 and name HG1%)
ASSI { 385}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HG1 ))
3.300 1.400 1.400 peak 385 spectrum 1 weight 0.10000E+01 volume 0.17836E-02 ppm1 9.256 ppm2 2.301 CV 1
OR { 385}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HG2 ))
ASSI { 389}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HN ))
2.800 1.000 1.000 peak 389 spectrum 1 weight 0.10000E+01 volume 0.18687E-02 ppm1 9.255 ppm2 7.794 CV 1
ASSI { 391}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 15 and name HD1%)
5.100 3.200 0.900 peak 391 spectrum 1 weight 0.10000E+01 volume 0.41930E-03 ppm1 7.825 ppm2 0.749 CV 1
ASSI { 392}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HN ))
2.500 0.800 0.800 peak 392 spectrum 1 weight 0.10000E+01 volume 0.46058E-02 ppm1 7.827 ppm2 8.199 CV 1
ASSI { 393}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HA ))
3.200 1.300 1.300 peak 393 spectrum 1 weight 0.10000E+01 volume 0.19869E-02 ppm1 7.827 ppm2 4.062 CV 1
ASSI { 394}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
2.700 0.900 0.900 peak 394 spectrum 1 weight 0.10000E+01 volume 0.39919E-02 ppm1 7.827 ppm2 3.946 CV 1
ASSI { 395}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HB2 ))
2.200 0.600 0.600 peak 395 spectrum 1 weight 0.10000E+01 volume 0.92586E-02 ppm1 7.827 ppm2 2.309 CV 1
ASSI { 396}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 13 and name HB% )
2.400 0.700 0.700 peak 396 spectrum 1 weight 0.10000E+01 volume 0.48551E-02 ppm1 7.827 ppm2 1.697 CV 1
ASSI { 397}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 24 and name HG1%)
3.400 1.400 1.400 peak 397 spectrum 1 weight 0.10000E+01 volume 0.14735E-02 ppm1 7.827 ppm2 0.992 CV 1
ASSI { 398}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HN ))
2.600 0.800 0.800 peak 398 spectrum 1 weight 0.10000E+01 volume 0.46562E-02 ppm1 7.827 ppm2 8.969 CV 1
ASSI { 399}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 12 and name HA ))
3.700 1.800 1.800 peak 399 spectrum 1 weight 0.10000E+01 volume 0.89482E-03 ppm1 7.827 ppm2 4.242 CV 1
ASSI { 400}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HG2 ))
3.600 1.600 1.600 peak 400 spectrum 1 weight 0.10000E+01 volume 0.45701E-02 ppm1 7.827 ppm2 2.637 CV 1
ASSI { 402}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 12 and name HN ))
4.300 2.300 1.700 peak 402 spectrum 1 weight 0.10000E+01 volume 0.44844E-03 ppm1 7.823 ppm2 9.259 CV 1
ASSI { 404}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HD1 ))
5.100 3.300 0.900 peak 404 spectrum 1 weight 0.10000E+01 volume 0.68980E-03 ppm1 8.479 ppm2 1.349 CV 1
ASSI { 405}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 29 and name HD2%)
3.900 1.900 1.900 peak 405 spectrum 1 weight 0.10000E+01 volume 0.13849E-02 ppm1 8.478 ppm2 0.896 CV 1
ASSI { 406}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA ))
2.400 0.700 0.700 peak 406 spectrum 1 weight 0.10000E+01 volume 0.57508E-02 ppm1 8.478 ppm2 4.645 CV 1
ASSI { 407}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB2 ))
3.500 1.500 1.500 peak 407 spectrum 1 weight 0.10000E+01 volume 0.28997E-02 ppm1 8.478 ppm2 2.084 CV 1
ASSI { 408}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB2 ))
2.100 0.600 0.600 peak 408 spectrum 1 weight 0.10000E+01 volume 0.78336E-02 ppm1 8.478 ppm2 1.760 CV 1
ASSI { 410}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HN ))
3.200 1.300 1.300 peak 410 spectrum 1 weight 0.10000E+01 volume 0.99553E-03 ppm1 8.478 ppm2 8.336 CV 1
ASSI { 411}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HG1 ))
3.600 1.700 1.700 peak 411 spectrum 1 weight 0.10000E+01 volume 0.16403E-02 ppm1 7.799 ppm2 2.316 CV 1
OR { 411}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HG2 ))
ASSI { 412}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HA ))
3.900 1.900 1.900 peak 412 spectrum 1 weight 0.10000E+01 volume 0.43970E-03 ppm1 7.788 ppm2 3.625 CV 1
ASSI { 413}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 24 and name HG1%)
2.600 2.600 3.400 peak 413 spectrum 1 weight 0.10000E+01 volume 0.14375E-02 ppm1 7.792 ppm2 0.979 CV 1
ASSI { 415}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB1 ))
3.400 1.400 1.400 peak 415 spectrum 1 weight 0.10000E+01 volume 0.36516E-02 ppm1 7.791 ppm2 2.663 CV 1
ASSI { 416}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HA ))
3.200 1.300 1.300 peak 416 spectrum 1 weight 0.10000E+01 volume 0.15275E-02 ppm1 7.790 ppm2 4.633 CV 1
ASSI { 417}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 70 and name HG2%)
4.700 2.700 1.300 peak 417 spectrum 1 weight 0.10000E+01 volume 0.34698E-03 ppm1 8.478 ppm2 0.636 CV 1
ASSI { 419}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 23 and name HB1 ))
4.600 2.600 1.400 peak 419 spectrum 1 weight 0.10000E+01 volume 0.10679E-02 ppm1 7.791 ppm2 1.760 CV 1
ASSI { 420}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HA ))
3.600 1.700 1.700 peak 420 spectrum 1 weight 0.10000E+01 volume 0.87015E-03 ppm1 7.793 ppm2 4.052 CV 1
ASSI { 421}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB2 ))
3.700 1.800 1.800 peak 421 spectrum 1 weight 0.10000E+01 volume 0.77097E-03 ppm1 7.793 ppm2 2.005 CV 1
OR { 421}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB1 ))
ASSI { 422}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HN ))
2.600 0.900 0.900 peak 422 spectrum 1 weight 0.10000E+01 volume 0.32445E-02 ppm1 7.982 ppm2 8.762 CV 1
ASSI { 424}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 74 and name HA ))
4.500 2.500 1.500 peak 424 spectrum 1 weight 0.10000E+01 volume 0.30804E-03 ppm1 7.964 ppm2 3.682 CV 1
ASSI { 427}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HB1 ))
2.700 0.900 0.900 peak 427 spectrum 1 weight 0.10000E+01 volume 0.35308E-02 ppm1 7.981 ppm2 2.445 CV 1
ASSI { 429}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 40 and name HN ))
4.300 2.300 1.700 peak 429 spectrum 1 weight 0.10000E+01 volume 0.74097E-03 ppm1 8.395 ppm2 8.145 CV 1
ASSI { 430}
(( segid " " and resid 35 and name HN ))
( segid " " and resid 34 and name HG2%)
4.400 2.400 1.600 peak 430 spectrum 1 weight 0.10000E+01 volume 0.10319E-02 ppm1 7.981 ppm2 1.301 CV 1
ASSI { 431}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 32 and name HB1 ))
3.000 1.100 1.100 peak 431 spectrum 1 weight 0.10000E+01 volume 0.16122E-02 ppm1 7.980 ppm2 3.861 CV 1
ASSI { 433}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HB2 ))
3.100 1.200 1.200 peak 433 spectrum 1 weight 0.10000E+01 volume 0.18634E-02 ppm1 7.981 ppm2 2.779 CV 1
ASSI { 435}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HB1 ))
2.700 0.900 0.900 peak 435 spectrum 1 weight 0.10000E+01 volume 0.48561E-02 ppm1 7.965 ppm2 1.947 CV 1
OR { 435}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HB2 ))
ASSI { 436}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HA ))
3.100 1.200 1.200 peak 436 spectrum 1 weight 0.10000E+01 volume 0.20432E-02 ppm1 7.981 ppm2 4.612 CV 1
ASSI { 437}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HA ))
2.600 0.900 0.900 peak 437 spectrum 1 weight 0.10000E+01 volume 0.52248E-02 ppm1 7.965 ppm2 4.176 CV 1
ASSI { 438}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HA ))
3.300 1.300 1.300 peak 438 spectrum 1 weight 0.10000E+01 volume 0.12485E-02 ppm1 7.964 ppm2 3.936 CV 1
ASSI { 439}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 39 and name HG1%)
4.400 2.500 1.600 peak 439 spectrum 1 weight 0.10000E+01 volume 0.72607E-03 ppm1 8.397 ppm2 0.830 CV 1
ASSI { 442}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
2.700 0.900 0.900 peak 442 spectrum 1 weight 0.10000E+01 volume 0.42930E-02 ppm1 8.398 ppm2 4.301 CV 1
ASSI { 443}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HB1 ))
2.800 1.000 1.000 peak 443 spectrum 1 weight 0.10000E+01 volume 0.23848E-02 ppm1 8.398 ppm2 1.640 CV 1
ASSI { 444}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB2 ))
2.200 0.600 0.600 peak 444 spectrum 1 weight 0.10000E+01 volume 0.62166E-02 ppm1 8.398 ppm2 4.016 CV 1
ASSI { 445}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HB2 ))
3.500 1.500 1.500 peak 445 spectrum 1 weight 0.10000E+01 volume 0.38671E-02 ppm1 8.397 ppm2 1.873 CV 1
ASSI { 446}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 77 and name HN ))
2.400 0.700 0.700 peak 446 spectrum 1 weight 0.10000E+01 volume 0.45665E-02 ppm1 7.964 ppm2 8.477 CV 1
ASSI { 448}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB1 ))
3.300 1.400 1.400 peak 448 spectrum 1 weight 0.10000E+01 volume 0.24223E-02 ppm1 8.398 ppm2 3.719 CV 1
ASSI { 449}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HN ))
2.500 0.800 0.800 peak 449 spectrum 1 weight 0.10000E+01 volume 0.42047E-02 ppm1 8.397 ppm2 8.624 CV 1
ASSI { 450}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HN ))
2.600 0.800 0.800 peak 450 spectrum 1 weight 0.10000E+01 volume 0.36040E-02 ppm1 7.963 ppm2 8.164 CV 1
ASSI { 451}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 32 and name HN ))
5.500 3.800 0.500 peak 451 spectrum 1 weight 0.10000E+01 volume 0.23075E-03 ppm1 7.986 ppm2 10.115 CV 1
ASSI { 452}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 37 and name HN ))
4.100 2.100 1.900 peak 452 spectrum 1 weight 0.10000E+01 volume 0.43336E-03 ppm1 7.984 ppm2 7.321 CV 1
ASSI { 453}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 36 and name HN ))
2.700 0.900 0.900 peak 453 spectrum 1 weight 0.10000E+01 volume 0.27772E-02 ppm1 7.983 ppm2 7.808 CV 1
ASSI { 454}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HA ))
4.300 2.300 1.700 peak 454 spectrum 1 weight 0.10000E+01 volume 0.29805E-03 ppm1 8.161 ppm2 4.143 CV 1
ASSI { 459}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HB1 ))
2.900 1.100 1.100 peak 459 spectrum 1 weight 0.10000E+01 volume 0.17063E-02 ppm1 8.159 ppm2 1.078 CV 1
ASSI { 460}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 15 and name HD1%)
6.000 4.700 0.000 peak 460 spectrum 1 weight 0.10000E+01 volume 0.12112E-03 ppm1 8.146 ppm2 0.760 CV 1
ASSI { 464}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HB ))
2.500 0.800 0.800 peak 464 spectrum 1 weight 0.10000E+01 volume 0.45298E-02 ppm1 8.922 ppm2 2.264 CV 1
ASSI { 465}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 16 and name HG1%)
4.100 2.100 1.900 peak 465 spectrum 1 weight 0.10000E+01 volume 0.15630E-02 ppm1 8.922 ppm2 0.996 CV 1
ASSI { 467}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 16 and name HG2%)
2.400 0.800 0.800 peak 467 spectrum 1 weight 0.10000E+01 volume 0.40079E-02 ppm1 8.921 ppm2 1.188 CV 1
ASSI { 468}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HA ))
2.900 1.100 1.100 peak 468 spectrum 1 weight 0.10000E+01 volume 0.17191E-02 ppm1 8.922 ppm2 3.558 CV 1
ASSI { 471}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 13 and name HA ))
3.600 1.600 1.600 peak 471 spectrum 1 weight 0.10000E+01 volume 0.52752E-03 ppm1 8.923 ppm2 4.052 CV 1
ASSI { 472}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 12 and name HA ))
4.400 2.400 1.600 peak 472 spectrum 1 weight 0.10000E+01 volume 0.34187E-03 ppm1 8.922 ppm2 4.248 CV 1
ASSI { 473}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA ))
4.200 2.200 1.800 peak 473 spectrum 1 weight 0.10000E+01 volume 0.32838E-03 ppm1 8.924 ppm2 3.804 CV 1
ASSI { 474}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 54 and name HN ))
4.300 2.300 1.700 peak 474 spectrum 1 weight 0.10000E+01 volume 0.29542E-03 ppm1 8.924 ppm2 8.164 CV 1
ASSI { 475}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 53 and name HG1 ))
3.700 1.700 1.700 peak 475 spectrum 1 weight 0.10000E+01 volume 0.26512E-02 ppm1 8.924 ppm2 2.319 CV 1
ASSI { 477}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 59 and name HG2%)
4.900 3.100 1.100 peak 477 spectrum 1 weight 0.10000E+01 volume 0.54567E-03 ppm1 8.925 ppm2 0.628 CV 1
ASSI { 478}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 49 and name HA ))
3.400 1.500 1.500 peak 478 spectrum 1 weight 0.10000E+01 volume 0.24000E-02 ppm1 8.924 ppm2 3.980 CV 1
ASSI { 480}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 51 and name HB% )
2.500 0.800 0.800 peak 480 spectrum 1 weight 0.10000E+01 volume 0.40209E-02 ppm1 8.924 ppm2 1.522 CV 1
ASSI { 484}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 53 and name HG2 ))
3.500 1.500 1.500 peak 484 spectrum 1 weight 0.10000E+01 volume 0.62516E-02 ppm1 8.924 ppm2 2.504 CV 1
ASSI { 485}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 54 and name HG2 ))
3.300 1.300 1.300 peak 485 spectrum 1 weight 0.10000E+01 volume 0.97791E-03 ppm1 8.924 ppm2 0.860 CV 1
ASSI { 487}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HA ))
2.600 0.800 0.800 peak 487 spectrum 1 weight 0.10000E+01 volume 0.37239E-02 ppm1 8.924 ppm2 4.174 CV 1
ASSI { 494}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 50 and name HN ))
4.700 2.800 1.300 peak 494 spectrum 1 weight 0.10000E+01 volume 0.32748E-03 ppm1 8.923 ppm2 7.809 CV 1
ASSI { 496}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 45 and name HB ))
3.100 3.100 2.900 peak 496 spectrum 1 weight 0.10000E+01 volume 0.37267E-02 ppm1 8.183 ppm2 2.226 CV 1
ASSI { 497}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 49 and name HG2%)
3.400 1.400 1.400 peak 497 spectrum 1 weight 0.10000E+01 volume 0.50393E-02 ppm1 8.183 ppm2 1.113 CV 1
ASSI { 499}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HB ))
2.400 0.700 0.700 peak 499 spectrum 1 weight 0.10000E+01 volume 0.48950E-02 ppm1 8.183 ppm2 2.062 CV 1
ASSI { 500}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HA ))
2.600 0.800 0.800 peak 500 spectrum 1 weight 0.10000E+01 volume 0.32036E-02 ppm1 8.183 ppm2 4.004 CV 1
ASSI { 501}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 49 and name HG1%)
3.700 1.700 1.700 peak 501 spectrum 1 weight 0.10000E+01 volume 0.18129E-02 ppm1 8.183 ppm2 0.996 CV 1
ASSI { 504}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 51 and name HN ))
4.400 2.400 1.600 peak 504 spectrum 1 weight 0.10000E+01 volume 0.29662E-03 ppm1 8.184 ppm2 8.898 CV 1
ASSI { 506}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 45 and name HA ))
4.100 2.100 1.900 peak 506 spectrum 1 weight 0.10000E+01 volume 0.28496E-03 ppm1 8.183 ppm2 3.511 CV 1
ASSI { 507}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 34 and name HG2%)
4.800 2.900 1.200 peak 507 spectrum 1 weight 0.10000E+01 volume 0.36689E-03 ppm1 8.320 ppm2 1.304 CV 1
ASSI { 509}
(( segid " " and resid 10 and name HN ))
( segid " " and resid 9 and name HG1%)
3.100 1.200 1.200 peak 509 spectrum 1 weight 0.10000E+01 volume 0.22281E-02 ppm1 7.742 ppm2 0.899 CV 1
ASSI { 510}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HA ))
3.500 1.500 1.500 peak 510 spectrum 1 weight 0.10000E+01 volume 0.10367E-02 ppm1 7.742 ppm2 3.386 CV 1
ASSI { 511}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.400 1.400 1.400 peak 511 spectrum 1 weight 0.10000E+01 volume 0.62013E-03 ppm1 8.321 ppm2 2.298 CV 1
ASSI { 513}
(( segid " " and resid 10 and name HN ))
( segid " " and resid 10 and name HB% )
2.300 0.700 0.700 peak 513 spectrum 1 weight 0.10000E+01 volume 0.11539E-01 ppm1 7.742 ppm2 1.528 CV 1
ASSI { 514}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HA ))
2.700 0.900 0.900 peak 514 spectrum 1 weight 0.10000E+01 volume 0.47035E-02 ppm1 7.742 ppm2 4.226 CV 1
ASSI { 515}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HB ))
2.700 0.900 0.900 peak 515 spectrum 1 weight 0.10000E+01 volume 0.45092E-02 ppm1 7.742 ppm2 2.018 CV 1
ASSI { 516}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HA ))
2.900 1.000 1.000 peak 516 spectrum 1 weight 0.10000E+01 volume 0.24727E-02 ppm1 8.320 ppm2 4.002 CV 1
ASSI { 518}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HB2 ))
4.000 2.000 2.000 peak 518 spectrum 1 weight 0.10000E+01 volume 0.75365E-03 ppm1 8.321 ppm2 3.170 CV 1
ASSI { 519}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB ))
2.100 0.600 0.600 peak 519 spectrum 1 weight 0.10000E+01 volume 0.62808E-02 ppm1 8.321 ppm2 1.986 CV 1
ASSI { 520}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 39 and name HG2%)
3.200 1.200 1.200 peak 520 spectrum 1 weight 0.10000E+01 volume 0.53008E-02 ppm1 8.321 ppm2 0.945 CV 1
ASSI { 521}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 34 and name HA ))
2.400 0.700 0.700 peak 521 spectrum 1 weight 0.10000E+01 volume 0.68023E-02 ppm1 8.321 ppm2 4.333 CV 1
ASSI { 522}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 39 and name HG1%)
3.400 1.400 1.400 peak 522 spectrum 1 weight 0.10000E+01 volume 0.12763E-02 ppm1 8.322 ppm2 0.827 CV 1
ASSI { 523}
(( segid " " and resid 10 and name HN ))
( segid " " and resid 9 and name HG2%)
4.300 2.300 1.700 peak 523 spectrum 1 weight 0.10000E+01 volume 0.11836E-02 ppm1 7.741 ppm2 1.053 CV 1
ASSI { 524}
(( segid " " and resid 10 and name HN ))
( segid " " and resid 8 and name HD1%)
5.200 3.300 0.800 peak 524 spectrum 1 weight 0.10000E+01 volume 0.24515E-03 ppm1 7.741 ppm2 0.578 CV 1
ASSI { 525}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 12 and name HN ))
4.500 2.500 1.500 peak 525 spectrum 1 weight 0.10000E+01 volume 0.37394E-03 ppm1 7.741 ppm2 9.256 CV 1
ASSI { 527}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 21 and name HA1 ))
4.100 2.100 1.900 peak 527 spectrum 1 weight 0.10000E+01 volume 0.11658E-02 ppm1 8.689 ppm2 3.950 CV 1
ASSI { 528}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HB ))
2.600 0.900 0.900 peak 528 spectrum 1 weight 0.10000E+01 volume 0.26383E-02 ppm1 8.699 ppm2 1.641 CV 1
ASSI { 529}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HA ))
3.100 1.200 1.200 peak 529 spectrum 1 weight 0.10000E+01 volume 0.20043E-02 ppm1 8.698 ppm2 4.812 CV 1
ASSI { 531}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HN ))
2.700 0.900 0.900 peak 531 spectrum 1 weight 0.10000E+01 volume 0.25576E-02 ppm1 8.690 ppm2 8.182 CV 1
ASSI { 534}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 19 and name HD1%)
5.300 3.600 0.700 peak 534 spectrum 1 weight 0.10000E+01 volume 0.38571E-03 ppm1 8.689 ppm2 0.816 CV 1
ASSI { 536}
(( segid " " and resid 56 and name HN ))
( segid " " and resid 55 and name HD% )
5.100 3.300 0.900 peak 536 spectrum 1 weight 0.10000E+01 volume 0.41872E-03 ppm1 7.868 ppm2 7.471 CV 1
ASSI { 537}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 54 and name HA ))
4.000 2.000 2.000 peak 537 spectrum 1 weight 0.10000E+01 volume 0.37480E-03 ppm1 7.872 ppm2 3.952 CV 1
ASSI { 538}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HA ))
3.300 1.400 1.400 peak 538 spectrum 1 weight 0.10000E+01 volume 0.12679E-02 ppm1 7.869 ppm2 4.874 CV 1
ASSI { 540}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HB2 ))
4.200 2.300 1.800 peak 540 spectrum 1 weight 0.10000E+01 volume 0.55929E-03 ppm1 7.871 ppm2 3.441 CV 1
ASSI { 541}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 53 and name HA ))
3.700 1.700 1.700 peak 541 spectrum 1 weight 0.10000E+01 volume 0.84627E-03 ppm1 7.869 ppm2 4.148 CV 1
ASSI { 542}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HB2 ))
2.300 0.700 0.700 peak 542 spectrum 1 weight 0.10000E+01 volume 0.39211E-02 ppm1 9.234 ppm2 2.189 CV 1
ASSI { 544}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
2.600 0.900 0.900 peak 544 spectrum 1 weight 0.10000E+01 volume 0.58081E-02 ppm1 9.235 ppm2 4.425 CV 1
ASSI { 545}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HB1 ))
2.500 0.800 0.800 peak 545 spectrum 1 weight 0.10000E+01 volume 0.33528E-02 ppm1 9.235 ppm2 2.051 CV 1
ASSI { 546}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HB ))
2.400 0.700 0.700 peak 546 spectrum 1 weight 0.10000E+01 volume 0.50240E-02 ppm1 9.235 ppm2 4.739 CV 1
ASSI { 547}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HA ))
2.400 0.700 0.700 peak 547 spectrum 1 weight 0.10000E+01 volume 0.72173E-02 ppm1 7.869 ppm2 4.528 CV 1
ASSI { 548}
(( segid " " and resid 5 and name HN ))
( segid " " and resid 78 and name HD1%)
3.200 1.300 1.300 peak 548 spectrum 1 weight 0.10000E+01 volume 0.15395E-02 ppm1 9.235 ppm2 0.820 CV 1
ASSI { 551}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HB1 ))
4.300 2.300 1.700 peak 551 spectrum 1 weight 0.10000E+01 volume 0.68837E-03 ppm1 7.867 ppm2 2.753 CV 1
ASSI { 552}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HB1 ))
4.000 2.000 2.000 peak 552 spectrum 1 weight 0.10000E+01 volume 0.16650E-02 ppm1 7.869 ppm2 2.579 CV 1
ASSI { 554}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 78 and name HA ))
3.700 1.700 1.700 peak 554 spectrum 1 weight 0.10000E+01 volume 0.61633E-03 ppm1 7.883 ppm2 3.892 CV 1
ASSI { 555}
(( segid " " and resid 81 and name HN ))
( segid " " and resid 57 and name HG1%)
3.900 1.900 1.900 peak 555 spectrum 1 weight 0.10000E+01 volume 0.13497E-02 ppm1 7.883 ppm2 0.968 CV 1
ASSI { 556}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HB2 ))
4.200 2.200 1.800 peak 556 spectrum 1 weight 0.10000E+01 volume 0.60212E-03 ppm1 7.884 ppm2 3.624 CV 1
ASSI { 557}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HG1 ))
3.000 1.100 1.100 peak 557 spectrum 1 weight 0.10000E+01 volume 0.37155E-02 ppm1 7.882 ppm2 2.571 CV 1
ASSI { 558}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 77 and name HA ))
4.000 2.000 2.000 peak 558 spectrum 1 weight 0.10000E+01 volume 0.68921E-03 ppm1 7.884 ppm2 3.534 CV 1
ASSI { 559}
(( segid " " and resid 81 and name HN ))
( segid " " and resid 77 and name HG2%)
4.000 2.000 2.000 peak 559 spectrum 1 weight 0.10000E+01 volume 0.77689E-03 ppm1 7.883 ppm2 0.542 CV 1
ASSI { 560}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HA ))
2.500 0.800 0.800 peak 560 spectrum 1 weight 0.10000E+01 volume 0.40044E-02 ppm1 7.883 ppm2 4.457 CV 1
ASSI { 561}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HN ))
2.300 0.700 0.700 peak 561 spectrum 1 weight 0.10000E+01 volume 0.68719E-02 ppm1 7.883 ppm2 7.722 CV 1
ASSI { 562}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HB1 ))
2.400 0.700 0.700 peak 562 spectrum 1 weight 0.10000E+01 volume 0.44734E-02 ppm1 7.883 ppm2 2.142 CV 1
ASSI { 563}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HG2 ))
2.400 0.700 0.700 peak 563 spectrum 1 weight 0.10000E+01 volume 0.54503E-02 ppm1 7.884 ppm2 2.718 CV 1
ASSI { 564}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HB2 ))
3.400 1.400 1.400 peak 564 spectrum 1 weight 0.10000E+01 volume 0.35644E-02 ppm1 7.884 ppm2 2.351 CV 1
ASSI { 565}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 9 and name HG2%)
2.700 0.900 0.900 peak 565 spectrum 1 weight 0.10000E+01 volume 0.79900E-02 ppm1 8.438 ppm2 1.052 CV 1
ASSI { 566}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HA ))
3.200 1.300 1.300 peak 566 spectrum 1 weight 0.10000E+01 volume 0.16231E-02 ppm1 7.883 ppm2 4.685 CV 1
ASSI { 567}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HB ))
2.200 0.600 0.600 peak 567 spectrum 1 weight 0.10000E+01 volume 0.59280E-02 ppm1 8.438 ppm2 2.018 CV 1
ASSI { 568}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HA ))
2.800 0.900 0.900 peak 568 spectrum 1 weight 0.10000E+01 volume 0.29665E-02 ppm1 8.438 ppm2 3.388 CV 1
ASSI { 569}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 9 and name HG1%)
4.000 2.000 2.000 peak 569 spectrum 1 weight 0.10000E+01 volume 0.18556E-02 ppm1 8.438 ppm2 0.894 CV 1
ASSI { 570}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 10 and name HN ))
2.500 0.800 0.800 peak 570 spectrum 1 weight 0.10000E+01 volume 0.41695E-02 ppm1 8.438 ppm2 7.741 CV 1
ASSI { 571}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HB ))
3.000 1.100 1.100 peak 571 spectrum 1 weight 0.10000E+01 volume 0.42474E-02 ppm1 8.438 ppm2 1.762 CV 1
ASSI { 572}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 82 and name HN ))
4.300 2.300 1.700 peak 572 spectrum 1 weight 0.10000E+01 volume 0.11114E-02 ppm1 7.885 ppm2 8.322 CV 1
ASSI { 574}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 10 and name HB% )
4.500 2.500 1.500 peak 574 spectrum 1 weight 0.10000E+01 volume 0.97969E-03 ppm1 8.439 ppm2 1.529 CV 1
ASSI { 575}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 8 and name HD1%)
3.800 1.800 1.800 peak 575 spectrum 1 weight 0.10000E+01 volume 0.16524E-02 ppm1 8.439 ppm2 0.578 CV 1
ASSI { 577}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HA ))
3.900 1.900 1.900 peak 577 spectrum 1 weight 0.10000E+01 volume 0.65294E-03 ppm1 7.695 ppm2 3.942 CV 1
ASSI { 581}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 8 and name HB ))
5.100 3.200 0.900 peak 581 spectrum 1 weight 0.10000E+01 volume 0.33617E-03 ppm1 7.692 ppm2 1.760 CV 1
ASSI { 583}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HB2 ))
3.400 1.400 1.400 peak 583 spectrum 1 weight 0.10000E+01 volume 0.27858E-02 ppm1 7.694 ppm2 2.107 CV 1
ASSI { 584}
(( segid " " and resid 7 and name HN ))
( segid " " and resid 4 and name HG2%)
3.500 1.500 1.500 peak 584 spectrum 1 weight 0.10000E+01 volume 0.29420E-03 ppm1 7.697 ppm2 1.368 CV 1
ASSI { 585}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HA ))
3.000 1.100 1.100 peak 585 spectrum 1 weight 0.10000E+01 volume 0.19576E-02 ppm1 7.695 ppm2 4.141 CV 1
ASSI { 586}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 4 and name HB ))
3.800 1.800 1.800 peak 586 spectrum 1 weight 0.10000E+01 volume 0.50808E-03 ppm1 7.694 ppm2 4.752 CV 1
ASSI { 588}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 8 and name HN ))
2.700 0.900 0.900 peak 588 spectrum 1 weight 0.10000E+01 volume 0.28031E-02 ppm1 7.695 ppm2 8.410 CV 1
ASSI { 591}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 16 and name HG2%)
4.400 2.400 1.600 peak 591 spectrum 1 weight 0.10000E+01 volume 0.93982E-03 ppm1 8.689 ppm2 1.191 CV 1
ASSI { 592}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA ))
3.700 1.700 1.700 peak 592 spectrum 1 weight 0.10000E+01 volume 0.82416E-03 ppm1 8.274 ppm2 4.637 CV 1
ASSI { 593}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 15 and name HA ))
3.300 1.300 1.300 peak 593 spectrum 1 weight 0.10000E+01 volume 0.12843E-02 ppm1 8.274 ppm2 3.804 CV 1
ASSI { 594}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HA ))
3.600 1.600 1.600 peak 594 spectrum 1 weight 0.10000E+01 volume 0.73771E-03 ppm1 8.690 ppm2 3.563 CV 1
ASSI { 595}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HB1 ))
2.900 1.000 1.000 peak 595 spectrum 1 weight 0.10000E+01 volume 0.47979E-02 ppm1 8.274 ppm2 2.185 CV 1
ASSI { 596}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HA ))
2.600 0.800 0.800 peak 596 spectrum 1 weight 0.10000E+01 volume 0.60661E-02 ppm1 8.274 ppm2 3.951 CV 1
ASSI { 598}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HN ))
2.600 0.800 0.800 peak 598 spectrum 1 weight 0.10000E+01 volume 0.42001E-02 ppm1 8.274 ppm2 8.696 CV 1
ASSI { 600}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HB1 ))
2.500 0.800 0.800 peak 600 spectrum 1 weight 0.10000E+01 volume 0.67120E-02 ppm1 8.688 ppm2 2.769 CV 1
ASSI { 601}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HB2 ))
2.500 0.800 0.800 peak 601 spectrum 1 weight 0.10000E+01 volume 0.51987E-02 ppm1 8.688 ppm2 3.104 CV 1
ASSI { 602}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HB2 ))
2.200 0.600 0.600 peak 602 spectrum 1 weight 0.10000E+01 volume 0.94372E-02 ppm1 8.274 ppm2 2.277 CV 1
ASSI { 603}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HB1 ))
2.600 0.900 0.900 peak 603 spectrum 1 weight 0.10000E+01 volume 0.41097E-02 ppm1 8.274 ppm2 2.768 CV 1
ASSI { 604}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
2.500 0.800 0.800 peak 604 spectrum 1 weight 0.10000E+01 volume 0.37465E-02 ppm1 8.688 ppm2 8.929 CV 1
ASSI { 605}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA ))
2.900 1.100 1.100 peak 605 spectrum 1 weight 0.10000E+01 volume 0.29042E-02 ppm1 8.688 ppm2 4.634 CV 1
ASSI { 606}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HB ))
2.600 0.900 0.900 peak 606 spectrum 1 weight 0.10000E+01 volume 0.37129E-02 ppm1 8.688 ppm2 2.266 CV 1
ASSI { 608}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HB2 ))
3.900 1.900 1.900 peak 608 spectrum 1 weight 0.10000E+01 volume 0.16140E-02 ppm1 8.274 ppm2 3.103 CV 1
ASSI { 609}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 14 and name HA ))
3.200 1.300 1.300 peak 609 spectrum 1 weight 0.10000E+01 volume 0.16889E-02 ppm1 8.689 ppm2 3.951 CV 1
ASSI { 613}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HA ))
2.800 1.000 1.000 peak 613 spectrum 1 weight 0.10000E+01 volume 0.25160E-02 ppm1 8.153 ppm2 3.943 CV 1
ASSI { 614}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 72 and name HA ))
3.800 1.800 1.800 peak 614 spectrum 1 weight 0.10000E+01 volume 0.73229E-03 ppm1 8.151 ppm2 4.524 CV 1
ASSI { 615}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HA ))
3.700 1.700 1.700 peak 615 spectrum 1 weight 0.10000E+01 volume 0.73100E-03 ppm1 8.153 ppm2 3.680 CV 1
ASSI { 616}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HB ))
2.600 0.800 0.800 peak 616 spectrum 1 weight 0.10000E+01 volume 0.40425E-02 ppm1 8.153 ppm2 4.187 CV 1
ASSI { 617}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HB1 ))
3.100 1.200 1.200 peak 617 spectrum 1 weight 0.10000E+01 volume 0.64456E-02 ppm1 8.153 ppm2 1.932 CV 1
ASSI { 619}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HB2 ))
2.200 0.600 0.600 peak 619 spectrum 1 weight 0.10000E+01 volume 0.64456E-02 ppm1 8.148 ppm2 1.972 CV 1
ASSI { 620}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HD2 ))
4.400 2.400 1.600 peak 620 spectrum 1 weight 0.10000E+01 volume 0.89107E-03 ppm1 8.152 ppm2 1.506 CV 1
ASSI { 621}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HD1 ))
3.700 1.700 1.700 peak 621 spectrum 1 weight 0.10000E+01 volume 0.95319E-03 ppm1 8.152 ppm2 1.470 CV 1
ASSI { 622}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 78 and name HD1%)
4.000 2.000 2.000 peak 622 spectrum 1 weight 0.10000E+01 volume 0.63755E-03 ppm1 8.154 ppm2 0.819 CV 1
OR { 622}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 78 and name HD2%)
ASSI { 624}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 74 and name HG2%)
4.000 2.000 2.000 peak 624 spectrum 1 weight 0.10000E+01 volume 0.12347E-02 ppm1 8.154 ppm2 1.090 CV 1
ASSI { 631}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HG2%)
3.400 1.500 1.500 peak 631 spectrum 1 weight 0.10000E+01 volume 0.23688E-02 ppm1 6.412 ppm2 0.998 CV 1
ASSI { 634}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 20 and name HN ))
4.400 2.500 1.600 peak 634 spectrum 1 weight 0.10000E+01 volume 0.93730E-03 ppm1 6.413 ppm2 8.695 CV 1
ASSI { 638}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 22 and name HG12))
2.200 0.600 0.600 peak 638 spectrum 1 weight 0.10000E+01 volume 0.40649E-02 ppm1 6.413 ppm2 1.319 CV 1
ASSI { 639}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HA ))
3.900 1.900 1.900 peak 639 spectrum 1 weight 0.10000E+01 volume 0.47853E-03 ppm1 8.515 ppm2 3.522 CV 1
ASSI { 642}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HA ))
3.000 1.100 1.100 peak 642 spectrum 1 weight 0.10000E+01 volume 0.19401E-02 ppm1 8.468 ppm2 3.533 CV 1
ASSI { 644}
(( segid " " and resid 77 and name HN ))
( segid " " and resid 77 and name HG2%)
3.800 1.800 1.800 peak 644 spectrum 1 weight 0.10000E+01 volume 0.19662E-02 ppm1 8.469 ppm2 0.549 CV 1
ASSI { 646}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 78 and name HD2%)
4.100 2.100 1.900 peak 646 spectrum 1 weight 0.10000E+01 volume 0.11760E-02 ppm1 8.516 ppm2 0.823 CV 1
OR { 646}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 78 and name HD1%)
ASSI { 647}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HB ))
2.300 0.600 0.600 peak 647 spectrum 1 weight 0.10000E+01 volume 0.53808E-02 ppm1 8.468 ppm2 1.802 CV 1
ASSI { 648}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HG11))
2.500 0.800 0.800 peak 648 spectrum 1 weight 0.10000E+01 volume 0.38131E-02 ppm1 8.468 ppm2 2.021 CV 1
ASSI { 649}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 15 and name HD1%)
4.000 2.000 2.000 peak 649 spectrum 1 weight 0.10000E+01 volume 0.18032E-02 ppm1 8.195 ppm2 0.764 CV 1
ASSI { 650}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HB2 ))
3.500 1.600 1.600 peak 650 spectrum 1 weight 0.10000E+01 volume 0.32522E-02 ppm1 8.468 ppm2 3.117 CV 1
ASSI { 652}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HG12))
3.700 1.700 1.700 peak 652 spectrum 1 weight 0.10000E+01 volume 0.22895E-02 ppm1 8.468 ppm2 0.949 CV 1
ASSI { 654}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
3.700 1.700 1.700 peak 654 spectrum 1 weight 0.10000E+01 volume 0.70258E-03 ppm1 8.196 ppm2 3.956 CV 1
ASSI { 655}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 15 and name HG2%)
3.200 1.300 1.300 peak 655 spectrum 1 weight 0.10000E+01 volume 0.34890E-02 ppm1 8.195 ppm2 1.074 CV 1
ASSI { 656}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HB2 ))
3.700 1.700 1.700 peak 656 spectrum 1 weight 0.10000E+01 volume 0.23844E-02 ppm1 8.195 ppm2 2.298 CV 1
ASSI { 660}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HA ))
2.600 0.800 0.800 peak 660 spectrum 1 weight 0.10000E+01 volume 0.26834E-02 ppm1 8.517 ppm2 3.906 CV 1
ASSI { 661}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HG12))
3.400 1.400 1.400 peak 661 spectrum 1 weight 0.10000E+01 volume 0.40101E-02 ppm1 8.195 ppm2 1.975 CV 1
ASSI { 662}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA ))
3.000 1.100 1.100 peak 662 spectrum 1 weight 0.10000E+01 volume 0.23244E-02 ppm1 8.196 ppm2 3.806 CV 1
ASSI { 664}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HB ))
2.200 0.600 0.600 peak 664 spectrum 1 weight 0.10000E+01 volume 0.65679E-02 ppm1 8.195 ppm2 2.129 CV 1
ASSI { 666}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 12 and name HA ))
3.400 1.400 1.400 peak 666 spectrum 1 weight 0.10000E+01 volume 0.13756E-02 ppm1 8.194 ppm2 4.256 CV 1
ASSI { 667}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 16 and name HN ))
2.600 0.800 0.800 peak 667 spectrum 1 weight 0.10000E+01 volume 0.30235E-02 ppm1 8.196 ppm2 8.929 CV 1
ASSI { 669}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 49 and name HG2%)
4.200 2.200 1.800 peak 669 spectrum 1 weight 0.10000E+01 volume 0.19946E-02 ppm1 7.812 ppm2 1.093 CV 1
ASSI { 670}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HB ))
3.000 1.100 1.100 peak 670 spectrum 1 weight 0.10000E+01 volume 0.35606E-02 ppm1 7.811 ppm2 2.064 CV 1
ASSI { 671}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 50 and name HB% )
2.200 0.600 0.600 peak 671 spectrum 1 weight 0.10000E+01 volume 0.10390E-01 ppm1 7.811 ppm2 1.546 CV 1
ASSI { 672}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HN ))
2.500 0.800 0.800 peak 672 spectrum 1 weight 0.10000E+01 volume 0.40643E-02 ppm1 7.811 ppm2 8.185 CV 1
ASSI { 673}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 49 and name HG1%)
2.900 2.900 3.100 peak 673 spectrum 1 weight 0.10000E+01 volume 0.18225E-02 ppm1 7.811 ppm2 1.006 CV 1
ASSI { 674}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HA ))
2.800 0.900 0.900 peak 674 spectrum 1 weight 0.10000E+01 volume 0.36508E-02 ppm1 7.812 ppm2 4.265 CV 1
ASSI { 675}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HN ))
2.400 0.700 0.700 peak 675 spectrum 1 weight 0.10000E+01 volume 0.52179E-02 ppm1 7.812 ppm2 8.890 CV 1
ASSI { 677}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 48 and name HA ))
3.700 1.700 1.700 peak 677 spectrum 1 weight 0.10000E+01 volume 0.88791E-03 ppm1 7.811 ppm2 3.414 CV 1
ASSI { 678}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 70 and name HG2%)
4.000 2.000 2.000 peak 678 spectrum 1 weight 0.10000E+01 volume 0.15911E-02 ppm1 8.076 ppm2 0.629 CV 1
ASSI { 679}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 71 and name HN ))
2.700 0.900 0.900 peak 679 spectrum 1 weight 0.10000E+01 volume 0.21805E-02 ppm1 8.076 ppm2 9.364 CV 1
ASSI { 680}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HA ))
1.900 0.500 0.500 peak 680 spectrum 1 weight 0.10000E+01 volume 0.65368E-02 ppm1 8.076 ppm2 5.244 CV 1
ASSI { 681}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 32 and name HA ))
3.400 1.400 1.400 peak 681 spectrum 1 weight 0.10000E+01 volume 0.14163E-02 ppm1 8.076 ppm2 4.868 CV 1
ASSI { 684}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HB ))
2.400 0.700 0.700 peak 684 spectrum 1 weight 0.10000E+01 volume 0.70214E-02 ppm1 8.076 ppm2 4.365 CV 1
ASSI { 685}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HB ))
2.400 0.700 0.700 peak 685 spectrum 1 weight 0.10000E+01 volume 0.56413E-02 ppm1 8.076 ppm2 2.264 CV 1
ASSI { 686}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HA ))
2.500 0.800 0.800 peak 686 spectrum 1 weight 0.10000E+01 volume 0.30197E-02 ppm1 8.076 ppm2 3.327 CV 1
ASSI { 689}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 31 and name HD2 ))
5.300 3.600 0.700 peak 689 spectrum 1 weight 0.10000E+01 volume 0.47922E-03 ppm1 8.078 ppm2 2.085 CV 1
ASSI { 690}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 72 and name HN ))
4.000 2.000 2.000 peak 690 spectrum 1 weight 0.10000E+01 volume 0.71477E-03 ppm1 8.077 ppm2 8.368 CV 1
ASSI { 691}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 33 and name HE% )
5.000 3.100 1.000 peak 691 spectrum 1 weight 0.10000E+01 volume 0.33245E-03 ppm1 8.076 ppm2 6.962 CV 1
ASSI { 693}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HN ))
4.800 2.900 1.200 peak 693 spectrum 1 weight 0.10000E+01 volume 0.22397E-03 ppm1 8.074 ppm2 8.740 CV 1
ASSI { 695}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 27 and name HG1%)
4.000 2.000 2.000 peak 695 spectrum 1 weight 0.10000E+01 volume 0.53990E-03 ppm1 8.968 ppm2 0.758 CV 1
ASSI { 698}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
2.900 1.000 1.000 peak 698 spectrum 1 weight 0.10000E+01 volume 0.21914E-02 ppm1 8.967 ppm2 9.263 CV 1
ASSI { 699}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HA ))
3.400 1.400 1.400 peak 699 spectrum 1 weight 0.10000E+01 volume 0.12755E-02 ppm1 8.967 ppm2 4.239 CV 1
ASSI { 705}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 62 and name HA ))
4.100 2.100 1.900 peak 705 spectrum 1 weight 0.10000E+01 volume 0.49197E-03 ppm1 7.577 ppm2 4.329 CV 1
ASSI { 706}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HG2 ))
2.800 1.000 1.000 peak 706 spectrum 1 weight 0.10000E+01 volume 0.76115E-03 ppm1 8.615 ppm2 2.504 CV 1
ASSI { 707}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HG1 ))
4.300 2.300 1.700 peak 707 spectrum 1 weight 0.10000E+01 volume 0.48566E-03 ppm1 8.615 ppm2 2.196 CV 1
ASSI { 708}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HA ))
2.500 0.800 0.800 peak 708 spectrum 1 weight 0.10000E+01 volume 0.36762E-02 ppm1 8.515 ppm2 3.622 CV 1
ASSI { 709}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HB ))
3.000 1.100 1.100 peak 709 spectrum 1 weight 0.10000E+01 volume 0.54498E-02 ppm1 8.515 ppm2 2.054 CV 1
ASSI { 710}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HA ))
3.400 1.400 1.400 peak 710 spectrum 1 weight 0.10000E+01 volume 0.13225E-02 ppm1 7.579 ppm2 4.686 CV 1
ASSI { 711}
(( segid " " and resid 24 and name HN ))
( segid " " and resid 24 and name HG1%)
2.200 0.600 0.600 peak 711 spectrum 1 weight 0.10000E+01 volume 0.13241E-01 ppm1 8.515 ppm2 0.997 CV 1
ASSI { 712}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HA ))
2.300 0.700 0.700 peak 712 spectrum 1 weight 0.10000E+01 volume 0.45212E-02 ppm1 8.614 ppm2 4.012 CV 1
ASSI { 713}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 48 and name HG1%)
4.000 2.000 2.000 peak 713 spectrum 1 weight 0.10000E+01 volume 0.17186E-02 ppm1 8.025 ppm2 0.628 CV 1
ASSI { 714}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 19 and name HD1%)
2.800 1.000 1.000 peak 714 spectrum 1 weight 0.10000E+01 volume 0.19388E-02 ppm1 8.026 ppm2 0.815 CV 1
ASSI { 716}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HA ))
2.100 0.500 0.500 peak 716 spectrum 1 weight 0.10000E+01 volume 0.13432E-01 ppm1 8.515 ppm2 4.317 CV 1
ASSI { 717}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 62 and name HN ))
4.400 2.400 1.600 peak 717 spectrum 1 weight 0.10000E+01 volume 0.47773E-03 ppm1 7.578 ppm2 8.783 CV 1
ASSI { 722}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HA ))
2.600 0.800 0.800 peak 722 spectrum 1 weight 0.10000E+01 volume 0.34334E-02 ppm1 8.026 ppm2 3.413 CV 1
ASSI { 723}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HB ))
2.100 0.600 0.600 peak 723 spectrum 1 weight 0.10000E+01 volume 0.96109E-02 ppm1 8.026 ppm2 2.363 CV 1
ASSI { 724}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 48 and name HG2%)
2.000 0.500 0.500 peak 724 spectrum 1 weight 0.10000E+01 volume 0.90780E-02 ppm1 8.026 ppm2 0.954 CV 1
ASSI { 725}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 17 and name HB2 ))
3.900 1.900 1.900 peak 725 spectrum 1 weight 0.10000E+01 volume 0.35699E-03 ppm1 8.516 ppm2 3.105 CV 1
ASSI { 728}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HB ))
2.100 0.600 0.600 peak 728 spectrum 1 weight 0.10000E+01 volume 0.82929E-02 ppm1 7.578 ppm2 2.065 CV 1
ASSI { 729}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HA ))
2.400 0.700 0.700 peak 729 spectrum 1 weight 0.10000E+01 volume 0.45784E-02 ppm1 7.578 ppm2 3.081 CV 1
ASSI { 730}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB2 ))
3.300 1.400 1.400 peak 730 spectrum 1 weight 0.10000E+01 volume 0.29094E-02 ppm1 8.614 ppm2 2.006 CV 1
ASSI { 731}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 64 and name HG2%)
2.100 0.600 0.600 peak 731 spectrum 1 weight 0.10000E+01 volume 0.87562E-02 ppm1 7.578 ppm2 0.927 CV 1
ASSI { 732}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 44 and name HE% )
3.900 1.900 1.900 peak 732 spectrum 1 weight 0.10000E+01 volume 0.16867E-02 ppm1 7.577 ppm2 0.219 CV 1
ASSI { 735}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HB2 ))
3.400 1.400 1.400 peak 735 spectrum 1 weight 0.10000E+01 volume 0.18210E-02 ppm1 8.515 ppm2 2.354 CV 1
ASSI { 736}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 64 and name HG1%)
3.900 1.900 1.900 peak 736 spectrum 1 weight 0.10000E+01 volume 0.18543E-02 ppm1 7.578 ppm2 0.770 CV 1
ASSI { 739}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HB1 ))
3.900 1.900 1.900 peak 739 spectrum 1 weight 0.10000E+01 volume 0.51952E-03 ppm1 8.613 ppm2 3.717 CV 1
ASSI { 740}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HN ))
2.700 0.900 0.900 peak 740 spectrum 1 weight 0.10000E+01 volume 0.28629E-02 ppm1 8.515 ppm2 9.257 CV 1
ASSI { 741}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB1 ))
2.400 0.700 0.700 peak 741 spectrum 1 weight 0.10000E+01 volume 0.40708E-02 ppm1 8.614 ppm2 1.864 CV 1
ASSI { 742}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 67 and name HD1%)
5.300 3.500 0.700 peak 742 spectrum 1 weight 0.10000E+01 volume 0.32457E-03 ppm1 7.578 ppm2 0.431 CV 1
ASSI { 743}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HB1 ))
3.000 1.100 1.100 peak 743 spectrum 1 weight 0.10000E+01 volume 0.17318E-02 ppm1 8.004 ppm2 2.959 CV 1
ASSI { 744}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HA ))
3.500 1.500 1.500 peak 744 spectrum 1 weight 0.10000E+01 volume 0.12395E-02 ppm1 8.006 ppm2 4.515 CV 1
ASSI { 746}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 73 and name HB% )
2.400 0.700 0.700 peak 746 spectrum 1 weight 0.10000E+01 volume 0.51232E-02 ppm1 8.006 ppm2 1.535 CV 1
ASSI { 748}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HA ))
2.800 1.000 1.000 peak 748 spectrum 1 weight 0.10000E+01 volume 0.25465E-02 ppm1 8.005 ppm2 4.129 CV 1
ASSI { 749}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 17 and name HD21))
3.700 1.700 1.700 peak 749 spectrum 1 weight 0.10000E+01 volume 0.67791E-03 ppm1 8.516 ppm2 6.864 CV 1
ASSI { 750}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HB2 ))
3.100 1.200 1.200 peak 750 spectrum 1 weight 0.10000E+01 volume 0.29479E-02 ppm1 8.005 ppm2 3.181 CV 1
ASSI { 753}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 67 and name HD2%)
4.100 2.200 1.900 peak 753 spectrum 1 weight 0.10000E+01 volume 0.72326E-03 ppm1 8.006 ppm2 0.554 CV 1
ASSI { 756}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 25 and name HA ))
3.400 1.500 1.500 peak 756 spectrum 1 weight 0.10000E+01 volume 0.12415E-02 ppm1 7.487 ppm2 4.054 CV 1
ASSI { 757}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 25 and name HN ))
4.700 2.800 1.300 peak 757 spectrum 1 weight 0.10000E+01 volume 0.34133E-03 ppm1 7.489 ppm2 9.258 CV 1
ASSI { 759}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HB1 ))
3.800 1.800 1.800 peak 759 spectrum 1 weight 0.10000E+01 volume 0.11017E-02 ppm1 7.489 ppm2 2.660 CV 1
ASSI { 760}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 27 and name HG1%)
4.100 2.100 1.900 peak 760 spectrum 1 weight 0.10000E+01 volume 0.15475E-02 ppm1 7.489 ppm2 0.749 CV 1
ASSI { 761}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 27 and name HG2%)
2.300 0.700 0.700 peak 761 spectrum 1 weight 0.10000E+01 volume 0.67377E-02 ppm1 7.489 ppm2 0.949 CV 1
ASSI { 762}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HB ))
2.400 0.700 0.700 peak 762 spectrum 1 weight 0.10000E+01 volume 0.57562E-02 ppm1 7.489 ppm2 2.338 CV 1
ASSI { 763}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 28 and name HG1 ))
3.100 1.200 1.200 peak 763 spectrum 1 weight 0.10000E+01 volume 0.13149E-02 ppm1 7.487 ppm2 1.698 CV 1
ASSI { 764}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HN ))
2.400 0.700 0.700 peak 764 spectrum 1 weight 0.10000E+01 volume 0.56280E-02 ppm1 7.489 ppm2 7.794 CV 1
ASSI { 765}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HA ))
2.700 0.900 0.900 peak 765 spectrum 1 weight 0.10000E+01 volume 0.25513E-02 ppm1 7.488 ppm2 3.560 CV 1
ASSI { 766}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 28 and name HD1 ))
4.600 2.600 1.400 peak 766 spectrum 1 weight 0.10000E+01 volume 0.47287E-03 ppm1 7.488 ppm2 1.344 CV 1
ASSI { 767}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HA ))
3.400 1.400 1.400 peak 767 spectrum 1 weight 0.10000E+01 volume 0.15132E-02 ppm1 7.488 ppm2 4.636 CV 1
ASSI { 768}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 13 and name HA ))
4.500 2.600 1.500 peak 768 spectrum 1 weight 0.10000E+01 volume 0.64929E-03 ppm1 9.261 ppm2 4.077 CV 1
ASSI { 769}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 8 and name HD1%)
4.500 2.500 1.500 peak 769 spectrum 1 weight 0.10000E+01 volume 0.21361E-03 ppm1 9.258 ppm2 0.597 CV 1
ASSI { 770}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 55 and name HZ ))
4.100 2.100 1.900 peak 770 spectrum 1 weight 0.10000E+01 volume 0.76633E-03 ppm1 9.259 ppm2 7.470 CV 1
OR { 770}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 55 and name HD% )
ASSI { 772}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 55 and name HE% )
4.400 2.400 1.600 peak 772 spectrum 1 weight 0.10000E+01 volume 0.23638E-03 ppm1 9.257 ppm2 7.127 CV 1
ASSI { 773}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HG ))
4.100 2.100 1.900 peak 773 spectrum 1 weight 0.10000E+01 volume 0.25436E-02 ppm1 9.258 ppm2 1.974 CV 1
ASSI { 775}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB2 ))
2.400 0.700 0.700 peak 775 spectrum 1 weight 0.10000E+01 volume 0.31743E-02 ppm1 9.259 ppm2 2.122 CV 1
ASSI { 777}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 64 and name HG2%)
4.800 2.900 1.200 peak 777 spectrum 1 weight 0.10000E+01 volume 0.31670E-03 ppm1 8.615 ppm2 0.922 CV 1
ASSI { 780}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 40 and name HB1 ))
4.500 2.500 1.500 peak 780 spectrum 1 weight 0.10000E+01 volume 0.26203E-03 ppm1 7.868 ppm2 2.780 CV 1
ASSI { 783}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HB1 ))
3.400 1.500 1.500 peak 783 spectrum 1 weight 0.10000E+01 volume 0.14709E-02 ppm1 8.612 ppm2 1.919 CV 1
ASSI { 785}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HA ))
3.500 1.500 1.500 peak 785 spectrum 1 weight 0.10000E+01 volume 0.92600E-03 ppm1 8.613 ppm2 4.783 CV 1
ASSI { 786}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HA ))
3.500 1.500 1.500 peak 786 spectrum 1 weight 0.10000E+01 volume 0.12626E-02 ppm1 7.868 ppm2 3.991 CV 1
ASSI { 787}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB1 ))
3.300 1.300 1.300 peak 787 spectrum 1 weight 0.10000E+01 volume 0.15255E-02 ppm1 7.869 ppm2 3.910 CV 1
OR { 787}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB2 ))
ASSI { 788}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 40 and name HB2 ))
4.200 2.200 1.800 peak 788 spectrum 1 weight 0.10000E+01 volume 0.63247E-03 ppm1 7.869 ppm2 3.135 CV 1
ASSI { 789}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HA ))
2.200 0.600 0.600 peak 789 spectrum 1 weight 0.10000E+01 volume 0.13195E-01 ppm1 8.612 ppm2 4.361 CV 1
ASSI { 790}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HB2 ))
3.500 1.600 1.600 peak 790 spectrum 1 weight 0.10000E+01 volume 0.18424E-02 ppm1 8.612 ppm2 2.390 CV 1
ASSI { 791}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HB1 ))
2.600 0.900 0.900 peak 791 spectrum 1 weight 0.10000E+01 volume 0.63641E-02 ppm1 8.612 ppm2 2.614 CV 1
OR { 791}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HB2 ))
ASSI { 792}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB1 ))
2.600 0.900 0.900 peak 792 spectrum 1 weight 0.10000E+01 volume 0.37814E-02 ppm1 7.868 ppm2 1.666 CV 1
ASSI { 793}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB2 ))
2.700 0.900 0.900 peak 793 spectrum 1 weight 0.10000E+01 volume 0.49188E-02 ppm1 7.869 ppm2 1.875 CV 1
ASSI { 795}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HB1 ))
3.300 1.300 1.300 peak 795 spectrum 1 weight 0.10000E+01 volume 0.88752E-03 ppm1 7.750 ppm2 2.776 CV 1
ASSI { 798}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
2.500 0.800 0.800 peak 798 spectrum 1 weight 0.10000E+01 volume 0.53664E-02 ppm1 7.869 ppm2 8.410 CV 1
ASSI { 801}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HA ))
2.800 0.900 0.900 peak 801 spectrum 1 weight 0.10000E+01 volume 0.26374E-02 ppm1 7.750 ppm2 4.506 CV 1
ASSI { 802}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB2 ))
3.000 1.100 1.100 peak 802 spectrum 1 weight 0.10000E+01 volume 0.49673E-02 ppm1 7.749 ppm2 2.136 CV 1
ASSI { 805}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 67 and name HD1%)
4.200 2.200 1.800 peak 805 spectrum 1 weight 0.10000E+01 volume 0.13296E-02 ppm1 7.749 ppm2 0.457 CV 1
ASSI { 806}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HG ))
1.800 0.400 0.400 peak 806 spectrum 1 weight 0.10000E+01 volume 0.69814E-02 ppm1 7.750 ppm2 1.819 CV 1
ASSI { 810}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 44 and name HN ))
4.200 2.200 1.800 peak 810 spectrum 1 weight 0.10000E+01 volume 0.57715E-03 ppm1 7.867 ppm2 8.620 CV 1
ASSI { 811}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 68 and name HN ))
4.600 2.600 1.400 peak 811 spectrum 1 weight 0.10000E+01 volume 0.44768E-03 ppm1 7.749 ppm2 8.405 CV 1
ASSI { 813}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 72 and name HB2 ))
3.700 1.700 1.700 peak 813 spectrum 1 weight 0.10000E+01 volume 0.14678E-02 ppm1 8.401 ppm2 3.181 CV 1
ASSI { 814}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 72 and name HB1 ))
4.000 2.000 2.000 peak 814 spectrum 1 weight 0.10000E+01 volume 0.11036E-02 ppm1 8.401 ppm2 2.960 CV 1
ASSI { 816}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB1 ))
5.400 3.700 0.600 peak 816 spectrum 1 weight 0.10000E+01 volume 0.34689E-03 ppm1 8.398 ppm2 0.918 CV 1
ASSI { 817}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HA ))
2.400 0.700 0.700 peak 817 spectrum 1 weight 0.10000E+01 volume 0.54281E-02 ppm1 8.402 ppm2 4.510 CV 1
ASSI { 819}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HB2 ))
2.900 1.100 1.100 peak 819 spectrum 1 weight 0.10000E+01 volume 0.25446E-02 ppm1 8.253 ppm2 1.705 CV 1
OR { 819}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HB1 ))
ASSI { 820}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HA ))
2.500 0.800 0.800 peak 820 spectrum 1 weight 0.10000E+01 volume 0.55687E-02 ppm1 8.252 ppm2 4.726 CV 1
ASSI { 821}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HB ))
3.900 1.900 1.900 peak 821 spectrum 1 weight 0.10000E+01 volume 0.19068E-02 ppm1 8.253 ppm2 2.009 CV 1
ASSI { 822}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HD2 ))
4.100 2.100 1.900 peak 822 spectrum 1 weight 0.10000E+01 volume 0.73850E-03 ppm1 8.252 ppm2 1.362 CV 1
OR { 822}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HD1 ))
ASSI { 823}
(( segid " " and resid 58 and name HN ))
( segid " " and resid 57 and name HG1%)
3.800 1.800 1.800 peak 823 spectrum 1 weight 0.10000E+01 volume 0.13433E-02 ppm1 8.253 ppm2 0.957 CV 1
ASSI { 824}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 70 and name HN ))
6.000 5.100 0.000 peak 824 spectrum 1 weight 0.10000E+01 volume 0.20863E-03 ppm1 6.308 ppm2 8.105 CV 1
ASSI { 825}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HB1 ))
3.400 1.400 1.400 peak 825 spectrum 1 weight 0.10000E+01 volume 0.21870E-02 ppm1 6.307 ppm2 1.542 CV 1
ASSI { 827}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 37 and name HD1%)
4.700 2.700 1.300 peak 827 spectrum 1 weight 0.10000E+01 volume 0.68418E-03 ppm1 6.308 ppm2 0.599 CV 1
ASSI { 828}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA ))
2.800 1.000 1.000 peak 828 spectrum 1 weight 0.10000E+01 volume 0.19381E-02 ppm1 6.303 ppm2 4.647 CV 1
ASSI { 829}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
2.000 0.500 0.500 peak 829 spectrum 1 weight 0.10000E+01 volume 0.70816E-02 ppm1 6.307 ppm2 3.551 CV 1
ASSI { 830}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 31 and name HB1 ))
3.300 1.400 1.400 peak 830 spectrum 1 weight 0.10000E+01 volume 0.25552E-02 ppm1 6.307 ppm2 1.810 CV 1
ASSI { 831}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HB2 ))
2.600 0.900 0.900 peak 831 spectrum 1 weight 0.10000E+01 volume 0.20190E-02 ppm1 6.307 ppm2 2.082 CV 1
ASSI { 833}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HB ))
4.300 2.300 1.700 peak 833 spectrum 1 weight 0.10000E+01 volume 0.49087E-03 ppm1 6.306 ppm2 2.328 CV 1
ASSI { 835}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 71 and name HA2 ))
4.900 3.100 1.100 peak 835 spectrum 1 weight 0.10000E+01 volume 0.24085E-03 ppm1 6.308 ppm2 3.999 CV 1
ASSI { 836}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HN ))
4.200 2.200 1.800 peak 836 spectrum 1 weight 0.10000E+01 volume 0.86719E-03 ppm1 6.308 ppm2 7.498 CV 1
ASSI { 837}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 29 and name HN ))
4.800 2.800 1.200 peak 837 spectrum 1 weight 0.10000E+01 volume 0.26167E-03 ppm1 6.305 ppm2 8.486 CV 1
ASSI { 838}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 27 and name HG2%)
4.500 2.500 1.500 peak 838 spectrum 1 weight 0.10000E+01 volume 0.77472E-03 ppm1 6.305 ppm2 0.943 CV 1
ASSI { 840}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 8 and name HG2%)
2.900 1.100 1.100 peak 840 spectrum 1 weight 0.10000E+01 volume 0.19498E-02 ppm1 8.402 ppm2 0.535 CV 1
ASSI { 841}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 31 and name HA ))
6.000 4.800 0.000 peak 841 spectrum 1 weight 0.10000E+01 volume 0.26705E-03 ppm1 6.311 ppm2 4.363 CV 1
ASSI { 843}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 30 and name HN ))
4.700 2.800 1.300 peak 843 spectrum 1 weight 0.10000E+01 volume 0.25786E-03 ppm1 6.313 ppm2 8.339 CV 1
ASSI { 846}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HA ))
3.100 1.200 1.200 peak 846 spectrum 1 weight 0.10000E+01 volume 0.13992E-02 ppm1 8.402 ppm2 3.867 CV 1
ASSI { 847}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HB ))
2.400 0.700 0.700 peak 847 spectrum 1 weight 0.10000E+01 volume 0.37935E-02 ppm1 8.402 ppm2 1.766 CV 1
ASSI { 849}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HB2 ))
3.200 1.300 1.300 peak 849 spectrum 1 weight 0.10000E+01 volume 0.10569E-02 ppm1 8.402 ppm2 2.493 CV 1
OR { 849}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HG2 ))
ASSI { 850}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HG11))
4.500 2.500 1.500 peak 850 spectrum 1 weight 0.10000E+01 volume 0.12192E-02 ppm1 8.402 ppm2 0.085 CV 1
ASSI { 856}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 51 and name HB% )
2.100 0.500 0.500 peak 856 spectrum 1 weight 0.10000E+01 volume 0.11594E-01 ppm1 8.886 ppm2 1.530 CV 1
ASSI { 858}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 15 and name HD1%)
3.100 1.200 1.200 peak 858 spectrum 1 weight 0.10000E+01 volume 0.15937E-02 ppm1 8.886 ppm2 0.765 CV 1
ASSI { 859}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HA ))
3.700 1.700 1.700 peak 859 spectrum 1 weight 0.10000E+01 volume 0.75666E-03 ppm1 8.886 ppm2 4.262 CV 1
ASSI { 861}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 69 and name HG2%)
4.500 2.500 1.500 peak 861 spectrum 1 weight 0.10000E+01 volume 0.88446E-03 ppm1 8.352 ppm2 1.057 CV 1
ASSI { 862}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HA ))
2.700 0.900 0.900 peak 862 spectrum 1 weight 0.10000E+01 volume 0.44802E-02 ppm1 8.351 ppm2 4.520 CV 1
ASSI { 863}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 73 and name HB% )
4.800 2.900 1.200 peak 863 spectrum 1 weight 0.10000E+01 volume 0.57809E-03 ppm1 8.352 ppm2 1.529 CV 1
ASSI { 864}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 69 and name HB ))
3.500 1.500 1.500 peak 864 spectrum 1 weight 0.10000E+01 volume 0.11100E-02 ppm1 8.352 ppm2 4.362 CV 1
ASSI { 865}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HA1 ))
2.900 1.000 1.000 peak 865 spectrum 1 weight 0.10000E+01 volume 0.15254E-02 ppm1 8.351 ppm2 3.807 CV 1
ASSI { 866}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HB2 ))
2.400 0.700 0.700 peak 866 spectrum 1 weight 0.10000E+01 volume 0.54582E-02 ppm1 8.351 ppm2 3.183 CV 1
ASSI { 867}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 73 and name HN ))
2.400 0.700 0.700 peak 867 spectrum 1 weight 0.10000E+01 volume 0.58628E-02 ppm1 8.351 ppm2 8.012 CV 1
ASSI { 868}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HB1 ))
3.200 1.300 1.300 peak 868 spectrum 1 weight 0.10000E+01 volume 0.31537E-02 ppm1 8.352 ppm2 2.957 CV 1
ASSI { 869}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HN ))
2.700 0.900 0.900 peak 869 spectrum 1 weight 0.10000E+01 volume 0.29002E-02 ppm1 8.351 ppm2 9.365 CV 1
ASSI { 870}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 69 and name HG1 ))
2.800 1.000 1.000 peak 870 spectrum 1 weight 0.10000E+01 volume 0.28768E-02 ppm1 8.352 ppm2 5.324 CV 1
ASSI { 871}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HA2 ))
3.200 1.200 1.200 peak 871 spectrum 1 weight 0.10000E+01 volume 0.27188E-02 ppm1 8.352 ppm2 4.016 CV 1
ASSI { 872}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 69 and name HN ))
3.500 1.600 1.600 peak 872 spectrum 1 weight 0.10000E+01 volume 0.16155E-02 ppm1 8.351 ppm2 8.736 CV 1
ASSI { 873}
(( segid " " and resid 3 and name HN ))
( segid " " and resid 8 and name HG2%)
5.500 3.700 0.500 peak 873 spectrum 1 weight 0.10000E+01 volume 0.24032E-03 ppm1 8.853 ppm2 0.518 CV 1
ASSI { 874}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HA ))
2.800 1.000 1.000 peak 874 spectrum 1 weight 0.10000E+01 volume 0.31849E-02 ppm1 8.853 ppm2 4.825 CV 1
ASSI { 877}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 2 and name HN ))
3.800 1.800 1.800 peak 877 spectrum 1 weight 0.10000E+01 volume 0.26356E-02 ppm1 8.852 ppm2 7.716 CV 1
ASSI { 878}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 43 and name HB1 ))
3.700 1.700 1.700 peak 878 spectrum 1 weight 0.10000E+01 volume 0.12186E-02 ppm1 8.138 ppm2 3.720 CV 1
ASSI { 879}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 39 and name HG1%)
2.600 0.800 0.800 peak 879 spectrum 1 weight 0.10000E+01 volume 0.31295E-02 ppm1 8.139 ppm2 0.827 CV 1
ASSI { 880}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
1.900 0.400 0.400 peak 880 spectrum 1 weight 0.10000E+01 volume 0.17976E-01 ppm1 8.138 ppm2 4.000 CV 1
ASSI { 881}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HB1 ))
3.100 1.200 1.200 peak 881 spectrum 1 weight 0.10000E+01 volume 0.37874E-02 ppm1 8.138 ppm2 2.784 CV 1
ASSI { 883}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 39 and name HG2%)
2.900 1.000 1.000 peak 883 spectrum 1 weight 0.10000E+01 volume 0.14234E-02 ppm1 8.139 ppm2 0.941 CV 1
ASSI { 884}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HB2 ))
2.700 0.900 0.900 peak 884 spectrum 1 weight 0.10000E+01 volume 0.22973E-02 ppm1 8.139 ppm2 3.140 CV 1
ASSI { 885}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HB ))
4.200 2.200 1.800 peak 885 spectrum 1 weight 0.10000E+01 volume 0.61549E-03 ppm1 8.138 ppm2 1.994 CV 1
ASSI { 886}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 43 and name HA ))
5.700 4.100 0.300 peak 886 spectrum 1 weight 0.10000E+01 volume 0.34469E-03 ppm1 8.138 ppm2 4.320 CV 1
ASSI { 899}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HN ))
5.100 3.200 0.900 peak 899 spectrum 1 weight 0.10000E+01 volume 0.32822E-03 ppm1 8.359 ppm2 10.114 CV 1
ASSI { 902}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 69 and name HA ))
1.800 0.400 0.400 peak 902 spectrum 1 weight 0.10000E+01 volume 0.36747E-02 ppm1 8.357 ppm2 5.243 CV 1
ASSI { 904}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB1 ))
3.000 1.100 1.100 peak 904 spectrum 1 weight 0.10000E+01 volume 0.44476E-02 ppm1 8.357 ppm2 3.153 CV 1
ASSI { 905}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HA ))
2.200 0.600 0.600 peak 905 spectrum 1 weight 0.10000E+01 volume 0.36887E-02 ppm1 8.357 ppm2 4.095 CV 1
ASSI { 906}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HA ))
2.100 0.500 0.500 peak 906 spectrum 1 weight 0.10000E+01 volume 0.96903E-02 ppm1 8.357 ppm2 4.869 CV 1
ASSI { 907}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 33 and name HD% )
3.000 1.100 1.100 peak 907 spectrum 1 weight 0.10000E+01 volume 0.42285E-02 ppm1 8.357 ppm2 7.118 CV 1
ASSI { 908}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 34 and name HN ))
2.500 0.800 0.800 peak 908 spectrum 1 weight 0.10000E+01 volume 0.25875E-02 ppm1 8.357 ppm2 8.759 CV 1
ASSI { 909}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 33 and name HE% )
4.700 2.800 1.300 peak 909 spectrum 1 weight 0.10000E+01 volume 0.70125E-03 ppm1 8.355 ppm2 6.960 CV 1
ASSI { 910}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HB1 ))
3.700 1.700 1.700 peak 910 spectrum 1 weight 0.10000E+01 volume 0.55095E-03 ppm1 8.356 ppm2 3.857 CV 1
ASSI { 912}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 37 and name HD1%)
4.900 3.000 1.100 peak 912 spectrum 1 weight 0.10000E+01 volume 0.59758E-03 ppm1 8.357 ppm2 0.587 CV 1
ASSI { 917}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HB2 ))
2.700 0.900 0.900 peak 917 spectrum 1 weight 0.10000E+01 volume 0.20402E-02 ppm1 8.324 ppm2 2.352 CV 1
ASSI { 919}
(( segid " " and resid 82 and name HN ))
( segid " " and resid 57 and name HG1%)
3.400 1.400 1.400 peak 919 spectrum 1 weight 0.10000E+01 volume 0.34238E-03 ppm1 8.320 ppm2 0.967 CV 1
ASSI { 921}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HB1 ))
4.200 2.200 1.800 peak 921 spectrum 1 weight 0.10000E+01 volume 0.11874E-02 ppm1 8.323 ppm2 2.141 CV 1
ASSI { 3}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 77 and name HA ))
4.300 2.300 1.700 peak 3 spectrum 1 weight 0.10000E+01 volume 0.14027E-02 ppm1 0.679 ppm2 3.538 CV 1
ASSI { 4}
( segid " " and resid 77 and name HD1%)
( segid " " and resid 51 and name HB% )
2.200 2.200 3.800 peak 4 spectrum 1 weight 0.10000E+01 volume 0.36821E-02 ppm1 0.679 ppm2 1.525 CV 1
ASSI { 5}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 77 and name HG11))
2.400 0.700 0.700 peak 5 spectrum 1 weight 0.10000E+01 volume 0.50457E-02 ppm1 0.679 ppm2 2.031 CV 1
ASSI { 6}
( segid " " and resid 77 and name HD1%)
( segid " " and resid 12 and name HD2%)
2.500 0.800 0.800 peak 6 spectrum 1 weight 0.10000E+01 volume 0.44528E-02 ppm1 0.679 ppm2 0.854 CV 1
ASSI { 7}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 74 and name HA ))
3.300 1.300 1.300 peak 7 spectrum 1 weight 0.10000E+01 volume 0.12996E-02 ppm1 0.678 ppm2 3.682 CV 1
ASSI { 8}
( segid " " and resid 77 and name HD1%)
( segid " " and resid 77 and name HG2%)
2.200 0.600 0.600 peak 8 spectrum 1 weight 0.10000E+01 volume 0.10372E-01 ppm1 0.679 ppm2 0.563 CV 1
ASSI { 9}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 77 and name HG12))
2.200 0.600 0.600 peak 9 spectrum 1 weight 0.10000E+01 volume 0.74669E-02 ppm1 0.679 ppm2 0.947 CV 1
ASSI { 10}
( segid " " and resid 77 and name HD1%)
(( segid " " and resid 77 and name HN ))
3.700 1.700 1.700 peak 10 spectrum 1 weight 0.10000E+01 volume 0.17969E-02 ppm1 0.679 ppm2 8.464 CV 1
ASSI { 11}
( segid " " and resid 51 and name HB% )
( segid " " and resid 15 and name HD1%)
2.600 0.800 0.800 peak 11 spectrum 1 weight 0.10000E+01 volume 0.33989E-02 ppm1 1.523 ppm2 0.762 CV 1
ASSI { 12}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 51 and name HA ))
2.200 0.600 0.600 peak 12 spectrum 1 weight 0.10000E+01 volume 0.53694E-02 ppm1 1.523 ppm2 3.978 CV 1
ASSI { 17}
( segid " " and resid 51 and name HB% )
( segid " " and resid 55 and name HD% )
2.900 1.100 1.100 peak 17 spectrum 1 weight 0.10000E+01 volume 0.27753E-02 ppm1 1.523 ppm2 7.478 CV 1
OR { 17}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 55 and name HZ ))
ASSI { 18}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 54 and name HG2 ))
2.800 1.000 1.000 peak 18 spectrum 1 weight 0.10000E+01 volume 0.64288E-02 ppm1 1.525 ppm2 0.861 CV 1
ASSI { 21}
( segid " " and resid 73 and name HB% )
( segid " " and resid 67 and name HD2%)
3.100 1.200 1.200 peak 21 spectrum 1 weight 0.10000E+01 volume 0.15651E-02 ppm1 1.540 ppm2 0.542 CV 1
ASSI { 23}
( segid " " and resid 73 and name HB% )
(( segid " " and resid 33 and name HZ ))
3.300 1.300 1.300 peak 23 spectrum 1 weight 0.10000E+01 volume 0.26312E-02 ppm1 1.539 ppm2 6.799 CV 1
ASSI { 24}
( segid " " and resid 73 and name HB% )
( segid " " and resid 33 and name HE% )
2.600 0.900 0.900 peak 24 spectrum 1 weight 0.10000E+01 volume 0.26602E-02 ppm1 1.540 ppm2 6.963 CV 1
ASSI { 26}
( segid " " and resid 73 and name HB% )
( segid " " and resid 67 and name HD1%)
2.900 2.900 3.100 peak 26 spectrum 1 weight 0.10000E+01 volume 0.13944E-02 ppm1 1.541 ppm2 0.433 CV 1
ASSI { 28}
( segid " " and resid 73 and name HB% )
(( segid " " and resid 70 and name HA ))
2.900 1.100 1.100 peak 28 spectrum 1 weight 0.10000E+01 volume 0.16157E-02 ppm1 1.541 ppm2 3.333 CV 1
ASSI { 29}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 7 and name HA ))
2.500 0.800 0.800 peak 29 spectrum 1 weight 0.10000E+01 volume 0.65156E-02 ppm1 1.535 ppm2 4.141 CV 1
ASSI { 31}
( segid " " and resid 10 and name HB% )
( segid " " and resid 9 and name HG1%)
3.500 1.600 1.600 peak 31 spectrum 1 weight 0.10000E+01 volume 0.20722E-02 ppm1 1.537 ppm2 0.910 CV 1
ASSI { 34}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 10 and name HA ))
2.200 0.600 0.600 peak 34 spectrum 1 weight 0.10000E+01 volume 0.12972E-01 ppm1 1.534 ppm2 4.236 CV 1
ASSI { 36}
( segid " " and resid 10 and name HB% )
(( segid " " and resid 9 and name HB ))
4.300 2.300 1.700 peak 36 spectrum 1 weight 0.10000E+01 volume 0.96686E-03 ppm1 1.535 ppm2 2.020 CV 1
ASSI { 38}
( segid " " and resid 13 and name HB% )
(( segid " " and resid 10 and name HA ))
2.500 0.800 0.800 peak 38 spectrum 1 weight 0.10000E+01 volume 0.49870E-02 ppm1 1.701 ppm2 4.238 CV 1
ASSI { 39}
( segid " " and resid 13 and name HB% )
( segid " " and resid 27 and name HG1%)
2.600 0.800 0.800 peak 39 spectrum 1 weight 0.10000E+01 volume 0.56176E-02 ppm1 1.701 ppm2 0.746 CV 1
ASSI { 40}
( segid " " and resid 13 and name HB% )
(( segid " " and resid 24 and name HA ))
2.300 0.600 0.600 peak 40 spectrum 1 weight 0.10000E+01 volume 0.43066E-02 ppm1 1.701 ppm2 3.623 CV 1
ASSI { 41}
( segid " " and resid 13 and name HB% )
( segid " " and resid 24 and name HG1%)
2.600 0.900 0.900 peak 41 spectrum 1 weight 0.10000E+01 volume 0.72266E-02 ppm1 1.701 ppm2 0.976 CV 1
ASSI { 42}
( segid " " and resid 13 and name HB% )
(( segid " " and resid 27 and name HB ))
2.300 0.700 0.700 peak 42 spectrum 1 weight 0.10000E+01 volume 0.58283E-02 ppm1 1.702 ppm2 2.358 CV 1
ASSI { 43}
( segid " " and resid 13 and name HB% )
(( segid " " and resid 24 and name HB ))
3.200 1.200 1.200 peak 43 spectrum 1 weight 0.10000E+01 volume 0.29384E-02 ppm1 1.702 ppm2 2.060 CV 1
ASSI { 44}
( segid " " and resid 13 and name HB% )
(( segid " " and resid 13 and name HA ))
2.100 0.600 0.600 peak 44 spectrum 1 weight 0.10000E+01 volume 0.85406E-02 ppm1 1.702 ppm2 4.061 CV 1
ASSI { 45}
( segid " " and resid 13 and name HB% )
(( segid " " and resid 13 and name HN ))
2.200 0.600 0.600 peak 45 spectrum 1 weight 0.10000E+01 volume 0.81567E-02 ppm1 1.702 ppm2 8.990 CV 1
ASSI { 46}
( segid " " and resid 13 and name HB% )
( segid " " and resid 9 and name HG1%)
2.900 1.100 1.100 peak 46 spectrum 1 weight 0.10000E+01 volume 0.23420E-02 ppm1 1.696 ppm2 0.915 CV 1
ASSI { 47}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 51 and name HA ))
3.900 1.900 1.900 peak 47 spectrum 1 weight 0.10000E+01 volume 0.10033E-02 ppm1 1.554 ppm2 3.976 CV 1
ASSI { 48}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 51 and name HN ))
2.700 0.900 0.900 peak 48 spectrum 1 weight 0.10000E+01 volume 0.49836E-02 ppm1 1.555 ppm2 8.908 CV 1
ASSI { 50}
( segid " " and resid 50 and name HB% )
( segid " " and resid 15 and name HD1%)
2.400 0.700 0.700 peak 50 spectrum 1 weight 0.10000E+01 volume 0.71324E-02 ppm1 1.553 ppm2 0.770 CV 1
ASSI { 52}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 50 and name HA ))
2.300 0.600 0.600 peak 52 spectrum 1 weight 0.10000E+01 volume 0.10977E-01 ppm1 1.554 ppm2 4.262 CV 1
ASSI { 53}
( segid " " and resid 50 and name HB% )
( segid " " and resid 47 and name HG1%)
3.500 1.500 1.500 peak 53 spectrum 1 weight 0.10000E+01 volume 0.87711E-03 ppm1 1.556 ppm2 0.646 CV 1
ASSI { 54}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 15 and name HG12))
3.500 1.600 1.600 peak 54 spectrum 1 weight 0.10000E+01 volume 0.13499E-02 ppm1 1.553 ppm2 1.982 CV 1
ASSI { 55}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 48 and name HA ))
3.300 1.300 1.300 peak 55 spectrum 1 weight 0.10000E+01 volume 0.32039E-02 ppm1 1.553 ppm2 3.422 CV 1
ASSI { 56}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 15 and name HA ))
2.800 2.800 3.200 peak 56 spectrum 1 weight 0.10000E+01 volume 0.83507E-03 ppm1 1.555 ppm2 3.797 CV 1
ASSI { 57}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 49 and name HB ))
4.600 2.600 1.400 peak 57 spectrum 1 weight 0.10000E+01 volume 0.95763E-03 ppm1 1.553 ppm2 2.068 CV 1
ASSI { 58}
( segid " " and resid 50 and name HB% )
( segid " " and resid 49 and name HG1%)
3.600 1.600 1.600 peak 58 spectrum 1 weight 0.10000E+01 volume 0.17717E-02 ppm1 1.554 ppm2 1.001 CV 1
ASSI { 59}
( segid " " and resid 50 and name HB% )
( segid " " and resid 49 and name HG2%)
3.200 1.300 1.300 peak 59 spectrum 1 weight 0.10000E+01 volume 0.11881E-01 ppm1 1.554 ppm2 1.097 CV 1
ASSI { 61}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 3 and name HN ))
2.700 0.900 0.900 peak 61 spectrum 1 weight 0.10000E+01 volume 0.47719E-02 ppm1 1.521 ppm2 8.858 CV 1
ASSI { 63}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 2 and name HA ))
2.500 0.800 0.800 peak 63 spectrum 1 weight 0.10000E+01 volume 0.69138E-02 ppm1 1.522 ppm2 4.037 CV 1
ASSI { 64}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 81 and name HG1 ))
3.200 1.300 1.300 peak 64 spectrum 1 weight 0.10000E+01 volume 0.13563E-02 ppm1 1.521 ppm2 2.576 CV 1
ASSI { 67}
( segid " " and resid 82 and name HB% )
(( segid " " and resid 56 and name HB2 ))
3.600 1.600 1.600 peak 67 spectrum 1 weight 0.10000E+01 volume 0.80462E-03 ppm1 1.447 ppm2 3.263 CV 1
ASSI { 68}
( segid " " and resid 82 and name HB% )
(( segid " " and resid 82 and name HN ))
2.300 0.700 0.700 peak 68 spectrum 1 weight 0.10000E+01 volume 0.13475E-01 ppm1 1.447 ppm2 8.314 CV 1
ASSI { 69}
( segid " " and resid 82 and name HB% )
(( segid " " and resid 82 and name HA ))
2.500 0.800 0.800 peak 69 spectrum 1 weight 0.10000E+01 volume 0.70752E-02 ppm1 1.447 ppm2 4.205 CV 1
ASSI { 70}
( segid " " and resid 82 and name HB% )
(( segid " " and resid 81 and name HA ))
3.600 1.600 1.600 peak 70 spectrum 1 weight 0.10000E+01 volume 0.14285E-02 ppm1 1.447 ppm2 4.452 CV 1
ASSI { 73}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 8 and name HN ))
2.900 1.000 1.000 peak 73 spectrum 1 weight 0.10000E+01 volume 0.22987E-02 ppm1 1.570 ppm2 8.401 CV 1
ASSI { 74}
( segid " " and resid 3 and name HB% )
( segid " " and resid 55 and name HD% )
3.000 1.100 1.100 peak 74 spectrum 1 weight 0.10000E+01 volume 0.31551E-02 ppm1 1.571 ppm2 7.471 CV 1
OR { 74}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 55 and name HZ ))
ASSI { 75}
( segid " " and resid 3 and name HB% )
( segid " " and resid 8 and name HG2%)
3.300 1.300 1.300 peak 75 spectrum 1 weight 0.10000E+01 volume 0.47085E-02 ppm1 1.570 ppm2 0.514 CV 1
ASSI { 76}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 7 and name HB2 ))
2.900 1.100 1.100 peak 76 spectrum 1 weight 0.10000E+01 volume 0.32370E-02 ppm1 1.571 ppm2 2.499 CV 1
ASSI { 77}
( segid " " and resid 3 and name HB% )
( segid " " and resid 55 and name HE% )
2.900 1.000 1.000 peak 77 spectrum 1 weight 0.10000E+01 volume 0.21187E-02 ppm1 1.572 ppm2 7.134 CV 1
ASSI { 79}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 8 and name HA ))
3.400 1.400 1.400 peak 79 spectrum 1 weight 0.10000E+01 volume 0.11094E-02 ppm1 1.569 ppm2 3.871 CV 1
ASSI { 80}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 8 and name HG11))
3.200 1.300 1.300 peak 80 spectrum 1 weight 0.10000E+01 volume 0.29997E-02 ppm1 1.570 ppm2 0.087 CV 1
ASSI { 81}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 4 and name HN ))
3.000 1.100 1.100 peak 81 spectrum 1 weight 0.10000E+01 volume 0.62704E-02 ppm1 1.570 ppm2 8.571 CV 1
ASSI { 82}
( segid " " and resid 3 and name HB% )
( segid " " and resid 8 and name HD1%)
4.100 2.100 1.900 peak 82 spectrum 1 weight 0.10000E+01 volume 0.15419E-02 ppm1 1.574 ppm2 0.575 CV 1
ASSI { 83}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 3 and name HN ))
2.300 0.600 0.600 peak 83 spectrum 1 weight 0.10000E+01 volume 0.99686E-02 ppm1 1.570 ppm2 8.857 CV 1
ASSI { 85}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 4 and name HA ))
4.200 2.200 1.800 peak 85 spectrum 1 weight 0.10000E+01 volume 0.62936E-03 ppm1 1.571 ppm2 4.437 CV 1
ASSI { 89}
( segid " " and resid 20 and name HB% )
( segid " " and resid 16 and name HG2%)
4.300 2.300 1.700 peak 89 spectrum 1 weight 0.10000E+01 volume 0.10776E-02 ppm1 1.548 ppm2 1.205 CV 1
ASSI { 90}
( segid " " and resid 20 and name HB% )
(( segid " " and resid 19 and name HA ))
3.900 1.900 1.900 peak 90 spectrum 1 weight 0.10000E+01 volume 0.11753E-02 ppm1 1.548 ppm2 3.981 CV 1
ASSI { 93}
( segid " " and resid 20 and name HB% )
(( segid " " and resid 19 and name HB ))
2.500 0.800 0.800 peak 93 spectrum 1 weight 0.10000E+01 volume 0.74610E-02 ppm1 1.548 ppm2 1.655 CV 1
ASSI { 94}
( segid " " and resid 20 and name HB% )
(( segid " " and resid 20 and name HA ))
2.200 0.600 0.600 peak 94 spectrum 1 weight 0.10000E+01 volume 0.13447E-01 ppm1 1.548 ppm2 4.821 CV 1
ASSI { 96}
( segid " " and resid 20 and name HB% )
(( segid " " and resid 22 and name HN ))
3.500 1.600 1.600 peak 96 spectrum 1 weight 0.10000E+01 volume 0.29387E-02 ppm1 1.548 ppm2 6.419 CV 1
ASSI { 98}
( segid " " and resid 20 and name HB% )
(( segid " " and resid 20 and name HN ))
2.400 0.700 0.700 peak 98 spectrum 1 weight 0.10000E+01 volume 0.75064E-02 ppm1 1.548 ppm2 8.697 CV 1
ASSI { 99}
( segid " " and resid 20 and name HB% )
(( segid " " and resid 38 and name HB2 ))
3.600 1.700 1.700 peak 99 spectrum 1 weight 0.10000E+01 volume 0.68620E-03 ppm1 1.547 ppm2 3.152 CV 1
ASSI { 100}
( segid " " and resid 20 and name HB% )
(( segid " " and resid 38 and name HB1 ))
3.700 1.700 1.700 peak 100 spectrum 1 weight 0.10000E+01 volume 0.71487E-03 ppm1 1.549 ppm2 2.586 CV 1
ASSI { 101}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 34 and name HB ))
2.300 0.700 0.700 peak 101 spectrum 1 weight 0.10000E+01 volume 0.91046E-02 ppm1 1.305 ppm2 4.109 CV 1
ASSI { 102}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 67 and name HA ))
4.400 2.400 1.600 peak 102 spectrum 1 weight 0.10000E+01 volume 0.88095E-03 ppm1 1.295 ppm2 4.517 CV 1
ASSI { 104}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 4 and name HN ))
2.900 1.000 1.000 peak 104 spectrum 1 weight 0.10000E+01 volume 0.94288E-02 ppm1 1.374 ppm2 8.570 CV 1
ASSI { 105}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 4 and name HB ))
2.200 0.600 0.600 peak 105 spectrum 1 weight 0.10000E+01 volume 0.14163E-01 ppm1 1.374 ppm2 4.743 CV 1
ASSI { 106}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 4 and name HA ))
2.300 0.600 0.600 peak 106 spectrum 1 weight 0.10000E+01 volume 0.10646E-01 ppm1 1.375 ppm2 4.437 CV 1
ASSI { 108}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 34 and name HA ))
2.500 0.800 0.800 peak 108 spectrum 1 weight 0.10000E+01 volume 0.78163E-02 ppm1 1.305 ppm2 4.358 CV 1
ASSI { 110}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 5 and name HN ))
2.200 0.600 0.600 peak 110 spectrum 1 weight 0.10000E+01 volume 0.40361E-02 ppm1 1.375 ppm2 9.234 CV 1
ASSI { 112}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 6 and name HG2 ))
4.300 2.300 1.700 peak 112 spectrum 1 weight 0.10000E+01 volume 0.10484E-02 ppm1 1.375 ppm2 2.488 CV 1
ASSI { 113}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 34 and name HN ))
2.500 0.800 0.800 peak 113 spectrum 1 weight 0.10000E+01 volume 0.41799E-02 ppm1 1.305 ppm2 8.774 CV 1
ASSI { 114}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 3 and name HA ))
4.100 2.100 1.900 peak 114 spectrum 1 weight 0.10000E+01 volume 0.22038E-02 ppm1 1.374 ppm2 4.853 CV 1
ASSI { 115}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 40 and name HA ))
3.100 1.200 1.200 peak 115 spectrum 1 weight 0.10000E+01 volume 0.21005E-02 ppm1 1.305 ppm2 4.630 CV 1
ASSI { 116}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 33 and name HN ))
4.400 2.400 1.600 peak 116 spectrum 1 weight 0.10000E+01 volume 0.70322E-03 ppm1 1.303 ppm2 8.356 CV 1
ASSI { 117}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 3 and name HN ))
4.000 2.000 2.000 peak 117 spectrum 1 weight 0.10000E+01 volume 0.12129E-02 ppm1 1.375 ppm2 8.849 CV 1
ASSI { 118}
(( segid " " and resid 68 and name HD1 ))
(( segid " " and resid 68 and name HN ))
3.100 1.200 1.200 peak 118 spectrum 1 weight 0.10000E+01 volume 0.16595E-02 ppm1 1.496 ppm2 8.392 CV 1
ASSI { 119}
(( segid " " and resid 68 and name HD1 ))
(( segid " " and resid 68 and name HG2 ))
2.300 0.700 0.700 peak 119 spectrum 1 weight 0.10000E+01 volume 0.87030E-02 ppm1 1.500 ppm2 1.779 CV 1
OR { 119}
(( segid " " and resid 68 and name HD1 ))
(( segid " " and resid 68 and name HG1 ))
ASSI { 122}
(( segid " " and resid 68 and name HD2 ))
(( segid " " and resid 68 and name HG1 ))
2.300 0.700 0.700 peak 122 spectrum 1 weight 0.10000E+01 volume 0.87099E-02 ppm1 1.601 ppm2 1.779 CV 1
OR { 122}
(( segid " " and resid 68 and name HD2 ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 123}
(( segid " " and resid 68 and name HD2 ))
(( segid " " and resid 68 and name HA ))
3.300 1.400 1.400 peak 123 spectrum 1 weight 0.10000E+01 volume 0.12943E-02 ppm1 1.602 ppm2 4.533 CV 1
ASSI { 125}
(( segid " " and resid 68 and name HD1 ))
(( segid " " and resid 68 and name HB1 ))
3.200 1.300 1.300 peak 125 spectrum 1 weight 0.10000E+01 volume 0.19729E-02 ppm1 1.501 ppm2 2.113 CV 1
OR { 125}
(( segid " " and resid 68 and name HD1 ))
(( segid " " and resid 68 and name HB2 ))
ASSI { 127}
(( segid " " and resid 68 and name HD2 ))
(( segid " " and resid 68 and name HN ))
3.400 1.500 1.500 peak 127 spectrum 1 weight 0.10000E+01 volume 0.12809E-02 ppm1 1.606 ppm2 8.388 CV 1
ASSI { 129}
(( segid " " and resid 60 and name HG1 ))
(( segid " " and resid 60 and name HB2 ))
3.000 1.100 1.100 peak 129 spectrum 1 weight 0.10000E+01 volume 0.48950E-02 ppm1 1.917 ppm2 2.398 CV 1
ASSI { 130}
(( segid " " and resid 60 and name HG1 ))
(( segid " " and resid 60 and name HA ))
3.200 1.300 1.300 peak 130 spectrum 1 weight 0.10000E+01 volume 0.14760E-02 ppm1 1.916 ppm2 4.366 CV 1
ASSI { 134}
(( segid " " and resid 60 and name HG2 ))
(( segid " " and resid 60 and name HA ))
4.300 2.300 1.700 peak 134 spectrum 1 weight 0.10000E+01 volume 0.11300E-02 ppm1 2.015 ppm2 4.367 CV 1
ASSI { 135}
(( segid " " and resid 60 and name HG1 ))
(( segid " " and resid 60 and name HD1 ))
2.600 0.900 0.900 peak 135 spectrum 1 weight 0.10000E+01 volume 0.23148E-02 ppm1 1.917 ppm2 3.747 CV 1
ASSI { 136}
(( segid " " and resid 60 and name HG2 ))
(( segid " " and resid 60 and name HD1 ))
3.100 1.200 1.200 peak 136 spectrum 1 weight 0.10000E+01 volume 0.21797E-02 ppm1 2.015 ppm2 3.747 CV 1
ASSI { 137}
(( segid " " and resid 60 and name HG1 ))
(( segid " " and resid 60 and name HD2 ))
3.400 1.500 1.500 peak 137 spectrum 1 weight 0.10000E+01 volume 0.20887E-02 ppm1 1.917 ppm2 3.856 CV 1
ASSI { 138}
(( segid " " and resid 60 and name HG2 ))
(( segid " " and resid 60 and name HD2 ))
2.600 0.800 0.800 peak 138 spectrum 1 weight 0.10000E+01 volume 0.24161E-02 ppm1 2.016 ppm2 3.856 CV 1
ASSI { 141}
(( segid " " and resid 23 and name HG1 ))
(( segid " " and resid 23 and name HD1 ))
2.700 0.900 0.900 peak 141 spectrum 1 weight 0.10000E+01 volume 0.18796E-02 ppm1 1.963 ppm2 3.708 CV 1
ASSI { 142}
(( segid " " and resid 23 and name HG1 ))
(( segid " " and resid 23 and name HA ))
3.100 1.200 1.200 peak 142 spectrum 1 weight 0.10000E+01 volume 0.16842E-02 ppm1 1.963 ppm2 4.330 CV 1
ASSI { 143}
(( segid " " and resid 23 and name HG1 ))
(( segid " " and resid 23 and name HG2 ))
1.800 0.400 0.400 peak 143 spectrum 1 weight 0.10000E+01 volume 0.98077E-02 ppm1 1.966 ppm2 2.136 CV 1
ASSI { 146}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 23 and name HA ))
4.000 2.000 2.000 peak 146 spectrum 1 weight 0.10000E+01 volume 0.17601E-02 ppm1 2.138 ppm2 4.334 CV 1
ASSI { 152}
(( segid " " and resid 23 and name HG1 ))
(( segid " " and resid 23 and name HB1 ))
2.400 0.700 0.700 peak 152 spectrum 1 weight 0.10000E+01 volume 0.40405E-02 ppm1 1.965 ppm2 1.764 CV 1
ASSI { 156}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HN ))
2.400 0.700 0.700 peak 156 spectrum 1 weight 0.10000E+01 volume 0.75138E-02 ppm1 2.016 ppm2 9.261 CV 1
OR { 156}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 25 and name HN ))
ASSI { 165}
(( segid " " and resid 81 and name HB1 ))
(( segid " " and resid 81 and name HA ))
2.400 0.700 0.700 peak 165 spectrum 1 weight 0.10000E+01 volume 0.33773E-02 ppm1 2.150 ppm2 4.453 CV 1
ASSI { 166}
(( segid " " and resid 81 and name HB2 ))
(( segid " " and resid 81 and name HG1 ))
2.700 0.900 0.900 peak 166 spectrum 1 weight 0.10000E+01 volume 0.28210E-02 ppm1 2.356 ppm2 2.577 CV 1
ASSI { 168}
(( segid " " and resid 80 and name HB1 ))
(( segid " " and resid 81 and name HB1 ))
4.100 2.100 1.900 peak 168 spectrum 1 weight 0.10000E+01 volume 0.13843E-02 ppm1 2.581 ppm2 2.150 CV 1
ASSI { 178}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 5 and name HB1 ))
1.900 0.400 0.400 peak 178 spectrum 1 weight 0.10000E+01 volume 0.83077E-02 ppm1 2.202 ppm2 2.062 CV 1
ASSI { 180}
(( segid " " and resid 81 and name HB2 ))
( segid " " and resid 57 and name HG1%)
2.800 2.800 3.200 peak 180 spectrum 1 weight 0.10000E+01 volume 0.91253E-03 ppm1 2.350 ppm2 0.966 CV 1
ASSI { 183}
(( segid " " and resid 81 and name HB2 ))
(( segid " " and resid 81 and name HB1 ))
1.600 0.300 0.600 peak 183 spectrum 1 weight 0.10000E+01 volume 0.12748E-01 ppm1 2.356 ppm2 2.150 CV 1
ASSI { 186}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 57 and name HB ))
4.200 2.300 1.800 peak 186 spectrum 1 weight 0.10000E+01 volume 0.80605E-03 ppm1 3.643 ppm2 2.007 CV 1
ASSI { 187}
(( segid " " and resid 5 and name HB1 ))
( segid " " and resid 74 and name HG2%)
4.500 2.500 1.500 peak 187 spectrum 1 weight 0.10000E+01 volume 0.93952E-03 ppm1 2.052 ppm2 1.094 CV 1
ASSI { 188}
(( segid " " and resid 80 and name HB1 ))
(( segid " " and resid 81 and name HN ))
4.400 2.400 1.600 peak 188 spectrum 1 weight 0.10000E+01 volume 0.71314E-03 ppm1 2.566 ppm2 7.905 CV 1
ASSI { 190}
(( segid " " and resid 80 and name HB1 ))
( segid " " and resid 57 and name HG2%)
3.600 1.600 1.600 peak 190 spectrum 1 weight 0.10000E+01 volume 0.10673E-02 ppm1 2.557 ppm2 1.005 CV 1
ASSI { 191}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HN ))
2.900 1.100 1.100 peak 191 spectrum 1 weight 0.10000E+01 volume 0.14066E-02 ppm1 3.644 ppm2 7.728 CV 1
ASSI { 192}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HD2 ))
3.200 1.200 1.200 peak 192 spectrum 1 weight 0.10000E+01 volume 0.11265E-02 ppm1 3.644 ppm2 7.062 CV 1
ASSI { 195}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 80 and name HB1 ))
1.900 0.500 0.500 peak 195 spectrum 1 weight 0.10000E+01 volume 0.80995E-02 ppm1 3.642 ppm2 2.557 CV 1
ASSI { 199}
(( segid " " and resid 80 and name HB1 ))
(( segid " " and resid 80 and name HA ))
3.200 1.200 1.200 peak 199 spectrum 1 weight 0.10000E+01 volume 0.12995E-02 ppm1 2.559 ppm2 4.688 CV 1
ASSI { 200}
(( segid " " and resid 80 and name HB2 ))
( segid " " and resid 57 and name HG2%)
3.000 1.100 1.100 peak 200 spectrum 1 weight 0.10000E+01 volume 0.10913E-02 ppm1 3.641 ppm2 1.007 CV 1
ASSI { 201}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HB1 ))
1.700 0.400 0.500 peak 201 spectrum 1 weight 0.10000E+01 volume 0.19915E-01 ppm1 2.101 ppm2 1.995 CV 1
ASSI { 204}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HA ))
2.800 0.900 0.900 peak 204 spectrum 1 weight 0.10000E+01 volume 0.33540E-02 ppm1 2.101 ppm2 3.957 CV 1
ASSI { 206}
(( segid " " and resid 6 and name HB1 ))
(( segid " " and resid 6 and name HG2 ))
2.600 0.800 0.800 peak 206 spectrum 1 weight 0.10000E+01 volume 0.32020E-02 ppm1 1.994 ppm2 2.476 CV 1
ASSI { 207}
(( segid " " and resid 80 and name HB1 ))
(( segid " " and resid 80 and name HD2 ))
4.500 2.500 1.500 peak 207 spectrum 1 weight 0.10000E+01 volume 0.68156E-03 ppm1 2.556 ppm2 7.061 CV 1
ASSI { 208}
(( segid " " and resid 80 and name HB1 ))
( segid " " and resid 57 and name HG1%)
4.800 2.900 1.200 peak 208 spectrum 1 weight 0.10000E+01 volume 0.10161E-02 ppm1 2.561 ppm2 0.953 CV 1
ASSI { 209}
(( segid " " and resid 6 and name HB1 ))
(( segid " " and resid 6 and name HG1 ))
2.800 1.000 1.000 peak 209 spectrum 1 weight 0.10000E+01 volume 0.52002E-02 ppm1 1.994 ppm2 2.344 CV 1
ASSI { 212}
(( segid " " and resid 6 and name HB1 ))
(( segid " " and resid 6 and name HN ))
2.600 0.800 0.800 peak 212 spectrum 1 weight 0.10000E+01 volume 0.36885E-02 ppm1 1.995 ppm2 8.848 CV 1
ASSI { 220}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HG2 ))
2.800 1.000 1.000 peak 220 spectrum 1 weight 0.10000E+01 volume 0.29442E-02 ppm1 2.357 ppm2 2.486 CV 1
ASSI { 221}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 46 and name HN ))
2.900 1.100 1.100 peak 221 spectrum 1 weight 0.10000E+01 volume 0.19894E-02 ppm1 2.161 ppm2 6.953 CV 1
ASSI { 225}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 46 and name HG2 ))
2.400 0.700 0.700 peak 225 spectrum 1 weight 0.10000E+01 volume 0.57158E-02 ppm1 2.165 ppm2 2.492 CV 1
ASSI { 231}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HB1 ))
1.700 0.300 0.500 peak 231 spectrum 1 weight 0.10000E+01 volume 0.15898E-01 ppm1 2.301 ppm2 2.169 CV 1
ASSI { 234}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HA ))
2.300 0.700 0.700 peak 234 spectrum 1 weight 0.10000E+01 volume 0.66395E-02 ppm1 2.308 ppm2 3.956 CV 1
ASSI { 236}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 13 and name HA ))
3.300 1.400 1.400 peak 236 spectrum 1 weight 0.10000E+01 volume 0.35749E-02 ppm1 2.343 ppm2 4.059 CV 1
ASSI { 239}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 14 and name HA ))
3.100 1.200 1.200 peak 239 spectrum 1 weight 0.10000E+01 volume 0.31616E-02 ppm1 2.254 ppm2 3.955 CV 1
ASSI { 240}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 14 and name HG2 ))
2.700 0.900 0.900 peak 240 spectrum 1 weight 0.10000E+01 volume 0.28070E-02 ppm1 2.241 ppm2 2.629 CV 1
ASSI { 242}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 14 and name HN ))
2.700 0.900 0.900 peak 242 spectrum 1 weight 0.10000E+01 volume 0.32562E-02 ppm1 2.242 ppm2 7.839 CV 1
ASSI { 243}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HG2 ))
3.200 1.200 1.200 peak 243 spectrum 1 weight 0.10000E+01 volume 0.23731E-02 ppm1 2.319 ppm2 2.629 CV 1
ASSI { 248}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 24 and name HA ))
4.100 2.100 1.900 peak 248 spectrum 1 weight 0.10000E+01 volume 0.75089E-03 ppm1 2.346 ppm2 3.623 CV 1
ASSI { 249}
(( segid " " and resid 27 and name HB ))
( segid " " and resid 27 and name HG1%)
2.200 0.600 0.600 peak 249 spectrum 1 weight 0.10000E+01 volume 0.75834E-02 ppm1 2.345 ppm2 0.745 CV 1
ASSI { 251}
(( segid " " and resid 53 and name HB1 ))
( segid " " and resid 57 and name HG1%)
3.600 1.600 1.600 peak 251 spectrum 1 weight 0.10000E+01 volume 0.27391E-02 ppm1 2.079 ppm2 0.957 CV 1
ASSI { 252}
(( segid " " and resid 53 and name HB1 ))
(( segid " " and resid 54 and name HN ))
3.700 1.700 1.700 peak 252 spectrum 1 weight 0.10000E+01 volume 0.14557E-02 ppm1 2.078 ppm2 8.172 CV 1
ASSI { 253}
(( segid " " and resid 53 and name HB1 ))
(( segid " " and resid 50 and name HA ))
4.000 2.000 2.000 peak 253 spectrum 1 weight 0.10000E+01 volume 0.12563E-02 ppm1 2.078 ppm2 4.261 CV 1
ASSI { 254}
(( segid " " and resid 53 and name HB1 ))
(( segid " " and resid 53 and name HA ))
2.700 0.900 0.900 peak 254 spectrum 1 weight 0.10000E+01 volume 0.31910E-02 ppm1 2.077 ppm2 4.149 CV 1
ASSI { 256}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 54 and name HN ))
2.900 1.100 1.100 peak 256 spectrum 1 weight 0.10000E+01 volume 0.14216E-02 ppm1 2.159 ppm2 8.169 CV 1
ASSI { 257}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 50 and name HA ))
3.000 1.100 1.100 peak 257 spectrum 1 weight 0.10000E+01 volume 0.15377E-02 ppm1 2.162 ppm2 4.262 CV 1
ASSI { 260}
(( segid " " and resid 77 and name HG12))
( segid " " and resid 59 and name HG2%)
3.100 1.200 1.200 peak 260 spectrum 1 weight 0.10000E+01 volume 0.89768E-03 ppm1 0.949 ppm2 0.617 CV 1
ASSI { 262}
(( segid " " and resid 77 and name HG12))
(( segid " " and resid 77 and name HG11))
1.900 0.400 0.400 peak 262 spectrum 1 weight 0.10000E+01 volume 0.55806E-02 ppm1 0.954 ppm2 2.031 CV 1
ASSI { 264}
(( segid " " and resid 77 and name HG11))
(( segid " " and resid 77 and name HA ))
3.000 1.100 1.100 peak 264 spectrum 1 weight 0.10000E+01 volume 0.16767E-02 ppm1 2.034 ppm2 3.535 CV 1
ASSI { 267}
(( segid " " and resid 77 and name HG11))
( segid " " and resid 76 and name HD% )
3.300 1.400 1.400 peak 267 spectrum 1 weight 0.10000E+01 volume 0.72893E-03 ppm1 2.033 ppm2 6.806 CV 1
ASSI { 269}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 49 and name HA ))
4.000 2.000 2.000 peak 269 spectrum 1 weight 0.10000E+01 volume 0.10987E-02 ppm1 2.170 ppm2 3.983 CV 1
ASSI { 271}
(( segid " " and resid 77 and name HG11))
( segid " " and resid 59 and name HG2%)
3.500 1.600 1.600 peak 271 spectrum 1 weight 0.10000E+01 volume 0.89304E-03 ppm1 2.034 ppm2 0.615 CV 1
ASSI { 274}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HG2 ))
3.100 1.200 1.200 peak 274 spectrum 1 weight 0.10000E+01 volume 0.17431E-02 ppm1 2.544 ppm2 2.876 CV 1
ASSI { 277}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HB1 ))
1.800 0.400 0.400 peak 277 spectrum 1 weight 0.10000E+01 volume 0.71521E-02 ppm1 2.539 ppm2 2.158 CV 1
ASSI { 278}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 49 and name HA ))
4.500 2.500 1.500 peak 278 spectrum 1 weight 0.10000E+01 volume 0.12979E-02 ppm1 2.546 ppm2 3.984 CV 1
ASSI { 282}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 7 and name HA ))
2.700 0.900 0.900 peak 282 spectrum 1 weight 0.10000E+01 volume 0.36783E-02 ppm1 2.132 ppm2 4.144 CV 1
ASSI { 283}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HB1 ))
1.800 0.400 0.400 peak 283 spectrum 1 weight 0.10000E+01 volume 0.89354E-02 ppm1 2.510 ppm2 2.133 CV 1
ASSI { 284}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HG1 ))
2.200 2.200 3.800 peak 284 spectrum 1 weight 0.10000E+01 volume 0.44544E-02 ppm1 2.514 ppm2 2.393 CV 1
ASSI { 285}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 52 and name HG1 ))
2.600 0.900 0.900 peak 285 spectrum 1 weight 0.10000E+01 volume 0.48347E-02 ppm1 2.135 ppm2 2.392 CV 1
ASSI { 287}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 52 and name HN ))
3.000 1.100 1.100 peak 287 spectrum 1 weight 0.10000E+01 volume 0.14922E-02 ppm1 2.174 ppm2 8.931 CV 1
ASSI { 289}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HA ))
3.000 1.200 1.200 peak 289 spectrum 1 weight 0.10000E+01 volume 0.22282E-02 ppm1 2.506 ppm2 4.145 CV 1
ASSI { 290}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 7 and name HN ))
3.200 1.300 1.300 peak 290 spectrum 1 weight 0.10000E+01 volume 0.25951E-02 ppm1 2.130 ppm2 7.694 CV 1
ASSI { 292}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HN ))
2.400 0.700 0.700 peak 292 spectrum 1 weight 0.10000E+01 volume 0.32099E-02 ppm1 2.505 ppm2 7.694 CV 1
ASSI { 294}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 8 and name HN ))
3.300 1.400 1.400 peak 294 spectrum 1 weight 0.10000E+01 volume 0.94766E-03 ppm1 2.129 ppm2 8.409 CV 1
ASSI { 296}
(( segid " " and resid 7 and name HB1 ))
( segid " " and resid 3 and name HB% )
2.800 1.000 1.000 peak 296 spectrum 1 weight 0.10000E+01 volume 0.23250E-02 ppm1 2.130 ppm2 1.570 CV 1
ASSI { 297}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 8 and name HN ))
3.100 1.200 1.200 peak 297 spectrum 1 weight 0.10000E+01 volume 0.10260E-02 ppm1 2.504 ppm2 8.411 CV 1
ASSI { 301}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 54 and name HA ))
2.900 1.000 1.000 peak 301 spectrum 1 weight 0.10000E+01 volume 0.22618E-02 ppm1 1.095 ppm2 3.946 CV 1
ASSI { 302}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 54 and name HG2 ))
2.400 0.700 0.700 peak 302 spectrum 1 weight 0.10000E+01 volume 0.36067E-02 ppm1 1.094 ppm2 0.871 CV 1
ASSI { 303}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HA ))
2.700 0.900 0.900 peak 303 spectrum 1 weight 0.10000E+01 volume 0.33262E-02 ppm1 1.586 ppm2 3.943 CV 1
ASSI { 305}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 54 and name HB2 ))
1.900 0.400 0.400 peak 305 spectrum 1 weight 0.10000E+01 volume 0.76599E-02 ppm1 1.094 ppm2 1.586 CV 1
ASSI { 306}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HG1 ))
2.700 0.900 0.900 peak 306 spectrum 1 weight 0.10000E+01 volume 0.18702E-02 ppm1 1.587 ppm2 0.701 CV 1
ASSI { 307}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HN ))
3.400 1.400 1.400 peak 307 spectrum 1 weight 0.10000E+01 volume 0.36983E-02 ppm1 1.587 ppm2 8.174 CV 1
ASSI { 308}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HG2 ))
3.100 1.200 1.200 peak 308 spectrum 1 weight 0.10000E+01 volume 0.28325E-02 ppm1 1.587 ppm2 0.871 CV 1
ASSI { 311}
(( segid " " and resid 54 and name HB1 ))
( segid " " and resid 15 and name HD1%)
3.700 1.700 1.700 peak 311 spectrum 1 weight 0.10000E+01 volume 0.12599E-02 ppm1 1.095 ppm2 0.762 CV 1
ASSI { 313}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 15 and name HD1%)
4.200 2.200 1.800 peak 313 spectrum 1 weight 0.10000E+01 volume 0.13985E-02 ppm1 1.587 ppm2 0.763 CV 1
ASSI { 314}
(( segid " " and resid 44 and name HB2 ))
( segid " " and resid 39 and name HG1%)
4.000 2.000 2.000 peak 314 spectrum 1 weight 0.10000E+01 volume 0.11775E-02 ppm1 2.022 ppm2 0.841 CV 1
ASSI { 316}
(( segid " " and resid 44 and name HB1 ))
(( segid " " and resid 44 and name HA ))
2.400 0.700 0.700 peak 316 spectrum 1 weight 0.10000E+01 volume 0.20824E-02 ppm1 1.864 ppm2 4.022 CV 1
ASSI { 318}
(( segid " " and resid 44 and name HB1 ))
(( segid " " and resid 44 and name HB2 ))
1.800 0.400 0.400 peak 318 spectrum 1 weight 0.10000E+01 volume 0.51607E-02 ppm1 1.866 ppm2 2.020 CV 1
ASSI { 320}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HG1 ))
2.600 0.800 0.800 peak 320 spectrum 1 weight 0.10000E+01 volume 0.14453E-02 ppm1 2.024 ppm2 2.175 CV 1
ASSI { 323}
(( segid " " and resid 44 and name HB1 ))
( segid " " and resid 45 and name HG2%)
5.000 3.100 1.000 peak 323 spectrum 1 weight 0.10000E+01 volume 0.78617E-03 ppm1 1.866 ppm2 1.132 CV 1
ASSI { 326}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HA ))
2.600 0.800 0.800 peak 326 spectrum 1 weight 0.10000E+01 volume 0.21121E-02 ppm1 2.020 ppm2 4.022 CV 1
ASSI { 327}
(( segid " " and resid 44 and name HB1 ))
(( segid " " and resid 44 and name HG1 ))
3.100 1.200 1.200 peak 327 spectrum 1 weight 0.10000E+01 volume 0.12374E-02 ppm1 1.866 ppm2 2.176 CV 1
ASSI { 330}
(( segid " " and resid 44 and name HB2 ))
( segid " " and resid 45 and name HG2%)
4.100 2.100 1.900 peak 330 spectrum 1 weight 0.10000E+01 volume 0.11489E-02 ppm1 2.022 ppm2 1.134 CV 1
ASSI { 361}
(( segid " " and resid 64 and name HB ))
( segid " " and resid 64 and name HG1%)
2.200 0.600 0.600 peak 361 spectrum 1 weight 0.10000E+01 volume 0.54770E-02 ppm1 2.070 ppm2 0.775 CV 1
ASSI { 370}
(( segid " " and resid 48 and name HB ))
(( segid " " and resid 44 and name HA ))
3.000 1.100 1.100 peak 370 spectrum 1 weight 0.10000E+01 volume 0.38608E-02 ppm1 2.383 ppm2 4.028 CV 1
ASSI { 379}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 20 and name HN ))
3.500 1.600 1.600 peak 379 spectrum 1 weight 0.10000E+01 volume 0.18178E-02 ppm1 2.266 ppm2 8.689 CV 1
ASSI { 387}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 70 and name HA ))
2.900 1.100 1.100 peak 387 spectrum 1 weight 0.10000E+01 volume 0.10355E-02 ppm1 2.271 ppm2 3.333 CV 1
ASSI { 388}
(( segid " " and resid 48 and name HB ))
(( segid " " and resid 48 and name HA ))
3.200 1.300 1.300 peak 388 spectrum 1 weight 0.10000E+01 volume 0.11028E-02 ppm1 2.384 ppm2 3.416 CV 1
ASSI { 394}
(( segid " " and resid 48 and name HB ))
( segid " " and resid 45 and name HG2%)
4.400 2.400 1.600 peak 394 spectrum 1 weight 0.10000E+01 volume 0.13537E-02 ppm1 2.381 ppm2 1.133 CV 1
ASSI { 396}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 13 and name HA ))
2.700 0.900 0.900 peak 396 spectrum 1 weight 0.10000E+01 volume 0.22514E-02 ppm1 2.266 ppm2 4.058 CV 1
ASSI { 397}
(( segid " " and resid 70 and name HB ))
( segid " " and resid 70 and name HG2%)
2.300 0.700 0.700 peak 397 spectrum 1 weight 0.10000E+01 volume 0.59166E-02 ppm1 2.271 ppm2 0.641 CV 1
ASSI { 399}
(( segid " " and resid 48 and name HB ))
( segid " " and resid 48 and name HG1%)
2.300 0.700 0.700 peak 399 spectrum 1 weight 0.10000E+01 volume 0.54785E-02 ppm1 2.383 ppm2 0.637 CV 1
ASSI { 402}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 16 and name HA ))
2.500 0.800 0.800 peak 402 spectrum 1 weight 0.10000E+01 volume 0.51518E-02 ppm1 2.271 ppm2 3.578 CV 1
ASSI { 403}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 45 and name HA ))
2.700 0.900 0.900 peak 403 spectrum 1 weight 0.10000E+01 volume 0.34936E-02 ppm1 2.235 ppm2 3.527 CV 1
ASSI { 406}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 9 and name HA ))
3.000 1.100 1.100 peak 406 spectrum 1 weight 0.10000E+01 volume 0.19790E-02 ppm1 2.027 ppm2 3.388 CV 1
ASSI { 411}
(( segid " " and resid 48 and name HB ))
( segid " " and resid 48 and name HG2%)
2.200 0.600 0.600 peak 411 spectrum 1 weight 0.10000E+01 volume 0.64865E-02 ppm1 2.382 ppm2 0.965 CV 1
ASSI { 413}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 16 and name HG1%)
2.200 0.600 0.600 peak 413 spectrum 1 weight 0.10000E+01 volume 0.74240E-02 ppm1 2.268 ppm2 1.009 CV 1
ASSI { 414}
(( segid " " and resid 9 and name HB ))
( segid " " and resid 9 and name HG2%)
2.300 0.600 0.600 peak 414 spectrum 1 weight 0.10000E+01 volume 0.72903E-02 ppm1 2.027 ppm2 1.055 CV 1
ASSI { 415}
(( segid " " and resid 9 and name HB ))
( segid " " and resid 74 and name HG2%)
3.300 1.400 1.400 peak 415 spectrum 1 weight 0.10000E+01 volume 0.41185E-02 ppm1 2.026 ppm2 1.095 CV 1
ASSI { 418}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 16 and name HG2%)
2.300 0.700 0.700 peak 418 spectrum 1 weight 0.10000E+01 volume 0.63745E-02 ppm1 2.267 ppm2 1.195 CV 1
ASSI { 420}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 6 and name HA ))
2.700 0.900 0.900 peak 420 spectrum 1 weight 0.10000E+01 volume 0.22196E-02 ppm1 2.031 ppm2 3.960 CV 1
ASSI { 421}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 63 and name HN ))
3.000 3.000 3.000 peak 421 spectrum 1 weight 0.10000E+01 volume 0.51444E-02 ppm1 2.069 ppm2 7.543 CV 1
ASSI { 422}
(( segid " " and resid 64 and name HB ))
( segid " " and resid 64 and name HG2%)
2.100 0.600 0.600 peak 422 spectrum 1 weight 0.10000E+01 volume 0.59176E-02 ppm1 2.071 ppm2 0.937 CV 1
ASSI { 425}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 64 and name HA ))
2.800 1.000 1.000 peak 425 spectrum 1 weight 0.10000E+01 volume 0.15399E-02 ppm1 2.070 ppm2 3.082 CV 1
ASSI { 427}
(( segid " " and resid 45 and name HB ))
( segid " " and resid 45 and name HG2%)
2.100 0.600 0.600 peak 427 spectrum 1 weight 0.10000E+01 volume 0.88623E-02 ppm1 2.233 ppm2 1.119 CV 1
ASSI { 429}
(( segid " " and resid 39 and name HB ))
(( segid " " and resid 39 and name HA ))
2.900 1.000 1.000 peak 429 spectrum 1 weight 0.10000E+01 volume 0.13843E-02 ppm1 1.986 ppm2 3.995 CV 1
ASSI { 430}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name HG1 ))
2.800 1.000 1.000 peak 430 spectrum 1 weight 0.10000E+01 volume 0.42787E-02 ppm1 1.987 ppm2 1.675 CV 1
ASSI { 432}
(( segid " " and resid 39 and name HB ))
(( segid " " and resid 33 and name HB2 ))
4.400 2.400 1.600 peak 432 spectrum 1 weight 0.10000E+01 volume 0.20884E-02 ppm1 1.988 ppm2 3.212 CV 1
ASSI { 433}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 46 and name HN ))
2.700 0.900 0.900 peak 433 spectrum 1 weight 0.10000E+01 volume 0.32931E-02 ppm1 2.231 ppm2 6.955 CV 1
ASSI { 434}
(( segid " " and resid 39 and name HB ))
( segid " " and resid 39 and name HG2%)
2.000 0.500 0.500 peak 434 spectrum 1 weight 0.10000E+01 volume 0.61515E-02 ppm1 1.988 ppm2 0.947 CV 1
ASSI { 435}
(( segid " " and resid 39 and name HB ))
( segid " " and resid 39 and name HG1%)
2.100 0.600 0.600 peak 435 spectrum 1 weight 0.10000E+01 volume 0.59936E-02 ppm1 1.988 ppm2 0.841 CV 1
ASSI { 436}
(( segid " " and resid 39 and name HB ))
(( segid " " and resid 33 and name HB1 ))
3.600 1.600 1.600 peak 436 spectrum 1 weight 0.10000E+01 volume 0.11554E-02 ppm1 1.987 ppm2 3.149 CV 1
ASSI { 437}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 42 and name HA ))
3.200 1.300 1.300 peak 437 spectrum 1 weight 0.10000E+01 volume 0.93997E-03 ppm1 2.233 ppm2 4.288 CV 1
ASSI { 441}
(( segid " " and resid 39 and name HB ))
(( segid " " and resid 34 and name HA ))
4.000 2.000 2.000 peak 441 spectrum 1 weight 0.10000E+01 volume 0.60582E-03 ppm1 1.986 ppm2 4.357 CV 1
ASSI { 442}
(( segid " " and resid 39 and name HB ))
(( segid " " and resid 33 and name HA ))
3.900 1.900 1.900 peak 442 spectrum 1 weight 0.10000E+01 volume 0.79776E-03 ppm1 1.986 ppm2 4.098 CV 1
ASSI { 443}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HE1 ))
4.200 2.200 1.800 peak 443 spectrum 1 weight 0.10000E+01 volume 0.62378E-03 ppm1 1.813 ppm2 3.022 CV 1
OR { 443}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HE2 ))
OR { 443}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HE1 ))
OR { 443}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HE2 ))
ASSI { 444}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HA ))
2.300 0.700 0.700 peak 444 spectrum 1 weight 0.10000E+01 volume 0.81010E-02 ppm1 1.813 ppm2 4.033 CV 1
OR { 444}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HA ))
ASSI { 445}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HD2 ))
2.800 1.000 1.000 peak 445 spectrum 1 weight 0.10000E+01 volume 0.39219E-02 ppm1 1.814 ppm2 1.451 CV 1
OR { 445}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HD2 ))
ASSI { 447}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HG2 ))
2.600 0.900 0.900 peak 447 spectrum 1 weight 0.10000E+01 volume 0.39138E-02 ppm1 1.813 ppm2 1.684 CV 1
OR { 447}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HG1 ))
OR { 447}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HG1 ))
OR { 447}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HG2 ))
ASSI { 448}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HD1 ))
3.000 1.100 1.100 peak 448 spectrum 1 weight 0.10000E+01 volume 0.31829E-02 ppm1 1.814 ppm2 1.355 CV 1
OR { 448}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 65 and name HD1 ))
ASSI { 449}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 44 and name HB1 ))
3.700 3.700 2.300 peak 449 spectrum 1 weight 0.10000E+01 volume 0.43255E-02 ppm1 2.062 ppm2 1.853 CV 1
ASSI { 455}
(( segid " " and resid 49 and name HB ))
( segid " " and resid 49 and name HG1%)
2.000 0.500 0.500 peak 455 spectrum 1 weight 0.10000E+01 volume 0.15923E-01 ppm1 2.065 ppm2 1.000 CV 1
ASSI { 457}
(( segid " " and resid 49 and name HB ))
(( segid " " and resid 46 and name HA ))
2.700 0.900 0.900 peak 457 spectrum 1 weight 0.10000E+01 volume 0.31483E-02 ppm1 2.067 ppm2 4.048 CV 1
ASSI { 458}
(( segid " " and resid 49 and name HB ))
(( segid " " and resid 49 and name HA ))
2.800 1.000 1.000 peak 458 spectrum 1 weight 0.10000E+01 volume 0.20267E-02 ppm1 2.065 ppm2 3.980 CV 1
ASSI { 460}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 31 and name HB1 ))
3.300 1.300 1.300 peak 460 spectrum 1 weight 0.10000E+01 volume 0.23616E-02 ppm1 1.375 ppm2 1.813 CV 1
ASSI { 462}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 32 and name HN ))
4.800 2.900 1.200 peak 462 spectrum 1 weight 0.10000E+01 volume 0.76599E-03 ppm1 1.390 ppm2 10.103 CV 1
ASSI { 463}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 25 and name HN ))
3.100 1.200 1.200 peak 463 spectrum 1 weight 0.10000E+01 volume 0.12775E-02 ppm1 2.370 ppm2 9.260 CV 1
ASSI { 464}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 23 and name HA ))
2.600 0.900 0.900 peak 464 spectrum 1 weight 0.10000E+01 volume 0.25339E-02 ppm1 1.766 ppm2 4.325 CV 1
ASSI { 466}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HG2 ))
2.300 0.700 0.700 peak 466 spectrum 1 weight 0.10000E+01 volume 0.50965E-02 ppm1 2.370 ppm2 2.136 CV 1
ASSI { 467}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 28 and name HN ))
2.500 0.800 0.800 peak 467 spectrum 1 weight 0.10000E+01 volume 0.88574E-03 ppm1 2.078 ppm2 6.313 CV 1
ASSI { 468}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HA ))
2.800 1.000 1.000 peak 468 spectrum 1 weight 0.10000E+01 volume 0.56285E-02 ppm1 2.370 ppm2 4.325 CV 1
ASSI { 469}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 25 and name HG1 ))
4.100 2.100 1.900 peak 469 spectrum 1 weight 0.10000E+01 volume 0.99750E-03 ppm1 1.766 ppm2 2.303 CV 1
OR { 469}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 25 and name HG2 ))
ASSI { 470}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HG1 ))
2.900 1.100 1.100 peak 470 spectrum 1 weight 0.10000E+01 volume 0.52480E-02 ppm1 2.371 ppm2 1.962 CV 1
ASSI { 471}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 36 and name HB2 ))
4.500 2.600 1.500 peak 471 spectrum 1 weight 0.10000E+01 volume 0.73268E-03 ppm1 1.390 ppm2 3.078 CV 1
ASSI { 472}
(( segid " " and resid 31 and name HD2 ))
( segid " " and resid 70 and name HG1%)
3.500 1.500 1.500 peak 472 spectrum 1 weight 0.10000E+01 volume 0.14628E-02 ppm1 2.074 ppm2 0.444 CV 1
ASSI { 474}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 32 and name HN ))
5.200 3.300 0.800 peak 474 spectrum 1 weight 0.10000E+01 volume 0.55762E-03 ppm1 2.074 ppm2 10.105 CV 1
ASSI { 475}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 25 and name HN ))
3.600 1.600 1.600 peak 475 spectrum 1 weight 0.10000E+01 volume 0.10956E-02 ppm1 1.766 ppm2 9.261 CV 1
ASSI { 478}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 23 and name HB2 ))
1.700 0.400 0.500 peak 478 spectrum 1 weight 0.10000E+01 volume 0.11447E-01 ppm1 1.767 ppm2 2.368 CV 1
ASSI { 479}
(( segid " " and resid 31 and name HD1 ))
( segid " " and resid 37 and name HD2%)
2.700 0.900 0.900 peak 479 spectrum 1 weight 0.10000E+01 volume 0.12094E-02 ppm1 1.390 ppm2 0.773 CV 1
ASSI { 481}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 23 and name HG2 ))
2.700 0.900 0.900 peak 481 spectrum 1 weight 0.10000E+01 volume 0.43042E-02 ppm1 1.766 ppm2 2.136 CV 1
ASSI { 482}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HD1 ))
4.100 2.100 1.900 peak 482 spectrum 1 weight 0.10000E+01 volume 0.12112E-02 ppm1 2.371 ppm2 3.706 CV 1
ASSI { 483}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 23 and name HD1 ))
4.100 2.100 1.900 peak 483 spectrum 1 weight 0.10000E+01 volume 0.13476E-02 ppm1 1.766 ppm2 3.705 CV 1
ASSI { 484}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 31 and name HA ))
4.600 2.600 1.400 peak 484 spectrum 1 weight 0.10000E+01 volume 0.12559E-02 ppm1 1.392 ppm2 4.380 CV 1
ASSI { 485}
(( segid " " and resid 31 and name HD1 ))
( segid " " and resid 70 and name HG1%)
3.100 1.200 1.200 peak 485 spectrum 1 weight 0.10000E+01 volume 0.76160E-03 ppm1 1.392 ppm2 0.444 CV 1
ASSI { 486}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HD1 ))
1.600 0.300 0.600 peak 486 spectrum 1 weight 0.10000E+01 volume 0.61658E-02 ppm1 2.075 ppm2 1.381 CV 1
ASSI { 487}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HN ))
3.000 1.100 1.100 peak 487 spectrum 1 weight 0.10000E+01 volume 0.23351E-02 ppm1 2.078 ppm2 7.497 CV 1
ASSI { 490}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HA ))
4.400 2.400 1.600 peak 490 spectrum 1 weight 0.10000E+01 volume 0.10003E-02 ppm1 2.075 ppm2 4.381 CV 1
ASSI { 491}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 31 and name HG2 ))
2.500 0.800 0.800 peak 491 spectrum 1 weight 0.10000E+01 volume 0.12750E-02 ppm1 1.391 ppm2 1.582 CV 1
ASSI { 495}
(( segid " " and resid 31 and name HD2 ))
( segid " " and resid 37 and name HD1%)
4.100 2.100 1.900 peak 495 spectrum 1 weight 0.10000E+01 volume 0.98408E-03 ppm1 2.073 ppm2 0.590 CV 1
ASSI { 497}
(( segid " " and resid 31 and name HD1 ))
( segid " " and resid 37 and name HD1%)
3.000 1.100 1.100 peak 497 spectrum 1 weight 0.10000E+01 volume 0.69178E-03 ppm1 1.393 ppm2 0.590 CV 1
ASSI { 498}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 28 and name HN ))
3.300 1.400 1.400 peak 498 spectrum 1 weight 0.10000E+01 volume 0.64382E-03 ppm1 1.389 ppm2 6.313 CV 1
ASSI { 500}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 43 and name HB2 ))
3.700 1.800 1.800 peak 500 spectrum 1 weight 0.10000E+01 volume 0.10941E-02 ppm1 2.526 ppm2 4.023 CV 1
ASSI { 501}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 44 and name HB2 ))
3.000 1.100 1.100 peak 501 spectrum 1 weight 0.10000E+01 volume 0.19568E-02 ppm1 2.527 ppm2 2.023 CV 1
ASSI { 502}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 44 and name HA ))
3.600 1.600 1.600 peak 502 spectrum 1 weight 0.10000E+01 volume 0.10365E-02 ppm1 2.180 ppm2 4.024 CV 1
ASSI { 504}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 44 and name HB1 ))
2.500 0.800 0.800 peak 504 spectrum 1 weight 0.10000E+01 volume 0.17260E-02 ppm1 2.526 ppm2 1.870 CV 1
ASSI { 506}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 72 and name HA ))
3.600 1.600 1.600 peak 506 spectrum 1 weight 0.10000E+01 volume 0.77378E-03 ppm1 1.948 ppm2 4.524 CV 1
OR { 506}
(( segid " " and resid 75 and name HB1 ))
(( segid " " and resid 72 and name HA ))
ASSI { 507}
(( segid " " and resid 44 and name HG1 ))
( segid " " and resid 45 and name HG2%)
2.500 0.800 0.800 peak 507 spectrum 1 weight 0.10000E+01 volume 0.27015E-02 ppm1 2.180 ppm2 1.137 CV 1
ASSI { 508}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 65 and name HN ))
3.800 1.800 1.800 peak 508 spectrum 1 weight 0.10000E+01 volume 0.12508E-02 ppm1 2.182 ppm2 7.442 CV 1
ASSI { 509}
(( segid " " and resid 75 and name HB1 ))
(( segid " " and resid 75 and name HA ))
2.800 1.000 1.000 peak 509 spectrum 1 weight 0.10000E+01 volume 0.27540E-02 ppm1 1.955 ppm2 3.941 CV 1
OR { 509}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name HA ))
ASSI { 511}
(( segid " " and resid 44 and name HG2 ))
( segid " " and resid 45 and name HG2%)
3.600 1.600 1.600 peak 511 spectrum 1 weight 0.10000E+01 volume 0.27242E-02 ppm1 2.528 ppm2 1.138 CV 1
ASSI { 512}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 44 and name HG2 ))
1.600 0.300 0.600 peak 512 spectrum 1 weight 0.10000E+01 volume 0.94367E-02 ppm1 2.181 ppm2 2.524 CV 1
ASSI { 513}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 65 and name HN ))
4.400 2.400 1.600 peak 513 spectrum 1 weight 0.10000E+01 volume 0.13946E-02 ppm1 2.527 ppm2 7.443 CV 1
ASSI { 517}
(( segid " " and resid 44 and name HG2 ))
(( segid " " and resid 44 and name HA ))
3.600 1.600 1.600 peak 517 spectrum 1 weight 0.10000E+01 volume 0.10894E-02 ppm1 2.524 ppm2 4.021 CV 1
ASSI { 521}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HB1 ))
1.600 0.300 0.600 peak 521 spectrum 1 weight 0.10000E+01 volume 0.17701E-01 ppm1 2.400 ppm2 1.919 CV 1
ASSI { 522}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HA ))
2.800 1.000 1.000 peak 522 spectrum 1 weight 0.10000E+01 volume 0.55406E-02 ppm1 2.399 ppm2 4.366 CV 1
ASSI { 532}
(( segid " " and resid 81 and name HG2 ))
(( segid " " and resid 81 and name HG1 ))
1.800 0.400 0.400 peak 532 spectrum 1 weight 0.10000E+01 volume 0.11675E-01 ppm1 2.719 ppm2 2.575 CV 1
ASSI { 533}
(( segid " " and resid 81 and name HG2 ))
(( segid " " and resid 81 and name HB2 ))
3.100 1.200 1.200 peak 533 spectrum 1 weight 0.10000E+01 volume 0.26614E-02 ppm1 2.718 ppm2 2.356 CV 1
ASSI { 534}
(( segid " " and resid 81 and name HG1 ))
(( segid " " and resid 81 and name HE21))
3.000 1.100 1.100 peak 534 spectrum 1 weight 0.10000E+01 volume 0.20624E-02 ppm1 2.580 ppm2 7.765 CV 1
ASSI { 535}
(( segid " " and resid 81 and name HG1 ))
(( segid " " and resid 81 and name HE22))
4.100 2.100 1.900 peak 535 spectrum 1 weight 0.10000E+01 volume 0.10267E-02 ppm1 2.581 ppm2 7.709 CV 1
ASSI { 537}
(( segid " " and resid 81 and name HG2 ))
( segid " " and resid 2 and name HB% )
4.100 2.100 1.900 peak 537 spectrum 1 weight 0.10000E+01 volume 0.67702E-03 ppm1 2.717 ppm2 1.520 CV 1
ASSI { 539}
(( segid " " and resid 81 and name HG2 ))
(( segid " " and resid 81 and name HE22))
3.900 1.900 1.900 peak 539 spectrum 1 weight 0.10000E+01 volume 0.11557E-02 ppm1 2.718 ppm2 7.709 CV 1
ASSI { 543}
(( segid " " and resid 81 and name HG2 ))
(( segid " " and resid 81 and name HE21))
2.700 0.900 0.900 peak 543 spectrum 1 weight 0.10000E+01 volume 0.21993E-02 ppm1 2.717 ppm2 7.765 CV 1
ASSI { 547}
(( segid " " and resid 81 and name HG1 ))
(( segid " " and resid 78 and name HA ))
4.600 2.600 1.400 peak 547 spectrum 1 weight 0.10000E+01 volume 0.83141E-03 ppm1 2.581 ppm2 3.894 CV 1
ASSI { 548}
(( segid " " and resid 81 and name HG2 ))
(( segid " " and resid 81 and name HB1 ))
2.600 0.800 0.800 peak 548 spectrum 1 weight 0.10000E+01 volume 0.22052E-02 ppm1 2.717 ppm2 2.149 CV 1
ASSI { 549}
(( segid " " and resid 81 and name HG1 ))
(( segid " " and resid 81 and name HB1 ))
3.200 1.300 1.300 peak 549 spectrum 1 weight 0.10000E+01 volume 0.21597E-02 ppm1 2.579 ppm2 2.149 CV 1
ASSI { 550}
(( segid " " and resid 81 and name HG2 ))
( segid " " and resid 77 and name HG2%)
3.000 3.000 3.000 peak 550 spectrum 1 weight 0.10000E+01 volume 0.60380E-03 ppm1 2.719 ppm2 0.546 CV 1
ASSI { 551}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 68 and name HN ))
2.700 0.900 0.900 peak 551 spectrum 1 weight 0.10000E+01 volume 0.32374E-02 ppm1 2.116 ppm2 8.390 CV 1
OR { 551}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HN ))
ASSI { 553}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HD2 ))
3.100 1.200 1.200 peak 553 spectrum 1 weight 0.10000E+01 volume 0.24268E-02 ppm1 2.117 ppm2 1.602 CV 1
OR { 553}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 68 and name HD2 ))
ASSI { 554}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HA ))
2.700 0.900 0.900 peak 554 spectrum 1 weight 0.10000E+01 volume 0.38663E-02 ppm1 2.119 ppm2 4.531 CV 1
OR { 554}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 68 and name HA ))
ASSI { 555}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HG1 ))
3.000 1.100 1.100 peak 555 spectrum 1 weight 0.10000E+01 volume 0.19161E-02 ppm1 2.120 ppm2 1.778 CV 1
OR { 555}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 68 and name HG2 ))
OR { 555}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 68 and name HG1 ))
OR { 555}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 557}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 58 and name HG2 ))
2.600 0.900 0.900 peak 557 spectrum 1 weight 0.10000E+01 volume 0.47376E-02 ppm1 1.724 ppm2 1.650 CV 1
OR { 557}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HG1 ))
OR { 557}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HG2 ))
OR { 557}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 58 and name HG1 ))
ASSI { 560}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 58 and name HD2 ))
2.300 0.700 0.700 peak 560 spectrum 1 weight 0.10000E+01 volume 0.12208E-01 ppm1 1.723 ppm2 1.367 CV 1
OR { 560}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HD2 ))
OR { 560}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HD1 ))
OR { 560}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 58 and name HD1 ))
ASSI { 561}
(( segid " " and resid 5 and name HG1 ))
(( segid " " and resid 5 and name HE21))
4.100 2.100 1.900 peak 561 spectrum 1 weight 0.10000E+01 volume 0.60099E-03 ppm1 2.151 ppm2 6.847 CV 1
ASSI { 563}
(( segid " " and resid 5 and name HG1 ))
(( segid " " and resid 5 and name HE22))
4.200 2.200 1.800 peak 563 spectrum 1 weight 0.10000E+01 volume 0.13445E-02 ppm1 2.146 ppm2 7.533 CV 1
ASSI { 564}
(( segid " " and resid 5 and name HG1 ))
( segid " " and resid 9 and name HG2%)
4.100 2.100 1.900 peak 564 spectrum 1 weight 0.10000E+01 volume 0.86625E-03 ppm1 2.143 ppm2 1.047 CV 1
ASSI { 566}
(( segid " " and resid 5 and name HG1 ))
(( segid " " and resid 5 and name HN ))
4.100 2.100 1.900 peak 566 spectrum 1 weight 0.10000E+01 volume 0.12267E-02 ppm1 2.147 ppm2 9.233 CV 1
ASSI { 568}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HA ))
2.800 1.000 1.000 peak 568 spectrum 1 weight 0.10000E+01 volume 0.19089E-02 ppm1 2.246 ppm2 3.701 CV 1
ASSI { 569}
(( segid " " and resid 5 and name HG1 ))
(( segid " " and resid 5 and name HB1 ))
2.800 1.000 1.000 peak 569 spectrum 1 weight 0.10000E+01 volume 0.39497E-02 ppm1 2.147 ppm2 2.061 CV 1
ASSI { 572}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HB1 ))
2.500 0.800 0.800 peak 572 spectrum 1 weight 0.10000E+01 volume 0.45925E-02 ppm1 2.247 ppm2 2.061 CV 1
ASSI { 573}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HN ))
3.800 1.800 1.800 peak 573 spectrum 1 weight 0.10000E+01 volume 0.14183E-02 ppm1 2.247 ppm2 9.232 CV 1
ASSI { 575}
(( segid " " and resid 5 and name HG2 ))
(( segid " " and resid 5 and name HE22))
4.100 2.100 1.900 peak 575 spectrum 1 weight 0.10000E+01 volume 0.13191E-02 ppm1 2.244 ppm2 7.534 CV 1
ASSI { 577}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HN ))
2.800 1.000 1.000 peak 577 spectrum 1 weight 0.10000E+01 volume 0.25173E-02 ppm1 4.536 ppm2 8.386 CV 1
ASSI { 590}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HG11))
2.200 0.600 0.600 peak 590 spectrum 1 weight 0.10000E+01 volume 0.48077E-02 ppm1 0.843 ppm2 1.376 CV 1
ASSI { 591}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HB ))
3.500 1.500 1.500 peak 591 spectrum 1 weight 0.10000E+01 volume 0.22352E-02 ppm1 0.843 ppm2 1.661 CV 1
ASSI { 592}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 23 and name HD2 ))
3.400 1.500 1.500 peak 592 spectrum 1 weight 0.10000E+01 volume 0.13933E-02 ppm1 0.844 ppm2 4.036 CV 1
ASSI { 593}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 37 and name HA ))
3.600 1.600 1.600 peak 593 spectrum 1 weight 0.10000E+01 volume 0.21539E-02 ppm1 0.843 ppm2 4.450 CV 1
ASSI { 594}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HN ))
3.500 1.500 1.500 peak 594 spectrum 1 weight 0.10000E+01 volume 0.19941E-02 ppm1 0.843 ppm2 6.418 CV 1
ASSI { 596}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 23 and name HD1 ))
4.200 2.200 1.800 peak 596 spectrum 1 weight 0.10000E+01 volume 0.91934E-03 ppm1 0.843 ppm2 3.709 CV 1
ASSI { 597}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HA ))
2.200 0.600 0.600 peak 597 spectrum 1 weight 0.10000E+01 volume 0.48312E-02 ppm1 0.843 ppm2 4.345 CV 1
ASSI { 598}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 38 and name HB1 ))
4.100 2.100 1.900 peak 598 spectrum 1 weight 0.10000E+01 volume 0.94347E-03 ppm1 0.843 ppm2 2.585 CV 1
ASSI { 600}
( segid " " and resid 22 and name HD1%)
( segid " " and resid 20 and name HB% )
3.700 1.700 1.700 peak 600 spectrum 1 weight 0.10000E+01 volume 0.35030E-02 ppm1 0.843 ppm2 1.545 CV 1
ASSI { 601}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 22 and name HG12))
2.300 0.600 0.600 peak 601 spectrum 1 weight 0.10000E+01 volume 0.52500E-02 ppm1 0.843 ppm2 1.302 CV 1
ASSI { 607}
(( segid " " and resid 46 and name HG1 ))
( segid " " and resid 19 and name HD1%)
4.600 2.600 1.400 peak 607 spectrum 1 weight 0.10000E+01 volume 0.74003E-03 ppm1 2.315 ppm2 0.794 CV 1
ASSI { 610}
(( segid " " and resid 46 and name HG2 ))
( segid " " and resid 19 and name HD1%)
4.700 2.700 1.300 peak 610 spectrum 1 weight 0.10000E+01 volume 0.66992E-03 ppm1 2.497 ppm2 0.796 CV 1
ASSI { 611}
( segid " " and resid 59 and name HG2%)
(( segid " " and resid 52 and name HG1 ))
3.700 1.700 1.700 peak 611 spectrum 1 weight 0.10000E+01 volume 0.66414E-03 ppm1 0.619 ppm2 2.389 CV 1
ASSI { 613}
( segid " " and resid 59 and name HG2%)
( segid " " and resid 76 and name HD% )
3.300 1.400 1.400 peak 613 spectrum 1 weight 0.10000E+01 volume 0.11370E-02 ppm1 0.624 ppm2 6.809 CV 1
ASSI { 614}
( segid " " and resid 59 and name HG2%)
( segid " " and resid 76 and name HE% )
3.600 1.600 1.600 peak 614 spectrum 1 weight 0.10000E+01 volume 0.13083E-02 ppm1 0.622 ppm2 6.580 CV 1
ASSI { 617}
( segid " " and resid 59 and name HG2%)
( segid " " and resid 59 and name HD1%)
2.300 0.600 0.600 peak 617 spectrum 1 weight 0.10000E+01 volume 0.74053E-02 ppm1 0.622 ppm2 0.238 CV 1
ASSI { 619}
( segid " " and resid 59 and name HG2%)
(( segid " " and resid 59 and name HB ))
2.500 0.800 0.800 peak 619 spectrum 1 weight 0.10000E+01 volume 0.31792E-02 ppm1 0.622 ppm2 1.663 CV 1
ASSI { 621}
( segid " " and resid 59 and name HG2%)
(( segid " " and resid 59 and name HG12))
2.300 0.700 0.700 peak 621 spectrum 1 weight 0.10000E+01 volume 0.70979E-02 ppm1 0.622 ppm2 1.519 CV 1
ASSI { 625}
( segid " " and resid 59 and name HG2%)
(( segid " " and resid 59 and name HG11))
2.800 1.000 1.000 peak 625 spectrum 1 weight 0.10000E+01 volume 0.11587E-01 ppm1 0.622 ppm2 0.852 CV 1
ASSI { 626}
( segid " " and resid 59 and name HG2%)
(( segid " " and resid 52 and name HG2 ))
4.000 2.000 2.000 peak 626 spectrum 1 weight 0.10000E+01 volume 0.68738E-03 ppm1 0.624 ppm2 2.875 CV 1
ASSI { 628}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HB1 ))
2.100 0.500 0.500 peak 628 spectrum 1 weight 0.10000E+01 volume 0.21860E-01 ppm1 2.300 ppm2 2.018 CV 1
OR { 628}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 25 and name HB2 ))
OR { 628}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HB2 ))
OR { 628}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 25 and name HB1 ))
ASSI { 629}
( segid " " and resid 59 and name HG2%)
( segid " " and resid 67 and name HD1%)
4.200 2.200 1.800 peak 629 spectrum 1 weight 0.10000E+01 volume 0.11455E-02 ppm1 0.621 ppm2 0.438 CV 1
ASSI { 636}
(( segid " " and resid 53 and name HG2 ))
(( segid " " and resid 53 and name HB1 ))
2.800 0.900 0.900 peak 636 spectrum 1 weight 0.10000E+01 volume 0.31567E-02 ppm1 2.469 ppm2 2.076 CV 1
ASSI { 639}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 46 and name HA ))
3.700 1.700 1.700 peak 639 spectrum 1 weight 0.10000E+01 volume 0.13040E-02 ppm1 2.492 ppm2 4.048 CV 1
ASSI { 643}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 46 and name HN ))
3.900 1.900 1.900 peak 643 spectrum 1 weight 0.10000E+01 volume 0.17910E-02 ppm1 2.490 ppm2 6.954 CV 1
ASSI { 647}
(( segid " " and resid 57 and name HB ))
(( segid " " and resid 81 and name HA ))
2.900 1.000 1.000 peak 647 spectrum 1 weight 0.10000E+01 volume 0.96824E-03 ppm1 2.009 ppm2 4.456 CV 1
ASSI { 648}
(( segid " " and resid 57 and name HB ))
( segid " " and resid 77 and name HG2%)
3.900 1.900 1.900 peak 648 spectrum 1 weight 0.10000E+01 volume 0.78607E-03 ppm1 2.009 ppm2 0.552 CV 1
ASSI { 650}
(( segid " " and resid 57 and name HB ))
(( segid " " and resid 57 and name HA ))
2.400 0.700 0.700 peak 650 spectrum 1 weight 0.10000E+01 volume 0.50235E-02 ppm1 2.010 ppm2 4.730 CV 1
ASSI { 651}
(( segid " " and resid 57 and name HB ))
(( segid " " and resid 82 and name HN ))
3.000 1.100 1.100 peak 651 spectrum 1 weight 0.10000E+01 volume 0.49643E-02 ppm1 2.009 ppm2 8.322 CV 1
ASSI { 652}
(( segid " " and resid 57 and name HB ))
( segid " " and resid 57 and name HG1%)
2.200 0.600 0.600 peak 652 spectrum 1 weight 0.10000E+01 volume 0.60691E-02 ppm1 2.010 ppm2 0.951 CV 1
ASSI { 653}
(( segid " " and resid 57 and name HB ))
( segid " " and resid 57 and name HG2%)
2.300 0.700 0.700 peak 653 spectrum 1 weight 0.10000E+01 volume 0.56906E-02 ppm1 2.010 ppm2 1.003 CV 1
ASSI { 655}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 24 and name HG1%)
4.600 2.600 1.400 peak 655 spectrum 1 weight 0.10000E+01 volume 0.67998E-03 ppm1 2.632 ppm2 0.987 CV 1
ASSI { 657}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 14 and name HA ))
3.700 1.700 1.700 peak 657 spectrum 1 weight 0.10000E+01 volume 0.11481E-02 ppm1 2.633 ppm2 3.953 CV 1
ASSI { 658}
(( segid " " and resid 14 and name HG1 ))
(( segid " " and resid 14 and name HG2 ))
1.900 0.500 0.500 peak 658 spectrum 1 weight 0.10000E+01 volume 0.11384E-01 ppm1 2.340 ppm2 2.631 CV 1
ASSI { 661}
(( segid " " and resid 14 and name HG1 ))
(( segid " " and resid 14 and name HA ))
3.000 1.100 1.100 peak 661 spectrum 1 weight 0.10000E+01 volume 0.21540E-02 ppm1 2.342 ppm2 3.957 CV 1
ASSI { 662}
(( segid " " and resid 14 and name HG1 ))
(( segid " " and resid 14 and name HN ))
4.100 2.100 1.900 peak 662 spectrum 1 weight 0.10000E+01 volume 0.17675E-02 ppm1 2.341 ppm2 7.838 CV 1
ASSI { 668}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HD1 ))
2.800 0.900 0.900 peak 668 spectrum 1 weight 0.10000E+01 volume 0.48937E-02 ppm1 1.550 ppm2 1.340 CV 1
ASSI { 669}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 31 and name HB1 ))
4.200 2.200 1.800 peak 669 spectrum 1 weight 0.10000E+01 volume 0.98408E-03 ppm1 1.550 ppm2 1.819 CV 1
ASSI { 670}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HB2 ))
1.800 0.400 0.400 peak 670 spectrum 1 weight 0.10000E+01 volume 0.82031E-02 ppm1 1.550 ppm2 2.096 CV 1
ASSI { 674}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HG1 ))
3.200 1.300 1.300 peak 674 spectrum 1 weight 0.10000E+01 volume 0.92541E-03 ppm1 2.100 ppm2 1.691 CV 1
ASSI { 676}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HD1 ))
2.200 0.600 0.600 peak 676 spectrum 1 weight 0.10000E+01 volume 0.45538E-02 ppm1 2.098 ppm2 1.340 CV 1
ASSI { 677}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 31 and name HB1 ))
2.400 0.700 0.700 peak 677 spectrum 1 weight 0.10000E+01 volume 0.25347E-02 ppm1 2.099 ppm2 1.819 CV 1
ASSI { 680}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HA ))
3.100 1.200 1.200 peak 680 spectrum 1 weight 0.10000E+01 volume 0.25945E-02 ppm1 2.099 ppm2 4.660 CV 1
ASSI { 681}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HG1 ))
3.900 1.900 1.900 peak 681 spectrum 1 weight 0.10000E+01 volume 0.73905E-03 ppm1 1.548 ppm2 1.692 CV 1
ASSI { 682}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 29 and name HB2 ))
4.800 2.900 1.200 peak 682 spectrum 1 weight 0.10000E+01 volume 0.93602E-03 ppm1 2.099 ppm2 1.771 CV 1
OR { 682}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 29 and name HG ))
ASSI { 683}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 52 and name HB1 ))
2.600 0.900 0.900 peak 683 spectrum 1 weight 0.10000E+01 volume 0.16139E-02 ppm1 2.877 ppm2 2.170 CV 1
ASSI { 688}
(( segid " " and resid 52 and name HG1 ))
(( segid " " and resid 52 and name HG2 ))
1.900 0.400 0.400 peak 688 spectrum 1 weight 0.10000E+01 volume 0.41356E-02 ppm1 2.388 ppm2 2.873 CV 1
ASSI { 693}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 49 and name HN ))
4.200 2.200 1.800 peak 693 spectrum 1 weight 0.10000E+01 volume 0.83304E-03 ppm1 2.877 ppm2 8.189 CV 1
ASSI { 694}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 52 and name HN ))
2.200 0.600 0.600 peak 694 spectrum 1 weight 0.10000E+01 volume 0.23045E-02 ppm1 2.876 ppm2 8.937 CV 1
ASSI { 695}
(( segid " " and resid 52 and name HG1 ))
(( segid " " and resid 49 and name HN ))
4.900 3.000 1.100 peak 695 spectrum 1 weight 0.10000E+01 volume 0.82090E-03 ppm1 2.391 ppm2 8.188 CV 1
ASSI { 698}
(( segid " " and resid 52 and name HG1 ))
(( segid " " and resid 52 and name HN ))
3.700 1.700 1.700 peak 698 spectrum 1 weight 0.10000E+01 volume 0.11398E-02 ppm1 2.393 ppm2 8.938 CV 1
ASSI { 700}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 16 and name HN ))
4.000 2.000 2.000 peak 700 spectrum 1 weight 0.10000E+01 volume 0.21464E-02 ppm1 0.765 ppm2 8.913 CV 1
ASSI { 701}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 51 and name HA ))
2.300 0.700 0.700 peak 701 spectrum 1 weight 0.10000E+01 volume 0.58786E-02 ppm1 0.765 ppm2 3.976 CV 1
ASSI { 702}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 15 and name HB ))
2.500 0.800 0.800 peak 702 spectrum 1 weight 0.10000E+01 volume 0.52036E-02 ppm1 0.765 ppm2 2.127 CV 1
ASSI { 704}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 15 and name HA ))
3.600 1.600 1.600 peak 704 spectrum 1 weight 0.10000E+01 volume 0.20837E-02 ppm1 0.765 ppm2 3.798 CV 1
ASSI { 705}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 15 and name HG12))
2.200 0.600 0.600 peak 705 spectrum 1 weight 0.10000E+01 volume 0.75622E-02 ppm1 0.765 ppm2 1.982 CV 1
ASSI { 706}
( segid " " and resid 15 and name HD1%)
( segid " " and resid 15 and name HG2%)
2.000 0.500 0.500 peak 706 spectrum 1 weight 0.10000E+01 volume 0.16002E-01 ppm1 0.765 ppm2 1.089 CV 1
ASSI { 707}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 48 and name HA ))
4.300 2.300 1.700 peak 707 spectrum 1 weight 0.10000E+01 volume 0.67559E-03 ppm1 0.765 ppm2 3.421 CV 1
ASSI { 712}
( segid " " and resid 15 and name HD1%)
( segid " " and resid 55 and name HE% )
3.700 1.700 1.700 peak 712 spectrum 1 weight 0.10000E+01 volume 0.14830E-02 ppm1 0.765 ppm2 7.137 CV 1
ASSI { 713}
( segid " " and resid 15 and name HD1%)
( segid " " and resid 16 and name HG2%)
4.900 3.000 1.100 peak 713 spectrum 1 weight 0.10000E+01 volume 0.76431E-03 ppm1 0.767 ppm2 1.210 CV 1
ASSI { 716}
( segid " " and resid 15 and name HD1%)
( segid " " and resid 47 and name HG1%)
2.500 0.800 0.800 peak 716 spectrum 1 weight 0.10000E+01 volume 0.71660E-02 ppm1 0.765 ppm2 0.661 CV 1
ASSI { 718}
(( segid " " and resid 6 and name HG1 ))
(( segid " " and resid 6 and name HB2 ))
2.400 0.700 0.700 peak 718 spectrum 1 weight 0.10000E+01 volume 0.45545E-02 ppm1 2.358 ppm2 2.106 CV 1
ASSI { 720}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 6 and name HA ))
3.600 1.600 1.600 peak 720 spectrum 1 weight 0.10000E+01 volume 0.22767E-02 ppm1 2.480 ppm2 3.957 CV 1
ASSI { 722}
(( segid " " and resid 6 and name HG1 ))
(( segid " " and resid 6 and name HN ))
4.200 2.200 1.800 peak 722 spectrum 1 weight 0.10000E+01 volume 0.89245E-03 ppm1 2.357 ppm2 8.855 CV 1
ASSI { 723}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 6 and name HB2 ))
2.900 1.000 1.000 peak 723 spectrum 1 weight 0.10000E+01 volume 0.47577E-02 ppm1 2.469 ppm2 2.120 CV 1
ASSI { 727}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 7 and name HA ))
4.000 2.000 2.000 peak 727 spectrum 1 weight 0.10000E+01 volume 0.23701E-02 ppm1 2.450 ppm2 4.144 CV 1
ASSI { 731}
(( segid " " and resid 6 and name HG2 ))
( segid " " and resid 3 and name HB% )
5.200 3.300 0.800 peak 731 spectrum 1 weight 0.10000E+01 volume 0.70322E-03 ppm1 2.452 ppm2 1.564 CV 1
ASSI { 732}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 8 and name HG11))
2.900 1.000 1.000 peak 732 spectrum 1 weight 0.10000E+01 volume 0.11502E-02 ppm1 1.769 ppm2 0.088 CV 1
ASSI { 733}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 8 and name HG12))
2.800 1.000 1.000 peak 733 spectrum 1 weight 0.10000E+01 volume 0.17499E-02 ppm1 1.772 ppm2 1.520 CV 1
ASSI { 734}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 8 and name HA ))
3.000 1.200 1.200 peak 734 spectrum 1 weight 0.10000E+01 volume 0.11857E-02 ppm1 1.771 ppm2 3.867 CV 1
ASSI { 735}
(( segid " " and resid 8 and name HB ))
( segid " " and resid 74 and name HG2%)
3.900 1.900 1.900 peak 735 spectrum 1 weight 0.10000E+01 volume 0.22496E-02 ppm1 1.770 ppm2 1.099 CV 1
ASSI { 742}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 15 and name HA ))
4.400 2.400 1.600 peak 742 spectrum 1 weight 0.10000E+01 volume 0.67451E-03 ppm1 0.797 ppm2 3.794 CV 1
ASSI { 744}
(( segid " " and resid 59 and name HB ))
(( segid " " and resid 59 and name HA ))
3.000 1.100 1.100 peak 744 spectrum 1 weight 0.10000E+01 volume 0.91954E-03 ppm1 1.664 ppm2 4.490 CV 1
ASSI { 745}
(( segid " " and resid 59 and name HB ))
( segid " " and resid 59 and name HD1%)
2.400 0.700 0.700 peak 745 spectrum 1 weight 0.10000E+01 volume 0.53255E-02 ppm1 1.666 ppm2 0.239 CV 1
ASSI { 750}
(( segid " " and resid 59 and name HB ))
(( segid " " and resid 59 and name HG11))
2.300 0.600 0.600 peak 750 spectrum 1 weight 0.10000E+01 volume 0.49120E-02 ppm1 1.665 ppm2 0.854 CV 1
ASSI { 751}
(( segid " " and resid 59 and name HB ))
(( segid " " and resid 59 and name HG12))
3.000 1.200 1.200 peak 751 spectrum 1 weight 0.10000E+01 volume 0.21654E-02 ppm1 1.665 ppm2 1.516 CV 1
ASSI { 754}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 15 and name HG2%)
2.400 0.700 0.700 peak 754 spectrum 1 weight 0.10000E+01 volume 0.84109E-02 ppm1 0.797 ppm2 1.092 CV 1
ASSI { 755}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 19 and name HB ))
2.200 0.600 0.600 peak 755 spectrum 1 weight 0.10000E+01 volume 0.73470E-02 ppm1 0.797 ppm2 1.648 CV 1
ASSI { 756}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 42 and name HD1%)
2.700 2.700 3.300 peak 756 spectrum 1 weight 0.10000E+01 volume 0.81434E-02 ppm1 0.797 ppm2 0.900 CV 1
ASSI { 757}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 48 and name HA ))
2.800 1.000 1.000 peak 757 spectrum 1 weight 0.10000E+01 volume 0.50225E-02 ppm1 0.797 ppm2 3.420 CV 1
ASSI { 758}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 19 and name HG11))
2.200 0.600 0.600 peak 758 spectrum 1 weight 0.10000E+01 volume 0.49161E-02 ppm1 0.797 ppm2 1.344 CV 1
ASSI { 759}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 46 and name HB1 ))
3.100 1.200 1.200 peak 759 spectrum 1 weight 0.10000E+01 volume 0.38195E-02 ppm1 0.797 ppm2 2.161 CV 1
ASSI { 760}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 16 and name HA ))
3.100 1.200 1.200 peak 760 spectrum 1 weight 0.10000E+01 volume 0.94416E-03 ppm1 0.797 ppm2 3.566 CV 1
ASSI { 763}
(( segid " " and resid 77 and name HB ))
( segid " " and resid 77 and name HG2%)
2.300 0.600 0.600 peak 763 spectrum 1 weight 0.10000E+01 volume 0.57918E-02 ppm1 1.810 ppm2 0.551 CV 1
ASSI { 764}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 37 and name HG ))
4.100 2.100 1.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.80852E-03 ppm1 0.795 ppm2 1.465 CV 1
ASSI { 766}
(( segid " " and resid 77 and name HB ))
(( segid " " and resid 77 and name HG11))
2.600 0.900 0.900 peak 766 spectrum 1 weight 0.10000E+01 volume 0.20988E-02 ppm1 1.810 ppm2 2.031 CV 1
ASSI { 767}
(( segid " " and resid 77 and name HB ))
(( segid " " and resid 77 and name HG12))
3.200 1.300 1.300 peak 767 spectrum 1 weight 0.10000E+01 volume 0.14782E-02 ppm1 1.811 ppm2 0.948 CV 1
ASSI { 770}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 51 and name HB% )
4.200 2.300 1.800 peak 770 spectrum 1 weight 0.10000E+01 volume 0.17101E-02 ppm1 0.797 ppm2 1.512 CV 1
ASSI { 771}
(( segid " " and resid 77 and name HB ))
( segid " " and resid 77 and name HD1%)
2.700 0.900 0.900 peak 771 spectrum 1 weight 0.10000E+01 volume 0.31323E-02 ppm1 1.812 ppm2 0.678 CV 1
ASSI { 772}
(( segid " " and resid 77 and name HB ))
(( segid " " and resid 77 and name HA ))
3.100 1.200 1.200 peak 772 spectrum 1 weight 0.10000E+01 volume 0.15552E-02 ppm1 1.812 ppm2 3.537 CV 1
ASSI { 789}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 12 and name HD1%)
4.300 2.300 1.700 peak 789 spectrum 1 weight 0.10000E+01 volume 0.96187E-03 ppm1 0.513 ppm2 0.894 CV 1
ASSI { 791}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 9 and name HG2%)
3.200 1.300 1.300 peak 791 spectrum 1 weight 0.10000E+01 volume 0.16145E-02 ppm1 0.512 ppm2 1.037 CV 1
ASSI { 793}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 8 and name HD1%)
2.100 0.500 0.500 peak 793 spectrum 1 weight 0.10000E+01 volume 0.10535E-01 ppm1 0.512 ppm2 0.601 CV 1
ASSI { 795}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HB ))
2.200 0.600 0.600 peak 795 spectrum 1 weight 0.10000E+01 volume 0.57039E-02 ppm1 0.512 ppm2 1.776 CV 1
ASSI { 797}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 78 and name HG ))
2.700 0.900 0.900 peak 797 spectrum 1 weight 0.10000E+01 volume 0.27661E-02 ppm1 0.512 ppm2 1.636 CV 1
ASSI { 798}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 78 and name HD1%)
2.200 0.600 0.600 peak 798 spectrum 1 weight 0.10000E+01 volume 0.94554E-02 ppm1 0.512 ppm2 0.830 CV 1
ASSI { 799}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HG11))
2.400 0.700 0.700 peak 799 spectrum 1 weight 0.10000E+01 volume 0.48457E-02 ppm1 0.512 ppm2 0.087 CV 1
ASSI { 802}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 74 and name HA ))
3.200 1.300 1.300 peak 802 spectrum 1 weight 0.10000E+01 volume 0.41143E-02 ppm1 0.512 ppm2 3.697 CV 1
ASSI { 803}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 78 and name HN ))
3.900 1.900 1.900 peak 803 spectrum 1 weight 0.10000E+01 volume 0.24931E-02 ppm1 0.512 ppm2 8.533 CV 1
ASSI { 809}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 77 and name HD1%)
4.500 2.500 1.500 peak 809 spectrum 1 weight 0.10000E+01 volume 0.77931E-03 ppm1 0.511 ppm2 0.676 CV 1
ASSI { 822}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 15 and name HG12))
3.000 1.200 1.200 peak 822 spectrum 1 weight 0.10000E+01 volume 0.21757E-02 ppm1 2.128 ppm2 1.982 CV 1
ASSI { 824}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 15 and name HG11))
3.000 1.100 1.100 peak 824 spectrum 1 weight 0.10000E+01 volume 0.10777E-02 ppm1 2.130 ppm2 1.046 CV 1
ASSI { 825}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 15 and name HA ))
3.100 1.200 1.200 peak 825 spectrum 1 weight 0.10000E+01 volume 0.16323E-02 ppm1 2.127 ppm2 3.796 CV 1
ASSI { 826}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 16 and name HN ))
2.900 1.000 1.000 peak 826 spectrum 1 weight 0.10000E+01 volume 0.26303E-02 ppm1 2.130 ppm2 8.939 CV 1
ASSI { 827}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 12 and name HA ))
2.500 0.800 0.800 peak 827 spectrum 1 weight 0.10000E+01 volume 0.37518E-02 ppm1 2.126 ppm2 4.261 CV 1
ASSI { 830}
(( segid " " and resid 15 and name HB ))
( segid " " and resid 16 and name HG2%)
4.100 2.100 1.900 peak 830 spectrum 1 weight 0.10000E+01 volume 0.78676E-03 ppm1 2.131 ppm2 1.204 CV 1
ASSI { 834}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HN ))
3.700 1.700 1.700 peak 834 spectrum 1 weight 0.10000E+01 volume 0.93804E-03 ppm1 3.264 ppm2 7.862 CV 1
ASSI { 835}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HB1 ))
1.800 0.400 0.400 peak 835 spectrum 1 weight 0.10000E+01 volume 0.86467E-02 ppm1 2.145 ppm2 0.926 CV 1
ASSI { 836}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 67 and name HA ))
2.700 0.900 0.900 peak 836 spectrum 1 weight 0.10000E+01 volume 0.18695E-02 ppm1 0.926 ppm2 4.511 CV 1
ASSI { 837}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 66 and name HB2 ))
2.800 2.800 3.200 peak 837 spectrum 1 weight 0.10000E+01 volume 0.82811E-03 ppm1 2.145 ppm2 3.084 CV 1
ASSI { 839}
(( segid " " and resid 67 and name HB1 ))
( segid " " and resid 67 and name HD2%)
2.600 0.800 0.800 peak 839 spectrum 1 weight 0.10000E+01 volume 0.22351E-02 ppm1 0.927 ppm2 0.536 CV 1
ASSI { 840}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HA ))
3.200 1.300 1.300 peak 840 spectrum 1 weight 0.10000E+01 volume 0.12657E-02 ppm1 2.144 ppm2 4.513 CV 1
ASSI { 842}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 67 and name HG ))
3.200 1.200 1.200 peak 842 spectrum 1 weight 0.10000E+01 volume 0.10204E-02 ppm1 0.926 ppm2 1.814 CV 1
ASSI { 844}
(( segid " " and resid 22 and name HB ))
( segid " " and resid 22 and name HG2%)
2.000 0.500 0.500 peak 844 spectrum 1 weight 0.10000E+01 volume 0.10041E-01 ppm1 1.659 ppm2 1.010 CV 1
ASSI { 845}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 67 and name HN ))
3.100 1.200 1.200 peak 845 spectrum 1 weight 0.10000E+01 volume 0.16213E-02 ppm1 0.929 ppm2 7.761 CV 1
ASSI { 846}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 22 and name HA ))
2.900 1.100 1.100 peak 846 spectrum 1 weight 0.10000E+01 volume 0.14335E-02 ppm1 1.659 ppm2 4.344 CV 1
ASSI { 847}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 22 and name HN ))
2.200 0.600 0.600 peak 847 spectrum 1 weight 0.10000E+01 volume 0.51296E-02 ppm1 1.660 ppm2 6.418 CV 1
ASSI { 850}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HG ))
3.100 1.200 1.200 peak 850 spectrum 1 weight 0.10000E+01 volume 0.14735E-02 ppm1 2.145 ppm2 1.818 CV 1
ASSI { 852}
(( segid " " and resid 67 and name HB1 ))
( segid " " and resid 73 and name HB% )
4.600 2.600 1.400 peak 852 spectrum 1 weight 0.10000E+01 volume 0.70732E-03 ppm1 0.929 ppm2 1.541 CV 1
ASSI { 853}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 17 and name HA ))
3.700 1.800 1.800 peak 853 spectrum 1 weight 0.10000E+01 volume 0.59492E-03 ppm1 1.662 ppm2 4.637 CV 1
ASSI { 854}
(( segid " " and resid 56 and name HB1 ))
(( segid " " and resid 56 and name HB2 ))
1.900 0.500 0.500 peak 854 spectrum 1 weight 0.10000E+01 volume 0.11724E-01 ppm1 2.608 ppm2 3.259 CV 1
ASSI { 856}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 64 and name HA ))
5.000 3.100 1.000 peak 856 spectrum 1 weight 0.10000E+01 volume 0.56916E-03 ppm1 0.929 ppm2 3.084 CV 1
ASSI { 857}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 67 and name HN ))
3.100 1.200 1.200 peak 857 spectrum 1 weight 0.10000E+01 volume 0.25146E-02 ppm1 3.080 ppm2 7.748 CV 1
ASSI { 858}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 66 and name HD22))
3.500 1.500 1.500 peak 858 spectrum 1 weight 0.10000E+01 volume 0.35031E-02 ppm1 2.778 ppm2 7.746 CV 1
ASSI { 860}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HB1 ))
1.800 0.400 0.400 peak 860 spectrum 1 weight 0.10000E+01 volume 0.14101E-01 ppm1 3.081 ppm2 2.777 CV 1
ASSI { 864}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HD21))
3.100 1.200 1.200 peak 864 spectrum 1 weight 0.10000E+01 volume 0.11384E-02 ppm1 3.080 ppm2 7.026 CV 1
ASSI { 866}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 22 and name HG12))
2.500 0.800 0.800 peak 866 spectrum 1 weight 0.10000E+01 volume 0.26975E-02 ppm1 1.659 ppm2 1.311 CV 1
ASSI { 867}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HA ))
2.900 1.000 1.000 peak 867 spectrum 1 weight 0.10000E+01 volume 0.21161E-02 ppm1 3.104 ppm2 4.202 CV 1
ASSI { 872}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 76 and name HD% )
2.700 0.900 0.900 peak 872 spectrum 1 weight 0.10000E+01 volume 0.41003E-02 ppm1 3.112 ppm2 6.804 CV 1
ASSI { 875}
(( segid " " and resid 66 and name HB1 ))
(( segid " " and resid 66 and name HA ))
3.100 1.200 1.200 peak 875 spectrum 1 weight 0.10000E+01 volume 0.23287E-02 ppm1 2.774 ppm2 4.876 CV 1
ASSI { 879}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 22 and name HG11))
2.400 0.700 0.700 peak 879 spectrum 1 weight 0.10000E+01 volume 0.36526E-02 ppm1 1.661 ppm2 1.366 CV 1
ASSI { 882}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 68 and name HB2 ))
4.000 2.000 2.000 peak 882 spectrum 1 weight 0.10000E+01 volume 0.13768E-02 ppm1 3.151 ppm2 2.101 CV 1
OR { 882}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 68 and name HB1 ))
ASSI { 884}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 37 and name HB1 ))
4.500 2.600 1.500 peak 884 spectrum 1 weight 0.10000E+01 volume 0.21615E-02 ppm1 3.210 ppm2 1.705 CV 1
ASSI { 889}
(( segid " " and resid 33 and name HB1 ))
( segid " " and resid 39 and name HG1%)
2.900 1.000 1.000 peak 889 spectrum 1 weight 0.10000E+01 volume 0.12381E-02 ppm1 3.153 ppm2 0.842 CV 1
ASSI { 904}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 62 and name HB1 ))
2.400 2.400 3.600 peak 904 spectrum 1 weight 0.10000E+01 volume 0.20445E-02 ppm1 3.101 ppm2 2.500 CV 1
ASSI { 905}
(( segid " " and resid 19 and name HB ))
( segid " " and resid 47 and name HG2%)
3.300 1.400 1.400 peak 905 spectrum 1 weight 0.10000E+01 volume 0.76870E-02 ppm1 1.661 ppm2 0.966 CV 1
ASSI { 914}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 38 and name HB2 ))
2.000 0.500 0.500 peak 914 spectrum 1 weight 0.10000E+01 volume 0.10922E-01 ppm1 2.587 ppm2 3.151 CV 1
ASSI { 919}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 55 and name HA ))
3.000 1.100 1.100 peak 919 spectrum 1 weight 0.10000E+01 volume 0.18058E-02 ppm1 2.755 ppm2 4.875 CV 1
ASSI { 924}
(( segid " " and resid 55 and name HB2 ))
( segid " " and resid 77 and name HG2%)
2.800 1.000 1.000 peak 924 spectrum 1 weight 0.10000E+01 volume 0.31449E-02 ppm1 3.455 ppm2 0.551 CV 1
ASSI { 925}
(( segid " " and resid 55 and name HB2 ))
( segid " " and resid 57 and name HG1%)
2.900 1.000 1.000 peak 925 spectrum 1 weight 0.10000E+01 volume 0.13697E-02 ppm1 3.453 ppm2 0.947 CV 1
ASSI { 926}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HB1 ))
1.800 0.400 0.400 peak 926 spectrum 1 weight 0.10000E+01 volume 0.10117E-01 ppm1 3.454 ppm2 2.750 CV 1
ASSI { 927}
(( segid " " and resid 55 and name HB1 ))
( segid " " and resid 57 and name HG1%)
3.700 1.700 1.700 peak 927 spectrum 1 weight 0.10000E+01 volume 0.12762E-02 ppm1 2.750 ppm2 0.948 CV 1
ASSI { 928}
(( segid " " and resid 55 and name HB1 ))
( segid " " and resid 77 and name HG2%)
3.300 1.400 1.400 peak 928 spectrum 1 weight 0.10000E+01 volume 0.20133E-02 ppm1 2.752 ppm2 0.550 CV 1
ASSI { 931}
(( segid " " and resid 55 and name HB1 ))
( segid " " and resid 55 and name HD% )
2.600 0.900 0.900 peak 931 spectrum 1 weight 0.10000E+01 volume 0.49235E-02 ppm1 2.754 ppm2 7.476 CV 1
ASSI { 932}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HA ))
3.100 1.200 1.200 peak 932 spectrum 1 weight 0.10000E+01 volume 0.26111E-02 ppm1 3.454 ppm2 4.876 CV 1
ASSI { 933}
(( segid " " and resid 55 and name HB2 ))
( segid " " and resid 55 and name HD% )
2.400 0.700 0.700 peak 933 spectrum 1 weight 0.10000E+01 volume 0.50082E-02 ppm1 3.454 ppm2 7.477 CV 1
ASSI { 934}
(( segid " " and resid 55 and name HB2 ))
( segid " " and resid 57 and name HG2%)
4.200 2.200 1.800 peak 934 spectrum 1 weight 0.10000E+01 volume 0.12633E-02 ppm1 3.454 ppm2 1.000 CV 1
ASSI { 947}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 30 and name HB2 ))
1.800 0.400 0.400 peak 947 spectrum 1 weight 0.10000E+01 volume 0.19052E-01 ppm1 2.614 ppm2 2.797 CV 1
ASSI { 981}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 62 and name HA ))
2.800 0.900 0.900 peak 981 spectrum 1 weight 0.10000E+01 volume 0.39090E-02 ppm1 2.517 ppm2 4.331 CV 1
ASSI { 988}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 63 and name HN ))
3.500 1.500 1.500 peak 988 spectrum 1 weight 0.10000E+01 volume 0.10553E-02 ppm1 2.657 ppm2 7.556 CV 1
ASSI { 989}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 63 and name HN ))
3.800 1.800 1.800 peak 989 spectrum 1 weight 0.10000E+01 volume 0.86595E-03 ppm1 2.519 ppm2 7.559 CV 1
ASSI { 1015}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 80 and name HN ))
4.100 2.100 1.900 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.68783E-03 ppm1 2.531 ppm2 7.729 CV 1
ASSI { 1020}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 76 and name HE% )
3.300 1.400 1.400 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.18401E-02 ppm1 0.243 ppm2 6.582 CV 1
ASSI { 1022}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 59 and name HG11))
2.400 0.700 0.700 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.55949E-02 ppm1 0.239 ppm2 0.852 CV 1
ASSI { 1026}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 64 and name HA ))
3.000 1.100 1.100 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.15436E-02 ppm1 0.238 ppm2 3.083 CV 1
ASSI { 1027}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 59 and name HA ))
3.500 1.500 1.500 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.38797E-02 ppm1 0.239 ppm2 4.490 CV 1
ASSI { 1029}
( segid " " and resid 59 and name HD1%)
(( segid " " and resid 60 and name HB2 ))
3.700 1.700 1.700 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.24727E-02 ppm1 0.238 ppm2 2.412 CV 1
ASSI { 1036}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 67 and name HD1%)
3.300 1.300 1.300 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.30007E-02 ppm1 0.238 ppm2 0.438 CV 1
ASSI { 1041}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 76 and name HD% )
2.600 0.900 0.900 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.32307E-02 ppm1 0.237 ppm2 6.805 CV 1
ASSI { 1042}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 79 and name HB1 ))
1.900 0.500 0.500 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.10004E-01 ppm1 2.530 ppm2 2.229 CV 1
ASSI { 1044}
( segid " " and resid 59 and name HD1%)
( segid " " and resid 64 and name HG1%)
3.800 1.800 1.800 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.11760E-02 ppm1 0.238 ppm2 0.780 CV 1
ASSI { 1104}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 26 and name HB2 ))
2.400 0.700 0.700 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.26813E-02 ppm1 1.012 ppm2 2.695 CV 1
ASSI { 1112}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 22 and name HA ))
2.500 0.800 0.800 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.42007E-02 ppm1 1.012 ppm2 4.343 CV 1
ASSI { 1114}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 60 and name HG2 ))
4.000 2.000 2.000 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.64426E-03 ppm1 2.415 ppm2 2.012 CV 1
OR { 1114}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 60 and name HG2 ))
ASSI { 1115}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 26 and name HB1 ))
2.800 1.000 1.000 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.21787E-02 ppm1 1.013 ppm2 2.644 CV 1
ASSI { 1116}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 60 and name HB1 ))
5.000 3.100 1.000 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.76204E-03 ppm1 2.416 ppm2 1.919 CV 1
OR { 1116}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 60 and name HB1 ))
ASSI { 1118}
( segid " " and resid 77 and name HG2%)
( segid " " and resid 57 and name HG2%)
2.900 1.000 1.000 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.39592E-02 ppm1 0.552 ppm2 1.000 CV 1
ASSI { 1119}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 8 and name HG11))
2.800 1.000 1.000 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.16967E-02 ppm1 0.552 ppm2 0.088 CV 1
ASSI { 1120}
(( segid " " and resid 63 and name HB2 ))
( segid " " and resid 76 and name HE% )
3.100 1.200 1.200 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.19920E-02 ppm1 2.417 ppm2 6.580 CV 1
OR { 1120}
(( segid " " and resid 63 and name HB1 ))
( segid " " and resid 76 and name HE% )
ASSI { 1121}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 63 and name HA ))
2.700 0.900 0.900 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.35827E-02 ppm1 2.417 ppm2 4.692 CV 1
OR { 1121}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HA ))
ASSI { 1122}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 64 and name HN ))
2.500 0.800 0.800 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.50586E-02 ppm1 2.415 ppm2 7.563 CV 1
OR { 1122}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 64 and name HN ))
ASSI { 1123}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 8 and name HG12))
3.500 1.500 1.500 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.13485E-02 ppm1 0.553 ppm2 1.517 CV 1
ASSI { 1124}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 77 and name HG11))
3.500 1.500 1.500 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.26128E-02 ppm1 0.552 ppm2 2.026 CV 1
ASSI { 1125}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 77 and name HG12))
2.200 0.600 0.600 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.70051E-02 ppm1 0.551 ppm2 0.951 CV 1
ASSI { 1126}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 78 and name HA ))
3.300 1.300 1.300 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.10946E-02 ppm1 0.552 ppm2 3.888 CV 1
ASSI { 1127}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 77 and name HA ))
2.600 0.900 0.900 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.42736E-02 ppm1 0.552 ppm2 3.534 CV 1
ASSI { 1129}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 81 and name HB1 ))
2.800 1.000 1.000 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.12757E-02 ppm1 0.552 ppm2 2.147 CV 1
ASSI { 1134}
( segid " " and resid 77 and name HG2%)
( segid " " and resid 3 and name HB% )
3.800 1.800 1.800 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.99893E-03 ppm1 0.551 ppm2 1.572 CV 1
ASSI { 1135}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 78 and name HN ))
3.200 1.300 1.300 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.15622E-02 ppm1 0.551 ppm2 8.538 CV 1
ASSI { 1136}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 20 and name HN ))
3.700 1.700 1.700 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.14008E-02 ppm1 0.973 ppm2 8.695 CV 1
ASSI { 1138}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 43 and name HB1 ))
2.500 0.800 0.800 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.23287E-02 ppm1 0.975 ppm2 3.710 CV 1
ASSI { 1140}
(( segid " " and resid 63 and name HB2 ))
( segid " " and resid 59 and name HD1%)
2.800 1.000 1.000 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.25759E-02 ppm1 2.415 ppm2 0.238 CV 1
OR { 1140}
(( segid " " and resid 63 and name HB1 ))
( segid " " and resid 59 and name HD1%)
ASSI { 1141}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 74 and name HA ))
4.400 2.400 1.600 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.63459E-03 ppm1 0.551 ppm2 3.676 CV 1
ASSI { 1143}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 20 and name HA ))
3.500 1.500 1.500 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.11569E-02 ppm1 0.972 ppm2 4.820 CV 1
ASSI { 1145}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 16 and name HA ))
4.700 2.700 1.300 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.71956E-03 ppm1 0.973 ppm2 3.565 CV 1
ASSI { 1147}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 19 and name HG11))
3.200 1.300 1.300 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.34281E-02 ppm1 0.973 ppm2 1.349 CV 1
ASSI { 1148}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 19 and name HB ))
2.100 0.500 0.500 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.90099E-02 ppm1 0.973 ppm2 1.655 CV 1
ASSI { 1150}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 46 and name HG1 ))
3.700 3.700 2.300 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.20007E-02 ppm1 0.973 ppm2 2.348 CV 1
ASSI { 1151}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 19 and name HA ))
2.400 0.700 0.700 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.58643E-02 ppm1 0.972 ppm2 3.955 CV 1
ASSI { 1152}
( segid " " and resid 19 and name HG2%)
( segid " " and resid 19 and name HD1%)
2.100 0.500 0.500 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.93138E-02 ppm1 0.972 ppm2 0.797 CV 1
ASSI { 1156}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 43 and name HA ))
3.500 1.500 1.500 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.12837E-02 ppm1 0.973 ppm2 4.310 CV 1
ASSI { 1159}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 46 and name HB1 ))
3.300 1.300 1.300 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.18947E-02 ppm1 0.973 ppm2 2.162 CV 1
ASSI { 1162}
(( segid " " and resid 35 and name HB1 ))
(( segid " " and resid 32 and name HB1 ))
2.900 1.100 1.100 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.22663E-02 ppm1 2.455 ppm2 3.857 CV 1
ASSI { 1163}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 17 and name HD21))
4.300 2.300 1.700 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.96276E-03 ppm1 2.776 ppm2 6.876 CV 1
ASSI { 1164}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 36 and name HN ))
4.100 2.100 1.900 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.11869E-02 ppm1 2.785 ppm2 7.816 CV 1
ASSI { 1166}
(( segid " " and resid 35 and name HB1 ))
(( segid " " and resid 35 and name HA ))
3.300 1.400 1.400 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.19739E-02 ppm1 2.460 ppm2 4.633 CV 1
ASSI { 1167}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 32 and name HB1 ))
3.700 1.700 1.700 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.14634E-02 ppm1 2.786 ppm2 3.857 CV 1
ASSI { 1169}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 34 and name HB ))
2.800 2.800 3.200 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.84740E-03 ppm1 2.787 ppm2 4.112 CV 1
ASSI { 1170}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HB1 ))
1.800 0.400 0.400 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.12493E-01 ppm1 2.788 ppm2 2.459 CV 1
ASSI { 1173}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 17 and name HD22))
4.500 2.500 1.500 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.13612E-02 ppm1 2.777 ppm2 8.083 CV 1
ASSI { 1174}
(( segid " " and resid 35 and name HB1 ))
(( segid " " and resid 34 and name HB ))
2.700 2.700 3.300 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.10823E-02 ppm1 2.459 ppm2 4.111 CV 1
ASSI { 1178}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 24 and name HA ))
3.400 1.500 1.500 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.76411E-03 ppm1 3.112 ppm2 3.625 CV 1
ASSI { 1179}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HD21))
2.700 0.900 0.900 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.16288E-02 ppm1 3.113 ppm2 6.876 CV 1
ASSI { 1182}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HD22))
3.800 1.800 1.800 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.22793E-02 ppm1 3.112 ppm2 8.082 CV 1
ASSI { 1185}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HA ))
2.700 0.900 0.900 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.27559E-02 ppm1 3.117 ppm2 4.636 CV 1
ASSI { 1188}
(( segid " " and resid 42 and name HB1 ))
(( segid " " and resid 42 and name HA ))
3.200 1.300 1.300 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.22922E-02 ppm1 1.640 ppm2 4.286 CV 1
ASSI { 1192}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 14 and name HA ))
2.900 1.100 1.100 peak 1192 spectrum 1 weight 0.10000E+01 volume 0.25850E-02 ppm1 2.774 ppm2 3.954 CV 1
ASSI { 1193}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HA ))
2.800 1.000 1.000 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.20947E-02 ppm1 1.870 ppm2 4.286 CV 1
ASSI { 1194}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 14 and name HA ))
3.000 1.100 1.100 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.19674E-02 ppm1 3.112 ppm2 3.954 CV 1
ASSI { 1201}
(( segid " " and resid 42 and name HB1 ))
(( segid " " and resid 42 and name HB2 ))
1.800 0.400 0.400 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.11472E-01 ppm1 1.641 ppm2 1.871 CV 1
ASSI { 1207}
(( segid " " and resid 42 and name HB2 ))
( segid " " and resid 42 and name HD1%)
3.500 1.500 1.500 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.98507E-03 ppm1 1.872 ppm2 0.902 CV 1
ASSI { 1219}
(( segid " " and resid 17 and name HB1 ))
( segid " " and resid 24 and name HG1%)
3.700 1.700 1.700 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.15448E-02 ppm1 2.774 ppm2 1.004 CV 1
ASSI { 1220}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 24 and name HG1%)
2.900 1.100 1.100 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.23335E-02 ppm1 3.112 ppm2 1.000 CV 1
ASSI { 1226}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 17 and name HA ))
2.700 0.900 0.900 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.70490E-02 ppm1 2.792 ppm2 4.630 CV 1
ASSI { 1232}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HG ))
2.600 0.800 0.800 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.18707E-02 ppm1 2.307 ppm2 1.471 CV 1
ASSI { 1233}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 33 and name HA ))
1.900 0.400 0.400 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.25690E-02 ppm1 2.307 ppm2 4.096 CV 1
ASSI { 1234}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HA ))
2.900 1.000 1.000 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.14168E-02 ppm1 2.308 ppm2 4.446 CV 1
ASSI { 1235}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 33 and name HA ))
3.800 1.800 1.800 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.14677E-02 ppm1 1.702 ppm2 4.097 CV 1
ASSI { 1237}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 37 and name HG ))
2.500 0.800 0.800 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.22108E-02 ppm1 1.703 ppm2 1.470 CV 1
ASSI { 1238}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HB1 ))
1.700 0.400 0.500 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.51419E-02 ppm1 2.308 ppm2 1.700 CV 1
ASSI { 1247}
(( segid " " and resid 37 and name HB1 ))
( segid " " and resid 39 and name HG2%)
2.900 1.100 1.100 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.23658E-02 ppm1 1.701 ppm2 0.948 CV 1
ASSI { 1252}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HA ))
2.900 1.000 1.000 peak 1252 spectrum 1 weight 0.10000E+01 volume 0.44441E-02 ppm1 3.154 ppm2 4.628 CV 1
ASSI { 1253}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HB1 ))
1.800 0.400 0.400 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.13144E-01 ppm1 3.154 ppm2 2.795 CV 1
ASSI { 1267}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 72 and name HB2 ))
2.000 0.500 0.500 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.66064E-02 ppm1 2.966 ppm2 3.187 CV 1
ASSI { 1271}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HA ))
2.700 0.900 0.900 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.39392E-02 ppm1 3.190 ppm2 4.520 CV 1
ASSI { 1272}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 72 and name HA ))
2.700 0.900 0.900 peak 1272 spectrum 1 weight 0.10000E+01 volume 0.50842E-02 ppm1 2.967 ppm2 4.520 CV 1
ASSI { 1273}
(( segid " " and resid 72 and name HB1 ))
( segid " " and resid 67 and name HD2%)
3.300 1.300 1.300 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.20145E-02 ppm1 2.970 ppm2 0.539 CV 1
ASSI { 1274}
(( segid " " and resid 72 and name HB2 ))
( segid " " and resid 67 and name HD2%)
4.100 2.100 1.900 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.14995E-02 ppm1 3.189 ppm2 0.539 CV 1
ASSI { 1291}
(( segid " " and resid 12 and name HB1 ))
( segid " " and resid 12 and name HD2%)
3.100 1.200 1.200 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.47271E-02 ppm1 1.248 ppm2 0.857 CV 1
ASSI { 1292}
(( segid " " and resid 12 and name HB1 ))
(( segid " " and resid 13 and name HN ))
2.900 1.000 1.000 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.12669E-02 ppm1 1.249 ppm2 8.993 CV 1
ASSI { 1294}
(( segid " " and resid 12 and name HB1 ))
(( segid " " and resid 12 and name HA ))
2.900 1.100 1.100 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.23834E-02 ppm1 1.248 ppm2 4.260 CV 1
ASSI { 1295}
(( segid " " and resid 12 and name HB1 ))
(( segid " " and resid 12 and name HG ))
2.900 1.100 1.100 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.12611E-02 ppm1 1.247 ppm2 1.981 CV 1
ASSI { 1296}
(( segid " " and resid 12 and name HB1 ))
(( segid " " and resid 12 and name HB2 ))
1.700 0.400 0.500 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.88609E-02 ppm1 1.248 ppm2 2.129 CV 1
ASSI { 1300}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 13 and name HN ))
3.600 1.600 1.600 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.19620E-02 ppm1 2.130 ppm2 8.994 CV 1
ASSI { 1302}
(( segid " " and resid 12 and name HB2 ))
( segid " " and resid 12 and name HD2%)
2.500 0.800 0.800 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.39300E-02 ppm1 2.130 ppm2 0.853 CV 1
ASSI { 1305}
(( segid " " and resid 12 and name HB1 ))
(( segid " " and resid 12 and name HN ))
3.200 1.300 1.300 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.19810E-02 ppm1 1.247 ppm2 9.278 CV 1
ASSI { 1310}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HG ))
2.800 1.000 1.000 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.18560E-02 ppm1 2.130 ppm2 1.982 CV 1
ASSI { 1348}
(( segid " " and resid 31 and name HE1 ))
(( segid " " and resid 22 and name HB ))
3.500 1.500 1.500 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.27591E-02 ppm1 2.955 ppm2 1.651 CV 1
ASSI { 1360}
(( segid " " and resid 31 and name HE1 ))
(( segid " " and resid 31 and name HG2 ))
3.200 1.200 1.200 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.24070E-02 ppm1 2.962 ppm2 1.578 CV 1
ASSI { 1367}
(( segid " " and resid 31 and name HE2 ))
(( segid " " and resid 31 and name HG2 ))
3.500 1.500 1.500 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.23833E-02 ppm1 3.027 ppm2 1.576 CV 1
ASSI { 1385}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 68 and name HD1 ))
3.200 1.300 1.300 peak 1385 spectrum 1 weight 0.10000E+01 volume 0.13397E-02 ppm1 3.130 ppm2 1.495 CV 1
OR { 1385}
(( segid " " and resid 68 and name HE1 ))
(( segid " " and resid 68 and name HD1 ))
ASSI { 1387}
(( segid " " and resid 28 and name HE2 ))
(( segid " " and resid 28 and name HD1 ))
2.800 1.000 1.000 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.26768E-02 ppm1 3.066 ppm2 1.342 CV 1
OR { 1387}
(( segid " " and resid 28 and name HE1 ))
(( segid " " and resid 28 and name HD1 ))
ASSI { 1389}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 75 and name HE2 ))
2.700 2.700 3.300 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.62393E-02 ppm1 1.657 ppm2 3.065 CV 1
ASSI { 1393}
(( segid " " and resid 78 and name HB2 ))
( segid " " and resid 8 and name HG2%)
4.900 3.000 1.100 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.86008E-03 ppm1 1.778 ppm2 0.513 CV 1
ASSI { 1394}
(( segid " " and resid 68 and name HE1 ))
(( segid " " and resid 66 and name HA ))
3.500 1.600 1.600 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.84296E-03 ppm1 3.131 ppm2 4.878 CV 1
OR { 1394}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 66 and name HA ))
ASSI { 1395}
(( segid " " and resid 68 and name HE1 ))
(( segid " " and resid 68 and name HG1 ))
2.800 1.000 1.000 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.43786E-02 ppm1 3.129 ppm2 1.785 CV 1
OR { 1395}
(( segid " " and resid 68 and name HE1 ))
(( segid " " and resid 68 and name HG2 ))
OR { 1395}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 68 and name HG1 ))
OR { 1395}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 1396}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 68 and name HD2 ))
3.200 1.300 1.300 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.12266E-02 ppm1 3.129 ppm2 1.602 CV 1
OR { 1396}
(( segid " " and resid 68 and name HE1 ))
(( segid " " and resid 68 and name HD2 ))
ASSI { 1397}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 75 and name HA ))
4.100 2.100 1.900 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.16707E-02 ppm1 1.661 ppm2 3.944 CV 1
ASSI { 1399}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 8 and name HG2%)
5.000 3.100 1.000 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.83743E-03 ppm1 1.663 ppm2 0.512 CV 1
ASSI { 1400}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 78 and name HD1%)
2.600 0.800 0.800 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.45478E-02 ppm1 1.663 ppm2 0.829 CV 1
ASSI { 1401}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 78 and name HA ))
2.600 0.800 0.800 peak 1401 spectrum 1 weight 0.10000E+01 volume 0.19343E-02 ppm1 1.662 ppm2 3.896 CV 1
ASSI { 1406}
(( segid " " and resid 78 and name HB2 ))
( segid " " and resid 78 and name HD1%)
2.400 0.700 0.700 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.51449E-02 ppm1 1.777 ppm2 0.826 CV 1
ASSI { 1463}
(( segid " " and resid 54 and name HD1 ))
(( segid " " and resid 54 and name HB1 ))
4.000 2.000 2.000 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.11529E-02 ppm1 2.729 ppm2 1.091 CV 1
ASSI { 1464}
(( segid " " and resid 54 and name HD2 ))
(( segid " " and resid 54 and name HB1 ))
3.000 1.100 1.100 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.10924E-02 ppm1 2.885 ppm2 1.089 CV 1
ASSI { 1465}
(( segid " " and resid 54 and name HD1 ))
(( segid " " and resid 54 and name HA ))
4.800 2.900 1.200 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.12806E-02 ppm1 2.729 ppm2 3.941 CV 1
ASSI { 1466}
(( segid " " and resid 54 and name HD2 ))
( segid " " and resid 55 and name HE% )
4.100 2.100 1.900 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.10226E-02 ppm1 2.886 ppm2 7.164 CV 1
ASSI { 1467}
(( segid " " and resid 54 and name HD2 ))
(( segid " " and resid 54 and name HA ))
4.400 2.400 1.600 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.13464E-02 ppm1 2.888 ppm2 3.940 CV 1
ASSI { 1468}
(( segid " " and resid 54 and name HD1 ))
( segid " " and resid 55 and name HE% )
3.000 3.000 3.000 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.11758E-02 ppm1 2.730 ppm2 7.165 CV 1
ASSI { 1469}
(( segid " " and resid 54 and name HD1 ))
( segid " " and resid 15 and name HD1%)
3.300 1.400 1.400 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.18900E-02 ppm1 2.728 ppm2 0.764 CV 1
ASSI { 1470}
(( segid " " and resid 54 and name HD1 ))
(( segid " " and resid 54 and name HG1 ))
2.700 0.900 0.900 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.18264E-02 ppm1 2.729 ppm2 0.699 CV 1
ASSI { 1472}
(( segid " " and resid 54 and name HD2 ))
(( segid " " and resid 54 and name HG1 ))
3.200 1.300 1.300 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.18646E-02 ppm1 2.886 ppm2 0.699 CV 1
ASSI { 1475}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HA ))
3.100 1.200 1.200 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.18365E-02 ppm1 1.755 ppm2 3.583 CV 1
ASSI { 1476}
(( segid " " and resid 54 and name HD2 ))
( segid " " and resid 15 and name HD1%)
2.800 1.000 1.000 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.20315E-02 ppm1 2.886 ppm2 0.764 CV 1
ASSI { 1478}
(( segid " " and resid 54 and name HD1 ))
(( segid " " and resid 54 and name HG2 ))
2.800 1.000 1.000 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.17175E-02 ppm1 2.730 ppm2 0.872 CV 1
ASSI { 1483}
(( segid " " and resid 29 and name HB2 ))
( segid " " and resid 29 and name HD1%)
2.800 1.000 1.000 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.25610E-02 ppm1 1.762 ppm2 0.816 CV 1
ASSI { 1486}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HA ))
2.700 0.900 0.900 peak 1486 spectrum 1 weight 0.10000E+01 volume 0.23976E-02 ppm1 1.470 ppm2 3.583 CV 1
ASSI { 1487}
(( segid " " and resid 54 and name HD2 ))
(( segid " " and resid 54 and name HG2 ))
2.700 0.900 0.900 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.19804E-02 ppm1 2.885 ppm2 0.870 CV 1
ASSI { 1489}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HB1 ))
1.800 0.400 0.400 peak 1489 spectrum 1 weight 0.10000E+01 volume 0.10977E-01 ppm1 1.756 ppm2 1.470 CV 1
ASSI { 1491}
(( segid " " and resid 54 and name HD1 ))
(( segid " " and resid 54 and name HB2 ))
3.900 1.900 1.900 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.11330E-02 ppm1 2.731 ppm2 1.589 CV 1
ASSI { 1495}
(( segid " " and resid 29 and name HB1 ))
( segid " " and resid 29 and name HD1%)
3.200 1.300 1.300 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.34601E-02 ppm1 1.471 ppm2 0.816 CV 1
ASSI { 1496}
(( segid " " and resid 29 and name HB1 ))
( segid " " and resid 29 and name HD2%)
2.600 0.900 0.900 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.42378E-02 ppm1 1.472 ppm2 0.915 CV 1
ASSI { 1497}
(( segid " " and resid 29 and name HB2 ))
( segid " " and resid 29 and name HD2%)
2.700 0.900 0.900 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.47797E-02 ppm1 1.755 ppm2 0.915 CV 1
ASSI { 1498}
(( segid " " and resid 54 and name HD2 ))
(( segid " " and resid 54 and name HB2 ))
3.400 1.400 1.400 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.11606E-02 ppm1 2.880 ppm2 1.592 CV 1
ASSI { 1502}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HN ))
3.800 1.800 1.800 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.19679E-02 ppm1 1.472 ppm2 8.492 CV 1
ASSI { 1524}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 71 and name HA2 ))
4.000 2.000 2.000 peak 1524 spectrum 1 weight 0.10000E+01 volume 0.85327E-03 ppm1 1.471 ppm2 4.031 CV 1
ASSI { 1548}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 8 and name HG11))
2.600 0.900 0.900 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.24458E-02 ppm1 0.590 ppm2 0.085 CV 1
ASSI { 1549}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 8 and name HA ))
2.800 1.000 1.000 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.36018E-02 ppm1 0.591 ppm2 3.867 CV 1
ASSI { 1551}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 77 and name HA ))
4.200 2.200 1.800 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.14122E-02 ppm1 0.592 ppm2 3.553 CV 1
ASSI { 1555}
( segid " " and resid 8 and name HD1%)
( segid " " and resid 77 and name HD1%)
2.500 0.800 0.800 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.66913E-02 ppm1 0.591 ppm2 0.685 CV 1
ASSI { 1557}
( segid " " and resid 8 and name HD1%)
( segid " " and resid 78 and name HD2%)
3.300 1.400 1.400 peak 1557 spectrum 1 weight 0.10000E+01 volume 0.49416E-02 ppm1 0.592 ppm2 0.849 CV 1
ASSI { 1560}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 74 and name HA ))
2.700 0.900 0.900 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.65852E-02 ppm1 0.591 ppm2 3.683 CV 1
ASSI { 1564}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 8 and name HB ))
3.100 1.200 1.200 peak 1564 spectrum 1 weight 0.10000E+01 volume 0.40059E-02 ppm1 0.591 ppm2 1.773 CV 1
ASSI { 1565}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 12 and name HG ))
3.700 1.700 1.700 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.12965E-02 ppm1 0.591 ppm2 1.979 CV 1
ASSI { 1592}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 50 and name HB% )
2.700 0.900 0.900 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.93859E-02 ppm1 1.097 ppm2 1.555 CV 1
ASSI { 1593}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 12 and name HA ))
3.500 1.500 1.500 peak 1593 spectrum 1 weight 0.10000E+01 volume 0.16797E-02 ppm1 1.097 ppm2 4.261 CV 1
ASSI { 1596}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 12 and name HD2%)
3.400 1.500 1.500 peak 1596 spectrum 1 weight 0.10000E+01 volume 0.17526E-02 ppm1 1.098 ppm2 0.863 CV 1
OR { 1596}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 12 and name HD1%)
ASSI { 1599}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HA ))
2.700 0.900 0.900 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.43734E-02 ppm1 1.098 ppm2 3.796 CV 1
ASSI { 1601}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HG12))
2.800 1.000 1.000 peak 1601 spectrum 1 weight 0.10000E+01 volume 0.23557E-02 ppm1 1.097 ppm2 1.981 CV 1
ASSI { 1602}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 48 and name HA ))
2.200 0.600 0.600 peak 1602 spectrum 1 weight 0.10000E+01 volume 0.67253E-02 ppm1 1.097 ppm2 3.420 CV 1
ASSI { 1604}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HB ))
2.300 0.600 0.600 peak 1604 spectrum 1 weight 0.10000E+01 volume 0.50507E-02 ppm1 1.097 ppm2 2.128 CV 1
ASSI { 1606}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 16 and name HG2%)
2.400 0.700 0.700 peak 1606 spectrum 1 weight 0.10000E+01 volume 0.55594E-02 ppm1 1.098 ppm2 1.200 CV 1
ASSI { 1607}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 16 and name HA ))
3.000 1.100 1.100 peak 1607 spectrum 1 weight 0.10000E+01 volume 0.13020E-02 ppm1 1.097 ppm2 3.565 CV 1
ASSI { 1608}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 16 and name HN ))
2.800 1.000 1.000 peak 1608 spectrum 1 weight 0.10000E+01 volume 0.15946E-02 ppm1 1.098 ppm2 8.933 CV 1
ASSI { 1615}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 47 and name HG1%)
2.100 0.600 0.600 peak 1615 spectrum 1 weight 0.10000E+01 volume 0.71595E-02 ppm1 1.097 ppm2 0.640 CV 1
ASSI { 1635}
( segid " " and resid 48 and name HG1%)
( segid " " and resid 27 and name HG1%)
3.500 3.500 2.500 peak 1635 spectrum 1 weight 0.10000E+01 volume 0.31264E-02 ppm1 0.639 ppm2 0.743 CV 1
ASSI { 1639}
( segid " " and resid 48 and name HG1%)
( segid " " and resid 12 and name HD2%)
2.700 0.900 0.900 peak 1639 spectrum 1 weight 0.10000E+01 volume 0.30781E-02 ppm1 0.639 ppm2 0.861 CV 1
OR { 1639}
( segid " " and resid 48 and name HG1%)
( segid " " and resid 12 and name HD1%)
ASSI { 1641}
( segid " " and resid 48 and name HG1%)
( segid " " and resid 67 and name HD2%)
3.300 1.300 1.300 peak 1641 spectrum 1 weight 0.10000E+01 volume 0.26364E-02 ppm1 0.638 ppm2 0.534 CV 1
ASSI { 1642}
( segid " " and resid 48 and name HG1%)
(( segid " " and resid 44 and name HA ))
4.700 2.700 1.300 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.10024E-02 ppm1 0.639 ppm2 4.028 CV 1
ASSI { 1643}
( segid " " and resid 48 and name HG1%)
( segid " " and resid 33 and name HE% )
3.300 1.400 1.400 peak 1643 spectrum 1 weight 0.10000E+01 volume 0.11292E-02 ppm1 0.639 ppm2 6.964 CV 1
ASSI { 1645}
( segid " " and resid 48 and name HG1%)
(( segid " " and resid 48 and name HA ))
2.600 0.800 0.800 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.31058E-02 ppm1 0.639 ppm2 3.418 CV 1
ASSI { 1652}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 37 and name HN ))
2.700 0.900 0.900 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.13027E-02 ppm1 3.091 ppm2 7.329 CV 1
ASSI { 1656}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 38 and name HN ))
3.900 1.900 1.900 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.96375E-03 ppm1 2.708 ppm2 7.443 CV 1
ASSI { 1662}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 31 and name HG2 ))
4.600 2.600 1.400 peak 1662 spectrum 1 weight 0.10000E+01 volume 0.73579E-03 ppm1 2.709 ppm2 1.584 CV 1
ASSI { 1664}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 22 and name HG11))
3.600 1.600 1.600 peak 1664 spectrum 1 weight 0.10000E+01 volume 0.13589E-02 ppm1 3.082 ppm2 1.385 CV 1
ASSI { 1666}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 31 and name HD1 ))
3.900 1.900 1.900 peak 1666 spectrum 1 weight 0.10000E+01 volume 0.14379E-02 ppm1 2.708 ppm2 1.384 CV 1
ASSI { 1667}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 31 and name HA ))
3.900 1.900 1.900 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.81429E-03 ppm1 3.081 ppm2 4.383 CV 1
ASSI { 1672}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 32 and name HN ))
3.700 1.700 1.700 peak 1672 spectrum 1 weight 0.10000E+01 volume 0.18039E-02 ppm1 2.707 ppm2 10.104 CV 1
ASSI { 1674}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 31 and name HG1 ))
2.500 0.800 0.800 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.21442E-02 ppm1 2.708 ppm2 1.482 CV 1
ASSI { 1675}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 37 and name HN ))
3.300 1.400 1.400 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.12159E-02 ppm1 2.707 ppm2 7.335 CV 1
ASSI { 1680}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 32 and name HN ))
2.600 0.900 0.900 peak 1680 spectrum 1 weight 0.10000E+01 volume 0.21313E-02 ppm1 3.084 ppm2 10.104 CV 1
ASSI { 1681}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 31 and name HG1 ))
2.400 0.700 0.700 peak 1681 spectrum 1 weight 0.10000E+01 volume 0.16085E-02 ppm1 3.081 ppm2 1.482 CV 1
ASSI { 1684}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 31 and name HA ))
4.500 2.500 1.500 peak 1684 spectrum 1 weight 0.10000E+01 volume 0.74812E-03 ppm1 2.707 ppm2 4.383 CV 1
ASSI { 1686}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HN ))
3.600 1.700 1.700 peak 1686 spectrum 1 weight 0.10000E+01 volume 0.15679E-02 ppm1 2.707 ppm2 7.816 CV 1
ASSI { 1715}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 38 and name HN ))
4.200 2.200 1.800 peak 1715 spectrum 1 weight 0.10000E+01 volume 0.62956E-03 ppm1 3.083 ppm2 7.443 CV 1
ASSI { 1857}
( segid " " and resid 57 and name HG1%)
(( segid " " and resid 52 and name HB2 ))
2.700 0.900 0.900 peak 1857 spectrum 1 weight 0.10000E+01 volume 0.13077E-02 ppm1 0.952 ppm2 2.558 CV 1
ASSI { 1859}
( segid " " and resid 57 and name HG1%)
( segid " " and resid 77 and name HG2%)
2.400 0.700 0.700 peak 1859 spectrum 1 weight 0.10000E+01 volume 0.36990E-02 ppm1 0.951 ppm2 0.552 CV 1
ASSI { 1862}
( segid " " and resid 57 and name HG1%)
(( segid " " and resid 57 and name HA ))
3.100 1.200 1.200 peak 1862 spectrum 1 weight 0.10000E+01 volume 0.31282E-02 ppm1 0.953 ppm2 4.729 CV 1
ASSI { 1868}
( segid " " and resid 57 and name HG1%)
(( segid " " and resid 52 and name HA ))
2.700 0.900 0.900 peak 1868 spectrum 1 weight 0.10000E+01 volume 0.32141E-02 ppm1 0.951 ppm2 4.196 CV 1
ASSI { 1882}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 37 and name HG ))
3.900 1.900 1.900 peak 1882 spectrum 1 weight 0.10000E+01 volume 0.95186E-03 ppm1 0.641 ppm2 1.456 CV 1
ASSI { 1883}
( segid " " and resid 57 and name HG1%)
(( segid " " and resid 81 and name HA ))
3.400 1.400 1.400 peak 1883 spectrum 1 weight 0.10000E+01 volume 0.24757E-02 ppm1 0.951 ppm2 4.454 CV 1
ASSI { 1886}
( segid " " and resid 74 and name HG2%)
( segid " " and resid 3 and name HB% )
3.800 1.800 1.800 peak 1886 spectrum 1 weight 0.10000E+01 volume 0.30539E-02 ppm1 1.116 ppm2 1.568 CV 1
ASSI { 1887}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 9 and name HA ))
3.600 1.600 1.600 peak 1887 spectrum 1 weight 0.10000E+01 volume 0.11631E-02 ppm1 0.643 ppm2 3.395 CV 1
ASSI { 1888}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 73 and name HB% )
3.500 1.500 1.500 peak 1888 spectrum 1 weight 0.10000E+01 volume 0.10052E-02 ppm1 0.643 ppm2 1.541 CV 1
ASSI { 1891}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 9 and name HG1%)
2.200 2.200 3.800 peak 1891 spectrum 1 weight 0.10000E+01 volume 0.41733E-02 ppm1 0.645 ppm2 0.909 CV 1
ASSI { 1892}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 71 and name HN ))
3.400 1.500 1.500 peak 1892 spectrum 1 weight 0.10000E+01 volume 0.16031E-02 ppm1 0.643 ppm2 9.375 CV 1
ASSI { 1893}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 9 and name HG2%)
2.900 1.000 1.000 peak 1893 spectrum 1 weight 0.10000E+01 volume 0.38022E-02 ppm1 0.644 ppm2 1.058 CV 1
ASSI { 1894}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 70 and name HA ))
2.500 0.800 0.800 peak 1894 spectrum 1 weight 0.10000E+01 volume 0.54400E-02 ppm1 0.643 ppm2 3.333 CV 1
ASSI { 1895}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 33 and name HZ ))
3.500 1.600 1.600 peak 1895 spectrum 1 weight 0.10000E+01 volume 0.86719E-03 ppm1 0.642 ppm2 6.799 CV 1
ASSI { 1896}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 70 and name HG1%)
2.000 0.500 0.500 peak 1896 spectrum 1 weight 0.10000E+01 volume 0.14024E-01 ppm1 0.644 ppm2 0.445 CV 1
ASSI { 1897}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 27 and name HA ))
2.800 2.800 3.200 peak 1897 spectrum 1 weight 0.10000E+01 volume 0.65566E-02 ppm1 0.643 ppm2 3.563 CV 1
ASSI { 1898}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 31 and name HD1 ))
3.300 1.400 1.400 peak 1898 spectrum 1 weight 0.10000E+01 volume 0.17782E-02 ppm1 0.642 ppm2 1.408 CV 1
ASSI { 1902}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 33 and name HE% )
3.700 1.700 1.700 peak 1902 spectrum 1 weight 0.10000E+01 volume 0.76258E-03 ppm1 0.643 ppm2 6.965 CV 1
ASSI { 1904}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 12 and name HB1 ))
3.500 1.500 1.500 peak 1904 spectrum 1 weight 0.10000E+01 volume 0.82036E-03 ppm1 0.644 ppm2 1.258 CV 1
ASSI { 1906}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 29 and name HG ))
4.100 2.100 1.900 peak 1906 spectrum 1 weight 0.10000E+01 volume 0.76801E-03 ppm1 0.643 ppm2 1.773 CV 1
ASSI { 1943}
( segid " " and resid 27 and name HG2%)
( segid " " and resid 13 and name HB% )
2.400 0.700 0.700 peak 1943 spectrum 1 weight 0.10000E+01 volume 0.55638E-02 ppm1 0.948 ppm2 1.703 CV 1
ASSI { 1944}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 74 and name HN ))
3.000 1.200 1.200 peak 1944 spectrum 1 weight 0.10000E+01 volume 0.28058E-02 ppm1 1.099 ppm2 8.666 CV 1
ASSI { 1945}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 23 and name HA ))
4.200 2.200 1.800 peak 1945 spectrum 1 weight 0.10000E+01 volume 0.16566E-02 ppm1 1.015 ppm2 4.325 CV 1
OR { 1945}
( segid " " and resid 24 and name HG1%)
(( segid " " and resid 23 and name HA ))
ASSI { 1946}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 71 and name HA1 ))
4.600 2.700 1.400 peak 1946 spectrum 1 weight 0.10000E+01 volume 0.13075E-02 ppm1 1.100 ppm2 3.807 CV 1
ASSI { 1947}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 74 and name HB ))
2.200 0.600 0.600 peak 1947 spectrum 1 weight 0.10000E+01 volume 0.85490E-02 ppm1 1.100 ppm2 4.193 CV 1
ASSI { 1949}
( segid " " and resid 74 and name HG2%)
( segid " " and resid 29 and name HD1%)
2.300 0.700 0.700 peak 1949 spectrum 1 weight 0.10000E+01 volume 0.11747E-01 ppm1 1.100 ppm2 0.822 CV 1
ASSI { 1951}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 8 and name HG12))
4.000 2.000 2.000 peak 1951 spectrum 1 weight 0.10000E+01 volume 0.20223E-02 ppm1 1.098 ppm2 1.506 CV 1
ASSI { 1952}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 75 and name HA ))
4.000 2.000 2.000 peak 1952 spectrum 1 weight 0.10000E+01 volume 0.13945E-02 ppm1 1.100 ppm2 3.945 CV 1
ASSI { 1953}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 9 and name HA ))
3.300 1.400 1.400 peak 1953 spectrum 1 weight 0.10000E+01 volume 0.10971E-02 ppm1 1.099 ppm2 3.389 CV 1
ASSI { 1955}
( segid " " and resid 74 and name HG2%)
( segid " " and resid 8 and name HG2%)
2.400 0.700 0.700 peak 1955 spectrum 1 weight 0.10000E+01 volume 0.33246E-02 ppm1 1.099 ppm2 0.516 CV 1
ASSI { 1956}
( segid " " and resid 74 and name HG2%)
( segid " " and resid 8 and name HD1%)
2.100 0.600 0.600 peak 1956 spectrum 1 weight 0.10000E+01 volume 0.89689E-02 ppm1 1.100 ppm2 0.588 CV 1
ASSI { 1959}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 74 and name HA ))
2.100 0.600 0.600 peak 1959 spectrum 1 weight 0.10000E+01 volume 0.87523E-02 ppm1 1.100 ppm2 3.686 CV 1
ASSI { 1960}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 5 and name HG2 ))
2.900 1.100 1.100 peak 1960 spectrum 1 weight 0.10000E+01 volume 0.30286E-02 ppm1 1.100 ppm2 2.238 CV 1
ASSI { 1961}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 78 and name HG ))
3.300 1.300 1.300 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.14951E-02 ppm1 1.102 ppm2 1.644 CV 1
OR { 1961}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 78 and name HB1 ))
ASSI { 1962}
( segid " " and resid 45 and name HG1%)
(( segid " " and resid 45 and name HA ))
2.300 0.600 0.600 peak 1962 spectrum 1 weight 0.10000E+01 volume 0.90562E-02 ppm1 0.961 ppm2 3.532 CV 1
ASSI { 1964}
( segid " " and resid 9 and name HG1%)
( segid " " and resid 29 and name HD1%)
2.800 2.800 3.200 peak 1964 spectrum 1 weight 0.10000E+01 volume 0.93627E-02 ppm1 0.906 ppm2 0.805 CV 1
ASSI { 1967}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 9 and name HA ))
2.600 0.800 0.800 peak 1967 spectrum 1 weight 0.10000E+01 volume 0.68877E-02 ppm1 0.906 ppm2 3.388 CV 1
ASSI { 1968}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 10 and name HA ))
3.200 1.300 1.300 peak 1968 spectrum 1 weight 0.10000E+01 volume 0.15862E-02 ppm1 0.906 ppm2 4.237 CV 1
ASSI { 1970}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 28 and name HA ))
3.300 1.400 1.400 peak 1970 spectrum 1 weight 0.10000E+01 volume 0.12379E-02 ppm1 0.905 ppm2 4.662 CV 1
ASSI { 1971}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 9 and name HB ))
2.200 0.600 0.600 peak 1971 spectrum 1 weight 0.10000E+01 volume 0.84760E-02 ppm1 0.906 ppm2 2.025 CV 1
ASSI { 1973}
( segid " " and resid 45 and name HG1%)
(( segid " " and resid 45 and name HB ))
2.200 0.600 0.600 peak 1973 spectrum 1 weight 0.10000E+01 volume 0.96947E-02 ppm1 0.963 ppm2 2.234 CV 1
ASSI { 1981}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 13 and name HA ))
2.000 0.500 0.500 peak 1981 spectrum 1 weight 0.10000E+01 volume 0.73081E-02 ppm1 0.950 ppm2 4.060 CV 1
ASSI { 1984}
( segid " " and resid 45 and name HG1%)
(( segid " " and resid 42 and name HA ))
4.500 2.500 1.500 peak 1984 spectrum 1 weight 0.10000E+01 volume 0.63395E-03 ppm1 0.966 ppm2 4.283 CV 1
ASSI { 1985}
( segid " " and resid 27 and name HG2%)
( segid " " and resid 27 and name HG1%)
2.000 0.500 0.500 peak 1985 spectrum 1 weight 0.10000E+01 volume 0.16253E-01 ppm1 0.948 ppm2 0.750 CV 1
ASSI { 1986}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 27 and name HB ))
2.300 0.600 0.600 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.58969E-02 ppm1 0.957 ppm2 2.345 CV 1
ASSI { 1988}
( segid " " and resid 27 and name HG2%)
( segid " " and resid 16 and name HG2%)
3.000 1.100 1.100 peak 1988 spectrum 1 weight 0.10000E+01 volume 0.32646E-02 ppm1 0.948 ppm2 1.197 CV 1
ASSI { 1992}
( segid " " and resid 49 and name HG1%)
(( segid " " and resid 50 and name HA ))
3.300 3.300 2.700 peak 1992 spectrum 1 weight 0.10000E+01 volume 0.16887E-02 ppm1 1.000 ppm2 4.260 CV 1
ASSI { 1993}
( segid " " and resid 49 and name HG1%)
(( segid " " and resid 49 and name HA ))
2.800 1.000 1.000 peak 1993 spectrum 1 weight 0.10000E+01 volume 0.49168E-02 ppm1 1.000 ppm2 3.981 CV 1
ASSI { 1994}
( segid " " and resid 49 and name HG1%)
( segid " " and resid 49 and name HG2%)
2.000 0.500 0.500 peak 1994 spectrum 1 weight 0.10000E+01 volume 0.26879E-01 ppm1 1.000 ppm2 1.110 CV 1
ASSI { 2002}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 69 and name HN ))
2.900 1.000 1.000 peak 2002 spectrum 1 weight 0.10000E+01 volume 0.28914E-02 ppm1 1.064 ppm2 8.739 CV 1
ASSI { 2003}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 32 and name HN ))
3.900 1.900 1.900 peak 2003 spectrum 1 weight 0.10000E+01 volume 0.10386E-02 ppm1 1.065 ppm2 10.104 CV 1
ASSI { 2005}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 69 and name HG1 ))
3.400 1.400 1.400 peak 2005 spectrum 1 weight 0.10000E+01 volume 0.91697E-03 ppm1 1.065 ppm2 5.334 CV 1
ASSI { 2006}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 70 and name HN ))
3.700 1.700 1.700 peak 2006 spectrum 1 weight 0.10000E+01 volume 0.30164E-02 ppm1 1.065 ppm2 8.078 CV 1
ASSI { 2007}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 32 and name HA ))
2.400 0.700 0.700 peak 2007 spectrum 1 weight 0.10000E+01 volume 0.42385E-02 ppm1 1.065 ppm2 4.877 CV 1
ASSI { 2008}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 69 and name HA ))
2.500 0.800 0.800 peak 2008 spectrum 1 weight 0.10000E+01 volume 0.62349E-02 ppm1 1.065 ppm2 5.247 CV 1
ASSI { 2009}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 69 and name HB ))
2.200 0.600 0.600 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.98018E-02 ppm1 1.065 ppm2 4.367 CV 1
ASSI { 2011}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 71 and name HN ))
4.300 2.300 1.700 peak 2011 spectrum 1 weight 0.10000E+01 volume 0.12107E-02 ppm1 1.065 ppm2 9.375 CV 1
ASSI { 2012}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 67 and name HA ))
3.700 1.700 1.700 peak 2012 spectrum 1 weight 0.10000E+01 volume 0.20310E-02 ppm1 1.066 ppm2 4.499 CV 1
ASSI { 2013}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 33 and name HN ))
3.700 1.700 1.700 peak 2013 spectrum 1 weight 0.10000E+01 volume 0.27783E-02 ppm1 1.066 ppm2 8.373 CV 1
ASSI { 2014}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 32 and name HB1 ))
3.600 1.700 1.700 peak 2014 spectrum 1 weight 0.10000E+01 volume 0.97155E-03 ppm1 1.066 ppm2 3.860 CV 1
ASSI { 2028}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 44 and name HG2 ))
3.900 1.900 1.900 peak 2028 spectrum 1 weight 0.10000E+01 volume 0.15930E-02 ppm1 0.776 ppm2 2.524 CV 1
ASSI { 2030}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 64 and name HA ))
2.300 0.700 0.700 peak 2030 spectrum 1 weight 0.10000E+01 volume 0.48249E-02 ppm1 0.776 ppm2 3.082 CV 1
ASSI { 2031}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 65 and name HB2 ))
4.500 2.500 1.500 peak 2031 spectrum 1 weight 0.10000E+01 volume 0.69562E-03 ppm1 0.777 ppm2 1.814 CV 1
OR { 2031}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 65 and name HB1 ))
ASSI { 2033}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 77 and name HD1%)
2.800 2.800 3.200 peak 2033 spectrum 1 weight 0.10000E+01 volume 0.45714E-02 ppm1 0.776 ppm2 0.671 CV 1
ASSI { 2034}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 45 and name HG2%)
3.300 1.400 1.400 peak 2034 spectrum 1 weight 0.10000E+01 volume 0.33572E-02 ppm1 0.776 ppm2 1.137 CV 1
ASSI { 2036}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 44 and name HG1 ))
2.900 1.000 1.000 peak 2036 spectrum 1 weight 0.10000E+01 volume 0.16046E-02 ppm1 0.776 ppm2 2.176 CV 1
ASSI { 2039}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 64 and name HG2%)
2.200 0.600 0.600 peak 2039 spectrum 1 weight 0.10000E+01 volume 0.10348E-01 ppm1 0.776 ppm2 0.936 CV 1
ASSI { 2046}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 65 and name HA ))
3.300 1.400 1.400 peak 2046 spectrum 1 weight 0.10000E+01 volume 0.13741E-02 ppm1 0.775 ppm2 4.031 CV 1
ASSI { 2054}
( segid " " and resid 57 and name HG2%)
( segid " " and resid 76 and name HE% )
4.000 2.000 2.000 peak 2054 spectrum 1 weight 0.10000E+01 volume 0.87020E-03 ppm1 1.004 ppm2 6.580 CV 1
ASSI { 2055}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 52 and name HB1 ))
4.400 2.400 1.600 peak 2055 spectrum 1 weight 0.10000E+01 volume 0.12189E-02 ppm1 1.004 ppm2 2.155 CV 1
ASSI { 2057}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 81 and name HB2 ))
4.500 2.500 1.500 peak 2057 spectrum 1 weight 0.10000E+01 volume 0.10098E-02 ppm1 1.000 ppm2 2.361 CV 1
ASSI { 2058}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 77 and name HA ))
2.900 1.000 1.000 peak 2058 spectrum 1 weight 0.10000E+01 volume 0.20435E-02 ppm1 1.004 ppm2 3.535 CV 1
ASSI { 2059}
( segid " " and resid 57 and name HG2%)
( segid " " and resid 59 and name HG2%)
2.900 1.000 1.000 peak 2059 spectrum 1 weight 0.10000E+01 volume 0.19324E-02 ppm1 1.003 ppm2 0.620 CV 1
ASSI { 2063}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 55 and name HB1 ))
4.100 2.100 1.900 peak 2063 spectrum 1 weight 0.10000E+01 volume 0.14374E-02 ppm1 1.001 ppm2 2.746 CV 1
ASSI { 2064}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 57 and name HA ))
2.700 0.900 0.900 peak 2064 spectrum 1 weight 0.10000E+01 volume 0.42152E-02 ppm1 1.004 ppm2 4.729 CV 1
ASSI { 2067}
( segid " " and resid 57 and name HG2%)
( segid " " and resid 77 and name HD1%)
4.300 2.300 1.700 peak 2067 spectrum 1 weight 0.10000E+01 volume 0.15896E-02 ppm1 1.004 ppm2 0.677 CV 1
ASSI { 2070}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 81 and name HG1 ))
4.100 2.100 1.900 peak 2070 spectrum 1 weight 0.10000E+01 volume 0.16219E-02 ppm1 1.004 ppm2 2.563 CV 1
ASSI { 2071}
( segid " " and resid 57 and name HG2%)
( segid " " and resid 76 and name HD% )
4.000 2.000 2.000 peak 2071 spectrum 1 weight 0.10000E+01 volume 0.79248E-03 ppm1 1.004 ppm2 6.805 CV 1
ASSI { 2086}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 70 and name HG1%)
2.200 0.600 0.600 peak 2086 spectrum 1 weight 0.10000E+01 volume 0.93577E-02 ppm1 0.748 ppm2 0.445 CV 1
ASSI { 2087}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 13 and name HA ))
2.500 0.800 0.800 peak 2087 spectrum 1 weight 0.10000E+01 volume 0.76613E-02 ppm1 0.747 ppm2 4.061 CV 1
ASSI { 2091}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 28 and name HN ))
2.800 1.000 1.000 peak 2091 spectrum 1 weight 0.10000E+01 volume 0.22105E-02 ppm1 0.748 ppm2 6.315 CV 1
ASSI { 2093}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 34 and name HA ))
4.500 2.500 1.500 peak 2093 spectrum 1 weight 0.10000E+01 volume 0.88046E-03 ppm1 0.947 ppm2 4.347 CV 1
ASSI { 2094}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 33 and name HB2 ))
5.000 3.200 1.000 peak 2094 spectrum 1 weight 0.10000E+01 volume 0.10588E-02 ppm1 0.948 ppm2 3.210 CV 1
ASSI { 2095}
( segid " " and resid 39 and name HG2%)
( segid " " and resid 33 and name HD% )
2.800 1.000 1.000 peak 2095 spectrum 1 weight 0.10000E+01 volume 0.33871E-02 ppm1 0.948 ppm2 7.128 CV 1
ASSI { 2097}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 33 and name HA ))
4.000 2.000 2.000 peak 2097 spectrum 1 weight 0.10000E+01 volume 0.15992E-02 ppm1 0.948 ppm2 4.096 CV 1
ASSI { 2099}
( segid " " and resid 39 and name HG2%)
( segid " " and resid 20 and name HB% )
2.300 0.700 0.700 peak 2099 spectrum 1 weight 0.10000E+01 volume 0.68941E-02 ppm1 0.948 ppm2 1.547 CV 1
ASSI { 2100}
( segid " " and resid 39 and name HG2%)
( segid " " and resid 33 and name HE% )
3.100 1.200 1.200 peak 2100 spectrum 1 weight 0.10000E+01 volume 0.79475E-03 ppm1 0.947 ppm2 6.965 CV 1
ASSI { 2101}
( segid " " and resid 39 and name HG2%)
( segid " " and resid 37 and name HD1%)
2.500 2.500 3.500 peak 2101 spectrum 1 weight 0.10000E+01 volume 0.19033E-02 ppm1 0.950 ppm2 0.591 CV 1
ASSI { 2102}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 42 and name HN ))
3.200 3.200 2.800 peak 2102 spectrum 1 weight 0.10000E+01 volume 0.25808E-02 ppm1 0.949 ppm2 7.867 CV 1
ASSI { 2103}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 33 and name HB1 ))
4.200 2.200 1.800 peak 2103 spectrum 1 weight 0.10000E+01 volume 0.10983E-02 ppm1 0.948 ppm2 3.149 CV 1
ASSI { 2104}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 37 and name HB2 ))
3.400 1.400 1.400 peak 2104 spectrum 1 weight 0.10000E+01 volume 0.26402E-02 ppm1 0.948 ppm2 2.305 CV 1
ASSI { 2105}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 39 and name HA ))
2.200 0.600 0.600 peak 2105 spectrum 1 weight 0.10000E+01 volume 0.73007E-02 ppm1 0.948 ppm2 3.991 CV 1
ASSI { 2117}
( segid " " and resid 39 and name HG1%)
( segid " " and resid 34 and name HG2%)
2.700 0.900 0.900 peak 2117 spectrum 1 weight 0.10000E+01 volume 0.42519E-02 ppm1 0.858 ppm2 1.302 CV 1
ASSI { 2124}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 45 and name HN ))
1.900 0.400 0.400 peak 2124 spectrum 1 weight 0.10000E+01 volume 0.10712E-01 ppm1 1.117 ppm2 7.189 CV 1
ASSI { 2125}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 42 and name HA ))
3.000 1.100 1.100 peak 2125 spectrum 1 weight 0.10000E+01 volume 0.31406E-02 ppm1 1.117 ppm2 4.285 CV 1
ASSI { 2127}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 44 and name HN ))
5.100 3.300 0.900 peak 2127 spectrum 1 weight 0.10000E+01 volume 0.68734E-03 ppm1 1.119 ppm2 8.624 CV 1
ASSI { 2128}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 46 and name HN ))
3.800 1.800 1.800 peak 2128 spectrum 1 weight 0.10000E+01 volume 0.16038E-02 ppm1 1.116 ppm2 6.954 CV 1
ASSI { 2129}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 45 and name HA ))
2.400 0.700 0.700 peak 2129 spectrum 1 weight 0.10000E+01 volume 0.79382E-02 ppm1 1.117 ppm2 3.526 CV 1
ASSI { 2131}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 44 and name HB1 ))
2.400 0.800 0.800 peak 2131 spectrum 1 weight 0.10000E+01 volume 0.16291E-02 ppm1 0.950 ppm2 1.872 CV 1
ASSI { 2136}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 44 and name HG1 ))
4.200 2.200 1.800 peak 2136 spectrum 1 weight 0.10000E+01 volume 0.80225E-03 ppm1 0.842 ppm2 2.172 CV 1
ASSI { 2139}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 33 and name HB2 ))
4.400 2.400 1.600 peak 2139 spectrum 1 weight 0.10000E+01 volume 0.10456E-02 ppm1 0.839 ppm2 3.211 CV 1
ASSI { 2140}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 43 and name HB1 ))
3.800 1.800 1.800 peak 2140 spectrum 1 weight 0.10000E+01 volume 0.26327E-02 ppm1 0.840 ppm2 3.710 CV 1
ASSI { 2143}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 43 and name HB2 ))
2.700 0.900 0.900 peak 2143 spectrum 1 weight 0.10000E+01 volume 0.91238E-02 ppm1 0.840 ppm2 4.020 CV 1
ASSI { 2145}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 44 and name HB1 ))
2.300 0.700 0.700 peak 2145 spectrum 1 weight 0.10000E+01 volume 0.24776E-02 ppm1 0.839 ppm2 1.864 CV 1
ASSI { 2146}
( segid " " and resid 39 and name HG1%)
( segid " " and resid 39 and name HG2%)
2.000 0.500 0.500 peak 2146 spectrum 1 weight 0.10000E+01 volume 0.19436E-01 ppm1 0.840 ppm2 0.950 CV 1
ASSI { 2147}
(( segid " " and resid 21 and name HA2 ))
(( segid " " and resid 22 and name HN ))
3.600 1.600 1.600 peak 2147 spectrum 1 weight 0.10000E+01 volume 0.13141E-02 ppm1 4.079 ppm2 6.418 CV 1
ASSI { 2148}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 44 and name HG2 ))
2.900 1.100 1.100 peak 2148 spectrum 1 weight 0.10000E+01 volume 0.13964E-02 ppm1 0.840 ppm2 2.525 CV 1
ASSI { 2154}
(( segid " " and resid 21 and name HA1 ))
(( segid " " and resid 22 and name HN ))
3.500 1.600 1.600 peak 2154 spectrum 1 weight 0.10000E+01 volume 0.12799E-02 ppm1 3.960 ppm2 6.419 CV 1
ASSI { 2155}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 68 and name HN ))
5.000 3.100 1.000 peak 2155 spectrum 1 weight 0.10000E+01 volume 0.83299E-03 ppm1 0.539 ppm2 8.390 CV 1
ASSI { 2156}
(( segid " " and resid 21 and name HA1 ))
(( segid " " and resid 21 and name HN ))
2.500 0.800 0.800 peak 2156 spectrum 1 weight 0.10000E+01 volume 0.44203E-02 ppm1 3.959 ppm2 7.871 CV 1
ASSI { 2157}
( segid " " and resid 67 and name HD2%)
( segid " " and resid 59 and name HD1%)
3.400 1.400 1.400 peak 2157 spectrum 1 weight 0.10000E+01 volume 0.79002E-03 ppm1 0.542 ppm2 0.239 CV 1
ASSI { 2159}
(( segid " " and resid 21 and name HA2 ))
(( segid " " and resid 21 and name HN ))
2.500 0.800 0.800 peak 2159 spectrum 1 weight 0.10000E+01 volume 0.48759E-02 ppm1 4.083 ppm2 7.871 CV 1
ASSI { 2163}
(( segid " " and resid 21 and name HA2 ))
(( segid " " and resid 20 and name HN ))
3.900 1.900 1.900 peak 2163 spectrum 1 weight 0.10000E+01 volume 0.60681E-03 ppm1 4.081 ppm2 8.698 CV 1
ASSI { 2164}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 67 and name HN ))
3.500 1.500 1.500 peak 2164 spectrum 1 weight 0.10000E+01 volume 0.17487E-02 ppm1 0.539 ppm2 7.758 CV 1
ASSI { 2166}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 67 and name HG ))
2.400 0.700 0.700 peak 2166 spectrum 1 weight 0.10000E+01 volume 0.39241E-02 ppm1 0.539 ppm2 1.815 CV 1
ASSI { 2167}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 73 and name HA ))
2.200 0.600 0.600 peak 2167 spectrum 1 weight 0.10000E+01 volume 0.51281E-02 ppm1 0.539 ppm2 4.129 CV 1
ASSI { 2168}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 67 and name HA ))
3.200 1.200 1.200 peak 2168 spectrum 1 weight 0.10000E+01 volume 0.62842E-02 ppm1 0.539 ppm2 4.511 CV 1
ASSI { 2169}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 64 and name HA ))
2.300 0.700 0.700 peak 2169 spectrum 1 weight 0.10000E+01 volume 0.35275E-02 ppm1 0.539 ppm2 3.092 CV 1
ASSI { 2170}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 67 and name HB2 ))
3.300 1.300 1.300 peak 2170 spectrum 1 weight 0.10000E+01 volume 0.20034E-02 ppm1 0.539 ppm2 2.143 CV 1
ASSI { 2174}
( segid " " and resid 67 and name HD2%)
( segid " " and resid 67 and name HD1%)
2.200 0.600 0.600 peak 2174 spectrum 1 weight 0.10000E+01 volume 0.97964E-02 ppm1 0.541 ppm2 0.428 CV 1
ASSI { 2175}
( segid " " and resid 67 and name HD2%)
( segid " " and resid 76 and name HE% )
4.000 2.000 2.000 peak 2175 spectrum 1 weight 0.10000E+01 volume 0.64840E-03 ppm1 0.540 ppm2 6.580 CV 1
ASSI { 2187}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 69 and name HB ))
4.100 2.100 1.900 peak 2187 spectrum 1 weight 0.10000E+01 volume 0.12555E-02 ppm1 0.770 ppm2 4.376 CV 1
ASSI { 2189}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HG ))
2.500 0.800 0.800 peak 2189 spectrum 1 weight 0.10000E+01 volume 0.37984E-02 ppm1 0.866 ppm2 1.980 CV 1
ASSI { 2191}
( segid " " and resid 49 and name HG2%)
(( segid " " and resid 46 and name HA ))
3.200 1.300 1.300 peak 2191 spectrum 1 weight 0.10000E+01 volume 0.36127E-02 ppm1 1.113 ppm2 4.045 CV 1
ASSI { 2193}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HN ))
4.200 2.200 1.800 peak 2193 spectrum 1 weight 0.10000E+01 volume 0.13116E-02 ppm1 0.867 ppm2 9.277 CV 1
ASSI { 2194}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 33 and name HZ ))
3.100 1.200 1.200 peak 2194 spectrum 1 weight 0.10000E+01 volume 0.11454E-02 ppm1 0.867 ppm2 6.798 CV 1
ASSI { 2196}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HB2 ))
3.400 1.400 1.400 peak 2196 spectrum 1 weight 0.10000E+01 volume 0.23319E-02 ppm1 0.867 ppm2 2.128 CV 1
ASSI { 2197}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HA ))
2.400 0.700 0.700 peak 2197 spectrum 1 weight 0.10000E+01 volume 0.62472E-02 ppm1 0.867 ppm2 4.260 CV 1
ASSI { 2199}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HB1 ))
2.700 0.900 0.900 peak 2199 spectrum 1 weight 0.10000E+01 volume 0.26193E-02 ppm1 0.868 ppm2 1.246 CV 1
ASSI { 2202}
( segid " " and resid 49 and name HG2%)
(( segid " " and resid 49 and name HB ))
2.200 0.600 0.600 peak 2202 spectrum 1 weight 0.10000E+01 volume 0.98600E-02 ppm1 1.113 ppm2 2.064 CV 1
ASSI { 2203}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 31 and name HG2 ))
2.700 0.900 0.900 peak 2203 spectrum 1 weight 0.10000E+01 volume 0.10712E-02 ppm1 0.771 ppm2 1.582 CV 1
ASSI { 2205}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 51 and name HB% )
2.800 1.000 1.000 peak 2205 spectrum 1 weight 0.10000E+01 volume 0.40814E-02 ppm1 0.867 ppm2 1.526 CV 1
ASSI { 2214}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 31 and name HB1 ))
4.200 2.200 1.800 peak 2214 spectrum 1 weight 0.10000E+01 volume 0.13176E-02 ppm1 0.774 ppm2 1.814 CV 1
ASSI { 2215}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 36 and name HB1 ))
3.500 1.500 1.500 peak 2215 spectrum 1 weight 0.10000E+01 volume 0.14116E-02 ppm1 0.773 ppm2 2.703 CV 1
ASSI { 2216}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 22 and name HG11))
2.700 0.900 0.900 peak 2216 spectrum 1 weight 0.10000E+01 volume 0.33271E-02 ppm1 0.774 ppm2 1.381 CV 1
ASSI { 2217}
( segid " " and resid 37 and name HD2%)
( segid " " and resid 37 and name HD1%)
2.000 0.500 0.500 peak 2217 spectrum 1 weight 0.10000E+01 volume 0.85140E-02 ppm1 0.774 ppm2 0.592 CV 1
ASSI { 2219}
( segid " " and resid 37 and name HD2%)
( segid " " and resid 22 and name HG2%)
1.900 1.900 4.100 peak 2219 spectrum 1 weight 0.10000E+01 volume 0.82179E-02 ppm1 0.772 ppm2 1.011 CV 1
ASSI { 2220}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 36 and name HB2 ))
3.300 1.400 1.400 peak 2220 spectrum 1 weight 0.10000E+01 volume 0.84153E-03 ppm1 0.774 ppm2 3.077 CV 1
ASSI { 2221}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 26 and name HB1 ))
2.900 2.900 3.100 peak 2221 spectrum 1 weight 0.10000E+01 volume 0.77921E-03 ppm1 0.773 ppm2 2.637 CV 1
ASSI { 2223}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HG ))
2.200 0.600 0.600 peak 2223 spectrum 1 weight 0.10000E+01 volume 0.50359E-02 ppm1 0.773 ppm2 1.470 CV 1
ASSI { 2224}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 22 and name HG11))
4.100 2.100 1.900 peak 2224 spectrum 1 weight 0.10000E+01 volume 0.21901E-02 ppm1 1.007 ppm2 1.370 CV 1
ASSI { 2227}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 22 and name HG12))
3.700 1.700 1.700 peak 2227 spectrum 1 weight 0.10000E+01 volume 0.27074E-02 ppm1 1.008 ppm2 1.313 CV 1
ASSI { 2228}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HB2 ))
2.900 1.000 1.000 peak 2228 spectrum 1 weight 0.10000E+01 volume 0.18450E-02 ppm1 0.773 ppm2 2.305 CV 1
ASSI { 2230}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 22 and name HN ))
3.200 1.300 1.300 peak 2230 spectrum 1 weight 0.10000E+01 volume 0.16776E-02 ppm1 1.007 ppm2 6.419 CV 1
ASSI { 2232}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 37 and name HD1%)
2.300 0.700 0.700 peak 2232 spectrum 1 weight 0.10000E+01 volume 0.36178E-02 ppm1 1.007 ppm2 0.590 CV 1
ASSI { 2234}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 44 and name HA ))
2.200 0.600 0.600 peak 2234 spectrum 1 weight 0.10000E+01 volume 0.42217E-02 ppm1 0.964 ppm2 4.026 CV 1
ASSI { 2236}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 31 and name HD2 ))
3.900 1.900 1.900 peak 2236 spectrum 1 weight 0.10000E+01 volume 0.11007E-02 ppm1 0.771 ppm2 2.074 CV 1
ASSI { 2240}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HB1 ))
3.400 1.400 1.400 peak 2240 spectrum 1 weight 0.10000E+01 volume 0.31746E-02 ppm1 0.774 ppm2 1.699 CV 1
ASSI { 2243}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 27 and name HA ))
3.600 1.600 1.600 peak 2243 spectrum 1 weight 0.10000E+01 volume 0.22681E-02 ppm1 0.773 ppm2 3.551 CV 1
ASSI { 2245}
( segid " " and resid 48 and name HG2%)
( segid " " and resid 48 and name HG1%)
2.100 0.500 0.500 peak 2245 spectrum 1 weight 0.10000E+01 volume 0.12823E-01 ppm1 0.965 ppm2 0.637 CV 1
ASSI { 2249}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 48 and name HA ))
2.300 0.700 0.700 peak 2249 spectrum 1 weight 0.10000E+01 volume 0.62408E-02 ppm1 0.965 ppm2 3.418 CV 1
ASSI { 2250}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 28 and name HN ))
4.300 2.300 1.700 peak 2250 spectrum 1 weight 0.10000E+01 volume 0.96044E-03 ppm1 0.775 ppm2 6.316 CV 1
ASSI { 2251}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HA ))
2.400 0.700 0.700 peak 2251 spectrum 1 weight 0.10000E+01 volume 0.72321E-02 ppm1 0.774 ppm2 4.449 CV 1
ASSI { 2253}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 33 and name HE% )
3.100 1.200 1.200 peak 2253 spectrum 1 weight 0.10000E+01 volume 0.93276E-03 ppm1 1.006 ppm2 6.965 CV 1
ASSI { 2255}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 69 and name HN ))
3.900 1.900 1.900 peak 2255 spectrum 1 weight 0.10000E+01 volume 0.20262E-02 ppm1 0.446 ppm2 8.746 CV 1
ASSI { 2257}
( segid " " and resid 70 and name HG1%)
( segid " " and resid 37 and name HD1%)
2.500 0.800 0.800 peak 2257 spectrum 1 weight 0.10000E+01 volume 0.88194E-02 ppm1 0.446 ppm2 0.584 CV 1
ASSI { 2259}
( segid " " and resid 70 and name HG1%)
( segid " " and resid 73 and name HB% )
3.800 1.800 1.800 peak 2259 spectrum 1 weight 0.10000E+01 volume 0.95590E-03 ppm1 0.446 ppm2 1.539 CV 1
ASSI { 2260}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 28 and name HN ))
2.900 1.100 1.100 peak 2260 spectrum 1 weight 0.10000E+01 volume 0.13531E-02 ppm1 0.445 ppm2 6.314 CV 1
ASSI { 2261}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 69 and name HA ))
3.900 1.900 1.900 peak 2261 spectrum 1 weight 0.10000E+01 volume 0.13206E-02 ppm1 0.445 ppm2 5.248 CV 1
ASSI { 2262}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 71 and name HN ))
2.800 1.000 1.000 peak 2262 spectrum 1 weight 0.10000E+01 volume 0.13987E-02 ppm1 0.445 ppm2 9.375 CV 1
ASSI { 2263}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 69 and name HB ))
3.800 1.800 1.800 peak 2263 spectrum 1 weight 0.10000E+01 volume 0.13355E-02 ppm1 0.445 ppm2 4.368 CV 1
ASSI { 2265}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 70 and name HB ))
2.100 0.500 0.500 peak 2265 spectrum 1 weight 0.10000E+01 volume 0.76890E-02 ppm1 0.445 ppm2 2.270 CV 1
ASSI { 2266}
( segid " " and resid 70 and name HG1%)
( segid " " and resid 33 and name HE% )
3.600 1.600 1.600 peak 2266 spectrum 1 weight 0.10000E+01 volume 0.30295E-02 ppm1 0.446 ppm2 6.966 CV 1
ASSI { 2267}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 33 and name HZ ))
3.700 1.700 1.700 peak 2267 spectrum 1 weight 0.10000E+01 volume 0.19918E-02 ppm1 0.445 ppm2 6.798 CV 1
ASSI { 2268}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 70 and name HA ))
2.700 0.900 0.900 peak 2268 spectrum 1 weight 0.10000E+01 volume 0.77911E-02 ppm1 0.445 ppm2 3.334 CV 1
ASSI { 2269}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 27 and name HA ))
3.200 1.300 1.300 peak 2269 spectrum 1 weight 0.10000E+01 volume 0.22582E-02 ppm1 0.445 ppm2 3.569 CV 1
ASSI { 2270}
( segid " " and resid 70 and name HG1%)
(( segid " " and resid 70 and name HN ))
1.900 0.400 0.400 peak 2270 spectrum 1 weight 0.10000E+01 volume 0.99745E-02 ppm1 0.445 ppm2 8.080 CV 1
ASSI { 2273}
(( segid " " and resid 11 and name HA2 ))
(( segid " " and resid 14 and name HB1 ))
3.300 1.400 1.400 peak 2273 spectrum 1 weight 0.10000E+01 volume 0.61766E-03 ppm1 4.085 ppm2 2.239 CV 1
ASSI { 2274}
(( segid " " and resid 11 and name HA2 ))
(( segid " " and resid 11 and name HN ))
2.900 1.000 1.000 peak 2274 spectrum 1 weight 0.10000E+01 volume 0.46416E-02 ppm1 4.088 ppm2 8.405 CV 1
ASSI { 2276}
(( segid " " and resid 11 and name HA2 ))
(( segid " " and resid 12 and name HN ))
3.700 1.700 1.700 peak 2276 spectrum 1 weight 0.10000E+01 volume 0.14137E-02 ppm1 4.089 ppm2 9.276 CV 1
ASSI { 2278}
( segid " " and resid 70 and name HG1%)
( segid " " and resid 9 and name HG2%)
3.600 1.600 1.600 peak 2278 spectrum 1 weight 0.10000E+01 volume 0.11485E-02 ppm1 0.447 ppm2 1.068 CV 1
ASSI { 2279}
( segid " " and resid 70 and name HG1%)
( segid " " and resid 16 and name HG2%)
3.500 1.500 1.500 peak 2279 spectrum 1 weight 0.10000E+01 volume 0.17024E-02 ppm1 0.445 ppm2 1.195 CV 1
ASSI { 2280}
(( segid " " and resid 11 and name HA1 ))
(( segid " " and resid 12 and name HN ))
2.900 1.000 1.000 peak 2280 spectrum 1 weight 0.10000E+01 volume 0.17092E-02 ppm1 3.882 ppm2 9.276 CV 1
ASSI { 2281}
(( segid " " and resid 11 and name HA2 ))
(( segid " " and resid 14 and name HB2 ))
3.900 1.900 1.900 peak 2281 spectrum 1 weight 0.10000E+01 volume 0.61125E-03 ppm1 4.086 ppm2 2.305 CV 1
ASSI { 2282}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 31 and name HD1 ))
4.200 2.200 1.800 peak 2282 spectrum 1 weight 0.10000E+01 volume 0.63735E-03 ppm1 1.197 ppm2 1.400 CV 1
ASSI { 2285}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 12 and name HA ))
4.000 2.000 2.000 peak 2285 spectrum 1 weight 0.10000E+01 volume 0.66459E-03 ppm1 1.200 ppm2 4.262 CV 1
ASSI { 2286}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 16 and name HG1%)
2.100 0.500 0.500 peak 2286 spectrum 1 weight 0.10000E+01 volume 0.14545E-01 ppm1 1.199 ppm2 1.008 CV 1
ASSI { 2287}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 37 and name HD1%)
2.900 1.100 1.100 peak 2287 spectrum 1 weight 0.10000E+01 volume 0.22459E-02 ppm1 1.200 ppm2 0.588 CV 1
ASSI { 2291}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 13 and name HA ))
2.700 0.900 0.900 peak 2291 spectrum 1 weight 0.10000E+01 volume 0.21822E-02 ppm1 1.199 ppm2 4.061 CV 1
ASSI { 2294}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 33 and name HZ ))
3.400 1.400 1.400 peak 2294 spectrum 1 weight 0.10000E+01 volume 0.73500E-03 ppm1 1.200 ppm2 6.797 CV 1
ASSI { 2295}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 22 and name HG12))
3.800 3.800 2.200 peak 2295 spectrum 1 weight 0.10000E+01 volume 0.46249E-02 ppm1 1.199 ppm2 1.302 CV 1
ASSI { 2296}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 16 and name HA ))
2.300 0.700 0.700 peak 2296 spectrum 1 weight 0.10000E+01 volume 0.72207E-02 ppm1 1.199 ppm2 3.566 CV 1
ASSI { 2299}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 42 and name HG ))
3.000 1.100 1.100 peak 2299 spectrum 1 weight 0.10000E+01 volume 0.19121E-02 ppm1 0.897 ppm2 1.687 CV 1
ASSI { 2300}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 33 and name HE% )
2.500 0.800 0.800 peak 2300 spectrum 1 weight 0.10000E+01 volume 0.49136E-02 ppm1 1.199 ppm2 6.966 CV 1
ASSI { 2301}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 42 and name HB1 ))
3.400 1.500 1.500 peak 2301 spectrum 1 weight 0.10000E+01 volume 0.24024E-02 ppm1 0.901 ppm2 1.643 CV 1
ASSI { 2303}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 42 and name HA ))
2.500 0.800 0.800 peak 2303 spectrum 1 weight 0.10000E+01 volume 0.60015E-02 ppm1 0.900 ppm2 4.284 CV 1
ASSI { 2310}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 44 and name HG2 ))
4.300 2.300 1.700 peak 2310 spectrum 1 weight 0.10000E+01 volume 0.89447E-03 ppm1 0.872 ppm2 2.525 CV 1
ASSI { 2312}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 45 and name HA ))
3.700 3.700 2.300 peak 2312 spectrum 1 weight 0.10000E+01 volume 0.17335E-02 ppm1 0.873 ppm2 3.527 CV 1
ASSI { 2315}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 45 and name HB ))
2.600 0.800 0.800 peak 2315 spectrum 1 weight 0.10000E+01 volume 0.60735E-02 ppm1 0.873 ppm2 2.234 CV 1
ASSI { 2318}
(( segid " " and resid 71 and name HA2 ))
( segid " " and resid 29 and name HD1%)
2.900 1.000 1.000 peak 2318 spectrum 1 weight 0.10000E+01 volume 0.32201E-02 ppm1 4.031 ppm2 0.818 CV 1
ASSI { 2319}
(( segid " " and resid 71 and name HA1 ))
( segid " " and resid 29 and name HD1%)
3.400 1.400 1.400 peak 2319 spectrum 1 weight 0.10000E+01 volume 0.39773E-02 ppm1 3.810 ppm2 0.818 CV 1
ASSI { 2323}
(( segid " " and resid 71 and name HA1 ))
(( segid " " and resid 29 and name HB1 ))
3.400 1.500 1.500 peak 2323 spectrum 1 weight 0.10000E+01 volume 0.64367E-03 ppm1 3.812 ppm2 1.468 CV 1
ASSI { 2324}
(( segid " " and resid 71 and name HA1 ))
(( segid " " and resid 74 and name HN ))
4.300 2.300 1.700 peak 2324 spectrum 1 weight 0.10000E+01 volume 0.78153E-03 ppm1 3.810 ppm2 8.667 CV 1
ASSI { 2325}
(( segid " " and resid 71 and name HA1 ))
(( segid " " and resid 29 and name HG ))
3.900 1.900 1.900 peak 2325 spectrum 1 weight 0.10000E+01 volume 0.55924E-03 ppm1 3.811 ppm2 1.769 CV 1
ASSI { 2328}
(( segid " " and resid 71 and name HA2 ))
(( segid " " and resid 74 and name HB ))
3.800 1.800 1.800 peak 2328 spectrum 1 weight 0.10000E+01 volume 0.14601E-02 ppm1 4.030 ppm2 4.195 CV 1
ASSI { 2330}
(( segid " " and resid 71 and name HA2 ))
(( segid " " and resid 74 and name HN ))
3.600 1.600 1.600 peak 2330 spectrum 1 weight 0.10000E+01 volume 0.64771E-03 ppm1 4.032 ppm2 8.669 CV 1
ASSI { 2335}
(( segid " " and resid 71 and name HA2 ))
(( segid " " and resid 29 and name HG ))
3.400 1.400 1.400 peak 2335 spectrum 1 weight 0.10000E+01 volume 0.54735E-03 ppm1 4.033 ppm2 1.767 CV 1
ASSI { 2345}
(( segid " " and resid 65 and name HD1 ))
(( segid " " and resid 65 and name HA ))
4.000 2.000 2.000 peak 2345 spectrum 1 weight 0.10000E+01 volume 0.70268E-03 ppm1 1.354 ppm2 4.033 CV 1
ASSI { 2347}
(( segid " " and resid 65 and name HD1 ))
(( segid " " and resid 65 and name HE2 ))
3.300 1.400 1.400 peak 2347 spectrum 1 weight 0.10000E+01 volume 0.10611E-02 ppm1 1.355 ppm2 3.022 CV 1
OR { 2347}
(( segid " " and resid 65 and name HD1 ))
(( segid " " and resid 65 and name HE1 ))
ASSI { 2349}
(( segid " " and resid 65 and name HD2 ))
(( segid " " and resid 65 and name HA ))
4.000 2.000 2.000 peak 2349 spectrum 1 weight 0.10000E+01 volume 0.69518E-03 ppm1 1.449 ppm2 4.034 CV 1
ASSI { 2350}
(( segid " " and resid 65 and name HD2 ))
(( segid " " and resid 65 and name HG2 ))
2.500 0.800 0.800 peak 2350 spectrum 1 weight 0.10000E+01 volume 0.64500E-02 ppm1 1.449 ppm2 1.682 CV 1
OR { 2350}
(( segid " " and resid 65 and name HD2 ))
(( segid " " and resid 65 and name HG1 ))
ASSI { 2351}
(( segid " " and resid 65 and name HD2 ))
(( segid " " and resid 65 and name HE1 ))
3.300 1.400 1.400 peak 2351 spectrum 1 weight 0.10000E+01 volume 0.10325E-02 ppm1 1.448 ppm2 3.022 CV 1
OR { 2351}
(( segid " " and resid 65 and name HD2 ))
(( segid " " and resid 65 and name HE2 ))
ASSI { 2353}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 8 and name HN ))
4.000 2.000 2.000 peak 2353 spectrum 1 weight 0.10000E+01 volume 0.16978E-02 ppm1 1.053 ppm2 8.400 CV 1
ASSI { 2354}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 9 and name HG1%)
2.100 0.500 0.500 peak 2354 spectrum 1 weight 0.10000E+01 volume 0.19638E-01 ppm1 1.055 ppm2 0.909 CV 1
ASSI { 2355}
( segid " " and resid 29 and name HD1%)
(( segid " " and resid 5 and name HE21))
3.700 1.700 1.700 peak 2355 spectrum 1 weight 0.10000E+01 volume 0.64046E-03 ppm1 0.820 ppm2 6.849 CV 1
ASSI { 2356}
( segid " " and resid 29 and name HD1%)
(( segid " " and resid 75 and name HD1 ))
2.900 2.900 3.100 peak 2356 spectrum 1 weight 0.10000E+01 volume 0.32973E-02 ppm1 0.819 ppm2 1.467 CV 1
ASSI { 2358}
( segid " " and resid 29 and name HD1%)
(( segid " " and resid 29 and name HG ))
2.500 0.800 0.800 peak 2358 spectrum 1 weight 0.10000E+01 volume 0.44950E-02 ppm1 0.819 ppm2 1.776 CV 1
ASSI { 2359}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 8 and name HD1%)
4.300 2.300 1.700 peak 2359 spectrum 1 weight 0.10000E+01 volume 0.14428E-02 ppm1 1.055 ppm2 0.587 CV 1
ASSI { 2360}
( segid " " and resid 29 and name HD1%)
(( segid " " and resid 29 and name HA ))
2.500 0.800 0.800 peak 2360 spectrum 1 weight 0.10000E+01 volume 0.54671E-02 ppm1 0.819 ppm2 3.580 CV 1
ASSI { 2362}
( segid " " and resid 29 and name HD1%)
( segid " " and resid 70 and name HG2%)
3.000 1.100 1.100 peak 2362 spectrum 1 weight 0.10000E+01 volume 0.35660E-02 ppm1 0.820 ppm2 0.644 CV 1
ASSI { 2364}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 6 and name HA ))
3.500 1.500 1.500 peak 2364 spectrum 1 weight 0.10000E+01 volume 0.20940E-02 ppm1 1.055 ppm2 3.957 CV 1
ASSI { 2366}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 9 and name HA ))
2.400 0.700 0.700 peak 2366 spectrum 1 weight 0.10000E+01 volume 0.66439E-02 ppm1 1.056 ppm2 3.389 CV 1
ASSI { 2367}
( segid " " and resid 29 and name HD1%)
(( segid " " and resid 74 and name HB ))
3.200 1.300 1.300 peak 2367 spectrum 1 weight 0.10000E+01 volume 0.15475E-02 ppm1 0.819 ppm2 4.195 CV 1
ASSI { 2374}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 5 and name HG2 ))
2.800 1.000 1.000 peak 2374 spectrum 1 weight 0.10000E+01 volume 0.19300E-02 ppm1 1.055 ppm2 2.240 CV 1
ASSI { 2376}
( segid " " and resid 29 and name HD1%)
(( segid " " and resid 71 and name HN ))
4.400 2.400 1.600 peak 2376 spectrum 1 weight 0.10000E+01 volume 0.11834E-02 ppm1 0.820 ppm2 9.376 CV 1
ASSI { 2377}
( segid " " and resid 29 and name HD1%)
(( segid " " and resid 5 and name HG2 ))
3.400 1.400 1.400 peak 2377 spectrum 1 weight 0.10000E+01 volume 0.88712E-03 ppm1 0.819 ppm2 2.255 CV 1
ASSI { 2378}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 74 and name HB ))
4.200 2.200 1.800 peak 2378 spectrum 1 weight 0.10000E+01 volume 0.65778E-03 ppm1 1.055 ppm2 4.196 CV 1
ASSI { 2379}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 59 and name HB ))
4.000 2.000 2.000 peak 2379 spectrum 1 weight 0.10000E+01 volume 0.15571E-02 ppm1 0.936 ppm2 1.668 CV 1
ASSI { 2380}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 59 and name HG2%)
4.700 2.800 1.300 peak 2380 spectrum 1 weight 0.10000E+01 volume 0.10078E-02 ppm1 0.939 ppm2 0.617 CV 1
ASSI { 2383}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 59 and name HD1%)
2.100 0.500 0.500 peak 2383 spectrum 1 weight 0.10000E+01 volume 0.93493E-02 ppm1 0.936 ppm2 0.239 CV 1
ASSI { 2384}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 64 and name HA ))
2.300 0.700 0.700 peak 2384 spectrum 1 weight 0.10000E+01 volume 0.59714E-02 ppm1 0.936 ppm2 3.083 CV 1
ASSI { 2388}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 60 and name HB2 ))
3.000 3.000 3.000 peak 2388 spectrum 1 weight 0.10000E+01 volume 0.60419E-03 ppm1 0.937 ppm2 2.412 CV 1
ASSI { 2389}
(( segid " " and resid 65 and name HD1 ))
(( segid " " and resid 65 and name HG1 ))
2.300 0.700 0.700 peak 2389 spectrum 1 weight 0.10000E+01 volume 0.82979E-02 ppm1 1.363 ppm2 1.678 CV 1
OR { 2389}
(( segid " " and resid 65 and name HD1 ))
(( segid " " and resid 65 and name HG2 ))
ASSI { 2390}
( segid " " and resid 64 and name HG2%)
( segid " " and resid 67 and name HD1%)
3.700 1.700 1.700 peak 2390 spectrum 1 weight 0.10000E+01 volume 0.16067E-02 ppm1 0.937 ppm2 0.439 CV 1
ASSI { 2392}
(( segid " " and resid 58 and name HD1 ))
(( segid " " and resid 58 and name HG1 ))
2.400 0.700 0.700 peak 2392 spectrum 1 weight 0.10000E+01 volume 0.81706E-02 ppm1 1.365 ppm2 1.661 CV 1
OR { 2392}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 58 and name HG2 ))
OR { 2392}
(( segid " " and resid 58 and name HD1 ))
(( segid " " and resid 58 and name HG2 ))
OR { 2392}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 58 and name HG1 ))
ASSI { 2395}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 28 and name HA ))
3.700 1.700 1.700 peak 2395 spectrum 1 weight 0.10000E+01 volume 0.32495E-02 ppm1 1.355 ppm2 4.664 CV 1
ASSI { 2396}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 42 and name HB2 ))
2.900 1.000 1.000 peak 2396 spectrum 1 weight 0.10000E+01 volume 0.25706E-02 ppm1 0.965 ppm2 1.868 CV 1
ASSI { 2397}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 58 and name HE2 ))
3.300 1.300 1.300 peak 2397 spectrum 1 weight 0.10000E+01 volume 0.12219E-02 ppm1 1.363 ppm2 2.963 CV 1
OR { 2397}
(( segid " " and resid 58 and name HD1 ))
(( segid " " and resid 58 and name HE1 ))
OR { 2397}
(( segid " " and resid 58 and name HD1 ))
(( segid " " and resid 58 and name HE2 ))
OR { 2397}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 58 and name HE1 ))
ASSI { 2399}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 42 and name HA ))
3.900 1.900 1.900 peak 2399 spectrum 1 weight 0.10000E+01 volume 0.13903E-02 ppm1 0.966 ppm2 4.287 CV 1
ASSI { 2402}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 28 and name HN ))
3.500 1.600 1.600 peak 2402 spectrum 1 weight 0.10000E+01 volume 0.16178E-02 ppm1 1.358 ppm2 6.315 CV 1
ASSI { 2404}
(( segid " " and resid 75 and name HD1 ))
(( segid " " and resid 75 and name HG1 ))
2.700 0.900 0.900 peak 2404 spectrum 1 weight 0.10000E+01 volume 0.58530E-02 ppm1 1.451 ppm2 1.676 CV 1
ASSI { 2406}
(( segid " " and resid 67 and name HG ))
(( segid " " and resid 66 and name HB2 ))
2.500 2.500 3.500 peak 2406 spectrum 1 weight 0.10000E+01 volume 0.20079E-02 ppm1 1.818 ppm2 3.081 CV 1
ASSI { 2409}
( segid " " and resid 67 and name HD1%)
( segid " " and resid 74 and name HG2%)
3.200 3.200 2.800 peak 2409 spectrum 1 weight 0.10000E+01 volume 0.32200E-02 ppm1 0.437 ppm2 1.091 CV 1
ASSI { 2410}
(( segid " " and resid 67 and name HG ))
( segid " " and resid 67 and name HD1%)
2.000 0.500 0.500 peak 2410 spectrum 1 weight 0.10000E+01 volume 0.86748E-02 ppm1 1.819 ppm2 0.437 CV 1
ASSI { 2412}
(( segid " " and resid 75 and name HD1 ))
(( segid " " and resid 75 and name HA ))
2.900 1.100 1.100 peak 2412 spectrum 1 weight 0.10000E+01 volume 0.13634E-02 ppm1 1.458 ppm2 3.943 CV 1
ASSI { 2413}
( segid " " and resid 67 and name HD1%)
(( segid " " and resid 64 and name HA ))
2.600 0.800 0.800 peak 2413 spectrum 1 weight 0.10000E+01 volume 0.46067E-02 ppm1 0.437 ppm2 3.084 CV 1
ASSI { 2415}
( segid " " and resid 67 and name HD1%)
(( segid " " and resid 67 and name HA ))
4.200 2.200 1.800 peak 2415 spectrum 1 weight 0.10000E+01 volume 0.11481E-02 ppm1 0.436 ppm2 4.509 CV 1
ASSI { 2416}
(( segid " " and resid 75 and name HD1 ))
(( segid " " and resid 75 and name HE1 ))
3.500 1.600 1.600 peak 2416 spectrum 1 weight 0.10000E+01 volume 0.59965E-03 ppm1 1.461 ppm2 3.054 CV 1
OR { 2416}
(( segid " " and resid 75 and name HD1 ))
(( segid " " and resid 75 and name HE2 ))
ASSI { 2417}
( segid " " and resid 67 and name HD1%)
(( segid " " and resid 67 and name HB2 ))
2.400 0.700 0.700 peak 2417 spectrum 1 weight 0.10000E+01 volume 0.34400E-02 ppm1 0.437 ppm2 2.144 CV 1
ASSI { 2418}
( segid " " and resid 67 and name HD1%)
(( segid " " and resid 67 and name HB1 ))
3.100 1.200 1.200 peak 2418 spectrum 1 weight 0.10000E+01 volume 0.41345E-02 ppm1 0.437 ppm2 0.932 CV 1
ASSI { 2419}
(( segid " " and resid 75 and name HD1 ))
(( segid " " and resid 75 and name HE1 ))
3.600 1.600 1.600 peak 2419 spectrum 1 weight 0.10000E+01 volume 0.59887E-03 ppm1 1.486 ppm2 3.037 CV 1
OR { 2419}
(( segid " " and resid 75 and name HD2 ))
(( segid " " and resid 75 and name HE1 ))
OR { 2419}
(( segid " " and resid 75 and name HD1 ))
(( segid " " and resid 75 and name HE2 ))
OR { 2419}
(( segid " " and resid 75 and name HD2 ))
(( segid " " and resid 75 and name HE2 ))
ASSI { 2421}
( segid " " and resid 67 and name HD1%)
( segid " " and resid 45 and name HG2%)
2.600 2.600 3.400 peak 2421 spectrum 1 weight 0.10000E+01 volume 0.14899E-02 ppm1 0.437 ppm2 1.137 CV 1
ASSI { 2424}
( segid " " and resid 67 and name HD1%)
( segid " " and resid 33 and name HE% )
3.000 1.100 1.100 peak 2424 spectrum 1 weight 0.10000E+01 volume 0.16315E-02 ppm1 0.436 ppm2 6.961 CV 1
ASSI { 2428}
( segid " " and resid 78 and name HD2%)
(( segid " " and resid 78 and name HA ))
2.200 0.600 0.600 peak 2428 spectrum 1 weight 0.10000E+01 volume 0.52663E-02 ppm1 0.828 ppm2 3.894 CV 1
OR { 2428}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 78 and name HA ))
ASSI { 2431}
( segid " " and resid 67 and name HD1%)
(( segid " " and resid 33 and name HZ ))
4.300 2.300 1.700 peak 2431 spectrum 1 weight 0.10000E+01 volume 0.59837E-03 ppm1 0.437 ppm2 6.808 CV 1
ASSI { 2433}
( segid " " and resid 78 and name HD2%)
( segid " " and resid 8 and name HG2%)
2.300 0.700 0.700 peak 2433 spectrum 1 weight 0.10000E+01 volume 0.52840E-02 ppm1 0.828 ppm2 0.513 CV 1
OR { 2433}
( segid " " and resid 78 and name HD1%)
( segid " " and resid 8 and name HG2%)
ASSI { 2435}
(( segid " " and resid 67 and name HG ))
(( segid " " and resid 65 and name HD1 ))
2.100 2.100 3.900 peak 2435 spectrum 1 weight 0.10000E+01 volume 0.50053E-02 ppm1 1.818 ppm2 1.373 CV 1
ASSI { 2436}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 31 and name HE2 ))
3.700 1.800 1.800 peak 2436 spectrum 1 weight 0.10000E+01 volume 0.90582E-03 ppm1 1.365 ppm2 3.034 CV 1
ASSI { 2437}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 75 and name HA ))
3.200 1.300 1.300 peak 2437 spectrum 1 weight 0.10000E+01 volume 0.10167E-02 ppm1 0.834 ppm2 3.941 CV 1
OR { 2437}
( segid " " and resid 78 and name HD2%)
(( segid " " and resid 75 and name HA ))
ASSI { 2443}
(( segid " " and resid 67 and name HG ))
(( segid " " and resid 72 and name HB1 ))
4.300 2.300 1.700 peak 2443 spectrum 1 weight 0.10000E+01 volume 0.91993E-03 ppm1 1.820 ppm2 2.960 CV 1
ASSI { 2444}
(( segid " " and resid 67 and name HG ))
(( segid " " and resid 69 and name HN ))
3.600 1.600 1.600 peak 2444 spectrum 1 weight 0.10000E+01 volume 0.20359E-02 ppm1 1.819 ppm2 8.746 CV 1
ASSI { 2445}
(( segid " " and resid 67 and name HG ))
( segid " " and resid 64 and name HG1%)
3.500 1.500 1.500 peak 2445 spectrum 1 weight 0.10000E+01 volume 0.11460E-02 ppm1 1.819 ppm2 0.770 CV 1
ASSI { 2447}
( segid " " and resid 78 and name HD2%)
(( segid " " and resid 78 and name HB1 ))
2.700 0.900 0.900 peak 2447 spectrum 1 weight 0.10000E+01 volume 0.25886E-02 ppm1 0.829 ppm2 1.664 CV 1
OR { 2447}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 78 and name HB1 ))
ASSI { 2451}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 31 and name HB1 ))
2.600 2.600 3.400 peak 2451 spectrum 1 weight 0.10000E+01 volume 0.31616E-02 ppm1 1.371 ppm2 1.814 CV 1
ASSI { 2454}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 5 and name HA ))
2.800 1.000 1.000 peak 2454 spectrum 1 weight 0.10000E+01 volume 0.22437E-02 ppm1 0.828 ppm2 3.699 CV 1
OR { 2454}
( segid " " and resid 78 and name HD2%)
(( segid " " and resid 5 and name HA ))
ASSI { 2456}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 5 and name HB1 ))
2.800 2.800 3.200 peak 2456 spectrum 1 weight 0.10000E+01 volume 0.87735E-03 ppm1 0.827 ppm2 2.060 CV 1
OR { 2456}
( segid " " and resid 78 and name HD2%)
(( segid " " and resid 5 and name HB1 ))
ASSI { 2457}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 5 and name HG1 ))
3.400 1.400 1.400 peak 2457 spectrum 1 weight 0.10000E+01 volume 0.13468E-02 ppm1 0.828 ppm2 2.152 CV 1
ASSI { 2458}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 5 and name HB2 ))
3.100 1.200 1.200 peak 2458 spectrum 1 weight 0.10000E+01 volume 0.16587E-02 ppm1 0.829 ppm2 2.212 CV 1
ASSI { 2462}
( segid " " and resid 29 and name HD2%)
( segid " " and resid 29 and name HD1%)
2.000 0.500 0.500 peak 2462 spectrum 1 weight 0.10000E+01 volume 0.25002E-01 ppm1 0.917 ppm2 0.819 CV 1
ASSI { 2463}
( segid " " and resid 29 and name HD2%)
(( segid " " and resid 5 and name HE21))
3.500 1.600 1.600 peak 2463 spectrum 1 weight 0.10000E+01 volume 0.17694E-02 ppm1 0.917 ppm2 6.849 CV 1
ASSI { 2464}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 75 and name HA ))
2.600 0.900 0.900 peak 2464 spectrum 1 weight 0.10000E+01 volume 0.28877E-02 ppm1 0.829 ppm2 3.942 CV 1
ASSI { 2465}
( segid " " and resid 29 and name HD2%)
(( segid " " and resid 75 and name HD1 ))
2.600 0.900 0.900 peak 2465 spectrum 1 weight 0.10000E+01 volume 0.37673E-02 ppm1 0.919 ppm2 1.464 CV 1
ASSI { 2466}
( segid " " and resid 29 and name HD2%)
(( segid " " and resid 71 and name HA1 ))
4.300 2.300 1.700 peak 2466 spectrum 1 weight 0.10000E+01 volume 0.71166E-03 ppm1 0.917 ppm2 3.807 CV 1
ASSI { 2469}
( segid " " and resid 78 and name HD1%)
( segid " " and resid 74 and name HG2%)
3.500 1.500 1.500 peak 2469 spectrum 1 weight 0.10000E+01 volume 0.22309E-02 ppm1 0.828 ppm2 1.102 CV 1
OR { 2469}
( segid " " and resid 78 and name HD2%)
( segid " " and resid 74 and name HG2%)
ASSI { 2472}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 27 and name HA ))
3.400 1.500 1.500 peak 2472 spectrum 1 weight 0.10000E+01 volume 0.10713E-02 ppm1 0.592 ppm2 3.552 CV 1
ASSI { 2474}
( segid " " and resid 37 and name HD1%)
( segid " " and resid 22 and name HG2%)
2.500 0.800 0.800 peak 2474 spectrum 1 weight 0.10000E+01 volume 0.34891E-02 ppm1 0.591 ppm2 1.008 CV 1
ASSI { 2475}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 33 and name HA ))
3.600 1.600 1.600 peak 2475 spectrum 1 weight 0.10000E+01 volume 0.34266E-02 ppm1 0.591 ppm2 4.097 CV 1
ASSI { 2476}
( segid " " and resid 37 and name HD1%)
( segid " " and resid 33 and name HE% )
3.900 1.900 1.900 peak 2476 spectrum 1 weight 0.10000E+01 volume 0.83285E-03 ppm1 0.592 ppm2 6.966 CV 1
ASSI { 2478}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 22 and name HG11))
2.200 0.600 0.600 peak 2478 spectrum 1 weight 0.10000E+01 volume 0.20682E-02 ppm1 0.591 ppm2 1.379 CV 1
ASSI { 2480}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HB2 ))
3.000 1.200 1.200 peak 2480 spectrum 1 weight 0.10000E+01 volume 0.34778E-02 ppm1 0.591 ppm2 2.304 CV 1
ASSI { 2481}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HA ))
3.000 1.100 1.100 peak 2481 spectrum 1 weight 0.10000E+01 volume 0.10714E-02 ppm1 0.591 ppm2 4.449 CV 1
ASSI { 2482}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HB1 ))
2.400 0.700 0.700 peak 2482 spectrum 1 weight 0.10000E+01 volume 0.32012E-02 ppm1 0.592 ppm2 1.699 CV 1
ASSI { 2483}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HG ))
2.000 0.500 0.500 peak 2483 spectrum 1 weight 0.10000E+01 volume 0.69296E-02 ppm1 0.591 ppm2 1.470 CV 1
ASSI { 2484}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 36 and name HB2 ))
4.500 2.600 1.500 peak 2484 spectrum 1 weight 0.10000E+01 volume 0.65511E-03 ppm1 0.593 ppm2 3.077 CV 1
ASSI { 2489}
(( segid " " and resid 37 and name HG ))
(( segid " " and resid 33 and name HA ))
3.300 1.300 1.300 peak 2489 spectrum 1 weight 0.10000E+01 volume 0.82658E-03 ppm1 1.473 ppm2 4.097 CV 1
ASSI { 2493}
(( segid " " and resid 59 and name HG12))
( segid " " and resid 64 and name HG2%)
3.200 1.200 1.200 peak 2493 spectrum 1 weight 0.10000E+01 volume 0.19612E-02 ppm1 1.513 ppm2 0.947 CV 1
ASSI { 2496}
(( segid " " and resid 59 and name HG11))
( segid " " and resid 76 and name HE% )
3.700 1.800 1.800 peak 2496 spectrum 1 weight 0.10000E+01 volume 0.16090E-02 ppm1 0.851 ppm2 6.581 CV 1
ASSI { 2500}
(( segid " " and resid 59 and name HG12))
(( segid " " and resid 59 and name HA ))
3.600 1.600 1.600 peak 2500 spectrum 1 weight 0.10000E+01 volume 0.11891E-02 ppm1 1.517 ppm2 4.490 CV 1
ASSI { 2502}
(( segid " " and resid 59 and name HG12))
( segid " " and resid 59 and name HD1%)
2.800 1.000 1.000 peak 2502 spectrum 1 weight 0.10000E+01 volume 0.19500E-02 ppm1 1.517 ppm2 0.238 CV 1
ASSI { 2504}
(( segid " " and resid 59 and name HG12))
(( segid " " and resid 59 and name HG11))
1.800 0.400 0.400 peak 2504 spectrum 1 weight 0.10000E+01 volume 0.82663E-02 ppm1 1.518 ppm2 0.848 CV 1
ASSI { 2505}
(( segid " " and resid 78 and name HG ))
(( segid " " and resid 78 and name HB2 ))
2.600 0.800 0.800 peak 2505 spectrum 1 weight 0.10000E+01 volume 0.25946E-02 ppm1 1.633 ppm2 1.778 CV 1
ASSI { 2506}
(( segid " " and resid 59 and name HG12))
( segid " " and resid 76 and name HE% )
4.500 2.500 1.500 peak 2506 spectrum 1 weight 0.10000E+01 volume 0.12006E-02 ppm1 1.519 ppm2 6.581 CV 1
ASSI { 2507}
(( segid " " and resid 59 and name HG12))
( segid " " and resid 76 and name HD% )
4.800 2.800 1.200 peak 2507 spectrum 1 weight 0.10000E+01 volume 0.63089E-03 ppm1 1.519 ppm2 6.807 CV 1
ASSI { 2509}
(( segid " " and resid 78 and name HG ))
(( segid " " and resid 78 and name HA ))
3.200 1.300 1.300 peak 2509 spectrum 1 weight 0.10000E+01 volume 0.90084E-03 ppm1 1.633 ppm2 3.895 CV 1
ASSI { 2510}
(( segid " " and resid 78 and name HG ))
(( segid " " and resid 78 and name HN ))
2.700 0.900 0.900 peak 2510 spectrum 1 weight 0.10000E+01 volume 0.20779E-02 ppm1 1.636 ppm2 8.533 CV 1
ASSI { 2511}
(( segid " " and resid 78 and name HG ))
( segid " " and resid 78 and name HD1%)
2.600 0.900 0.900 peak 2511 spectrum 1 weight 0.10000E+01 volume 0.26593E-02 ppm1 1.637 ppm2 0.825 CV 1
ASSI { 2513}
(( segid " " and resid 59 and name HG11))
( segid " " and resid 76 and name HD% )
4.500 2.600 1.500 peak 2513 spectrum 1 weight 0.10000E+01 volume 0.75044E-03 ppm1 0.850 ppm2 6.807 CV 1
ASSI { 2516}
(( segid " " and resid 54 and name HG1 ))
(( segid " " and resid 54 and name HA ))
3.700 1.700 1.700 peak 2516 spectrum 1 weight 0.10000E+01 volume 0.15213E-02 ppm1 0.702 ppm2 3.941 CV 1
ASSI { 2521}
(( segid " " and resid 54 and name HG2 ))
( segid " " and resid 55 and name HE% )
4.100 2.100 1.900 peak 2521 spectrum 1 weight 0.10000E+01 volume 0.68748E-03 ppm1 0.865 ppm2 7.151 CV 1
ASSI { 2522}
(( segid " " and resid 54 and name HG1 ))
(( segid " " and resid 54 and name HB1 ))
3.100 1.200 1.200 peak 2522 spectrum 1 weight 0.10000E+01 volume 0.30117E-02 ppm1 0.703 ppm2 1.092 CV 1
ASSI { 2523}
(( segid " " and resid 54 and name HG1 ))
(( segid " " and resid 54 and name HG2 ))
1.700 0.300 0.500 peak 2523 spectrum 1 weight 0.10000E+01 volume 0.10593E-01 ppm1 0.703 ppm2 0.871 CV 1
ASSI { 2525}
(( segid " " and resid 12 and name HG ))
(( segid " " and resid 12 and name HA ))
4.000 2.000 2.000 peak 2525 spectrum 1 weight 0.10000E+01 volume 0.87044E-03 ppm1 1.985 ppm2 4.259 CV 1
ASSI { 2533}
(( segid " " and resid 54 and name HG1 ))
( segid " " and resid 55 and name HE% )
3.600 1.600 1.600 peak 2533 spectrum 1 weight 0.10000E+01 volume 0.71077E-03 ppm1 0.702 ppm2 7.159 CV 1
ASSI { 2541}
(( segid " " and resid 29 and name HG ))
(( segid " " and resid 29 and name HB1 ))
2.700 0.900 0.900 peak 2541 spectrum 1 weight 0.10000E+01 volume 0.24494E-02 ppm1 1.789 ppm2 1.477 CV 1
ASSI { 2543}
(( segid " " and resid 29 and name HG ))
( segid " " and resid 9 and name HG2%)
3.700 1.800 1.800 peak 2543 spectrum 1 weight 0.10000E+01 volume 0.10657E-02 ppm1 1.788 ppm2 1.056 CV 1
ASSI { 2546}
(( segid " " and resid 12 and name HG ))
( segid " " and resid 12 and name HD2%)
2.200 0.600 0.600 peak 2546 spectrum 1 weight 0.10000E+01 volume 0.80132E-02 ppm1 1.983 ppm2 0.850 CV 1
ASSI { 2549}
( segid " " and resid 12 and name HD2%)
(( segid " " and resid 12 and name HN ))
3.900 1.900 1.900 peak 2549 spectrum 1 weight 0.10000E+01 volume 0.16457E-02 ppm1 0.850 ppm2 9.278 CV 1
ASSI { 2550}
( segid " " and resid 12 and name HD2%)
(( segid " " and resid 33 and name HZ ))
4.100 2.100 1.900 peak 2550 spectrum 1 weight 0.10000E+01 volume 0.81646E-03 ppm1 0.846 ppm2 6.800 CV 1
ASSI { 2552}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 73 and name HB% )
2.800 1.000 1.000 peak 2552 spectrum 1 weight 0.10000E+01 volume 0.28507E-02 ppm1 0.846 ppm2 1.539 CV 1
ASSI { 2553}
(( segid " " and resid 23 and name HD2 ))
(( segid " " and resid 23 and name HG2 ))
2.400 0.700 0.700 peak 2553 spectrum 1 weight 0.10000E+01 volume 0.35795E-02 ppm1 4.038 ppm2 2.135 CV 1
ASSI { 2556}
(( segid " " and resid 23 and name HD1 ))
(( segid " " and resid 23 and name HG2 ))
2.800 1.000 1.000 peak 2556 spectrum 1 weight 0.10000E+01 volume 0.39503E-02 ppm1 3.709 ppm2 2.136 CV 1
ASSI { 2557}
(( segid " " and resid 23 and name HD2 ))
(( segid " " and resid 23 and name HG1 ))
3.100 1.200 1.200 peak 2557 spectrum 1 weight 0.10000E+01 volume 0.30543E-02 ppm1 4.038 ppm2 1.964 CV 1
ASSI { 2558}
(( segid " " and resid 23 and name HD2 ))
(( segid " " and resid 23 and name HB1 ))
4.100 2.100 1.900 peak 2558 spectrum 1 weight 0.10000E+01 volume 0.12501E-02 ppm1 4.039 ppm2 1.765 CV 1
ASSI { 2559}
(( segid " " and resid 23 and name HD1 ))
(( segid " " and resid 23 and name HD2 ))
1.600 0.300 0.600 peak 2559 spectrum 1 weight 0.10000E+01 volume 0.14123E-01 ppm1 3.709 ppm2 4.035 CV 1
ASSI { 2562}
(( segid " " and resid 42 and name HG ))
(( segid " " and resid 42 and name HN ))
3.900 1.900 1.900 peak 2562 spectrum 1 weight 0.10000E+01 volume 0.20642E-02 ppm1 1.695 ppm2 7.886 CV 1
ASSI { 2563}
(( segid " " and resid 23 and name HD2 ))
(( segid " " and resid 23 and name HA ))
2.600 2.600 3.400 peak 2563 spectrum 1 weight 0.10000E+01 volume 0.95822E-02 ppm1 4.038 ppm2 4.343 CV 1
ASSI { 2565}
(( segid " " and resid 23 and name HD1 ))
( segid " " and resid 22 and name HG2%)
3.200 1.300 1.300 peak 2565 spectrum 1 weight 0.10000E+01 volume 0.55416E-02 ppm1 3.708 ppm2 1.012 CV 1
ASSI { 2567}
(( segid " " and resid 42 and name HG ))
(( segid " " and resid 42 and name HB2 ))
2.800 1.000 1.000 peak 2567 spectrum 1 weight 0.10000E+01 volume 0.47229E-02 ppm1 1.696 ppm2 1.870 CV 1
ASSI { 2569}
(( segid " " and resid 23 and name HD2 ))
(( segid " " and resid 23 and name HB2 ))
3.300 1.300 1.300 peak 2569 spectrum 1 weight 0.10000E+01 volume 0.10480E-02 ppm1 4.038 ppm2 2.370 CV 1
ASSI { 2570}
(( segid " " and resid 23 and name HD2 ))
( segid " " and resid 22 and name HG2%)
2.700 0.900 0.900 peak 2570 spectrum 1 weight 0.10000E+01 volume 0.32591E-02 ppm1 4.036 ppm2 1.008 CV 1
ASSI { 2571}
(( segid " " and resid 42 and name HG ))
(( segid " " and resid 42 and name HA ))
3.600 1.600 1.600 peak 2571 spectrum 1 weight 0.10000E+01 volume 0.13169E-02 ppm1 1.697 ppm2 4.287 CV 1
ASSI { 2574}
(( segid " " and resid 60 and name HD2 ))
(( segid " " and resid 60 and name HB1 ))
3.600 1.600 1.600 peak 2574 spectrum 1 weight 0.10000E+01 volume 0.30486E-02 ppm1 3.858 ppm2 1.917 CV 1
ASSI { 2575}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 8 and name HD1%)
2.600 0.900 0.900 peak 2575 spectrum 1 weight 0.10000E+01 volume 0.35305E-02 ppm1 0.851 ppm2 0.589 CV 1
ASSI { 2579}
( segid " " and resid 12 and name HD2%)
(( segid " " and resid 74 and name HA ))
3.500 1.600 1.600 peak 2579 spectrum 1 weight 0.10000E+01 volume 0.10240E-02 ppm1 0.852 ppm2 3.678 CV 1
ASSI { 2581}
( segid " " and resid 12 and name HD2%)
(( segid " " and resid 9 and name HA ))
4.000 2.000 2.000 peak 2581 spectrum 1 weight 0.10000E+01 volume 0.13108E-02 ppm1 0.850 ppm2 3.392 CV 1
ASSI { 2583}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 60 and name HB2 ))
3.800 1.800 1.800 peak 2583 spectrum 1 weight 0.10000E+01 volume 0.17291E-02 ppm1 3.749 ppm2 2.404 CV 1
ASSI { 2585}
(( segid " " and resid 60 and name HD1 ))
( segid " " and resid 76 and name HE% )
4.500 2.500 1.500 peak 2585 spectrum 1 weight 0.10000E+01 volume 0.68314E-03 ppm1 3.748 ppm2 6.580 CV 1
ASSI { 2586}
(( segid " " and resid 60 and name HD2 ))
(( segid " " and resid 60 and name HB2 ))
2.900 1.100 1.100 peak 2586 spectrum 1 weight 0.10000E+01 volume 0.21014E-02 ppm1 3.858 ppm2 2.407 CV 1
ASSI { 2587}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 59 and name HA ))
2.200 0.600 0.600 peak 2587 spectrum 1 weight 0.10000E+01 volume 0.55303E-02 ppm1 3.748 ppm2 4.490 CV 1
ASSI { 2588}
(( segid " " and resid 60 and name HD1 ))
( segid " " and resid 59 and name HD1%)
4.500 2.500 1.500 peak 2588 spectrum 1 weight 0.10000E+01 volume 0.15659E-02 ppm1 3.748 ppm2 0.238 CV 1
ASSI { 2589}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 60 and name HB1 ))
3.600 1.600 1.600 peak 2589 spectrum 1 weight 0.10000E+01 volume 0.32706E-02 ppm1 3.746 ppm2 1.916 CV 1
ASSI { 2590}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 60 and name HD2 ))
1.700 0.400 0.500 peak 2590 spectrum 1 weight 0.10000E+01 volume 0.12547E-01 ppm1 3.749 ppm2 3.856 CV 1
ASSI { 2593}
(( segid " " and resid 60 and name HD2 ))
(( segid " " and resid 59 and name HA ))
2.600 0.900 0.900 peak 2593 spectrum 1 weight 0.10000E+01 volume 0.51770E-02 ppm1 3.858 ppm2 4.489 CV 1
ASSI { 2594}
(( segid " " and resid 60 and name HD2 ))
( segid " " and resid 76 and name HE% )
3.400 1.400 1.400 peak 2594 spectrum 1 weight 0.10000E+01 volume 0.75148E-03 ppm1 3.858 ppm2 6.580 CV 1
ASSI { 2595}
(( segid " " and resid 60 and name HD2 ))
( segid " " and resid 59 and name HD1%)
3.600 1.600 1.600 peak 2595 spectrum 1 weight 0.10000E+01 volume 0.17500E-02 ppm1 3.859 ppm2 0.238 CV 1
ASSI { 2597}
(( segid " " and resid 22 and name HG12))
(( segid " " and resid 22 and name HG11))
1.500 0.300 0.700 peak 2597 spectrum 1 weight 0.10000E+01 volume 0.13119E-01 ppm1 1.308 ppm2 1.377 CV 1
ASSI { 2601}
(( segid " " and resid 22 and name HG11))
(( segid " " and resid 22 and name HN ))
3.200 1.300 1.300 peak 2601 spectrum 1 weight 0.10000E+01 volume 0.29467E-02 ppm1 1.380 ppm2 6.418 CV 1
ASSI { 2606}
(( segid " " and resid 22 and name HG11))
( segid " " and resid 27 and name HG2%)
4.000 2.000 2.000 peak 2606 spectrum 1 weight 0.10000E+01 volume 0.11798E-02 ppm1 1.377 ppm2 0.946 CV 1
ASSI { 2607}
(( segid " " and resid 22 and name HG11))
( segid " " and resid 20 and name HB% )
4.000 2.000 2.000 peak 2607 spectrum 1 weight 0.10000E+01 volume 0.19828E-02 ppm1 1.378 ppm2 1.547 CV 1
ASSI { 2608}
(( segid " " and resid 22 and name HG11))
( segid " " and resid 22 and name HG2%)
2.300 0.700 0.700 peak 2608 spectrum 1 weight 0.10000E+01 volume 0.39411E-02 ppm1 1.379 ppm2 1.010 CV 1
ASSI { 2609}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 3 and name HB% )
2.300 0.700 0.700 peak 2609 spectrum 1 weight 0.10000E+01 volume 0.80852E-02 ppm1 4.855 ppm2 1.572 CV 1
ASSI { 2611}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 20 and name HB% )
3.300 1.400 1.400 peak 2611 spectrum 1 weight 0.10000E+01 volume 0.19508E-02 ppm1 1.309 ppm2 1.548 CV 1
ASSI { 2613}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 22 and name HG2%)
3.100 1.200 1.200 peak 2613 spectrum 1 weight 0.10000E+01 volume 0.44173E-02 ppm1 1.310 ppm2 1.011 CV 1
ASSI { 2616}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 37 and name HD2%)
4.300 2.300 1.700 peak 2616 spectrum 1 weight 0.10000E+01 volume 0.12070E-02 ppm1 1.311 ppm2 0.764 CV 1
ASSI { 2620}
(( segid " " and resid 2 and name HA ))
( segid " " and resid 3 and name HB% )
3.900 1.900 1.900 peak 2620 spectrum 1 weight 0.10000E+01 volume 0.13544E-02 ppm1 4.040 ppm2 1.572 CV 1
ASSI { 2623}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 3 and name HN ))
2.200 0.600 0.600 peak 2623 spectrum 1 weight 0.10000E+01 volume 0.13195E-01 ppm1 4.041 ppm2 8.858 CV 1
ASSI { 2627}
(( segid " " and resid 31 and name HG1 ))
(( segid " " and resid 22 and name HG11))
2.700 0.900 0.900 peak 2627 spectrum 1 weight 0.10000E+01 volume 0.27288E-02 ppm1 1.482 ppm2 1.375 CV 1
ASSI { 2628}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 22 and name HG11))
3.400 1.500 1.500 peak 2628 spectrum 1 weight 0.10000E+01 volume 0.27218E-02 ppm1 1.581 ppm2 1.374 CV 1
ASSI { 2629}
(( segid " " and resid 31 and name HG1 ))
(( segid " " and resid 31 and name HE2 ))
3.300 1.400 1.400 peak 2629 spectrum 1 weight 0.10000E+01 volume 0.13427E-02 ppm1 1.481 ppm2 3.029 CV 1
ASSI { 2630}
(( segid " " and resid 31 and name HG1 ))
(( segid " " and resid 31 and name HG2 ))
1.600 0.300 0.600 peak 2630 spectrum 1 weight 0.10000E+01 volume 0.72202E-02 ppm1 1.483 ppm2 1.581 CV 1
ASSI { 2631}
(( segid " " and resid 31 and name HG1 ))
(( segid " " and resid 28 and name HB2 ))
4.200 2.300 1.800 peak 2631 spectrum 1 weight 0.10000E+01 volume 0.86072E-03 ppm1 1.480 ppm2 2.073 CV 1
ASSI { 2632}
(( segid " " and resid 31 and name HG1 ))
(( segid " " and resid 31 and name HE1 ))
2.500 0.800 0.800 peak 2632 spectrum 1 weight 0.10000E+01 volume 0.11580E-02 ppm1 1.481 ppm2 2.959 CV 1
ASSI { 2636}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HB1 ))
2.500 0.800 0.800 peak 2636 spectrum 1 weight 0.10000E+01 volume 0.28678E-02 ppm1 1.585 ppm2 1.815 CV 1
ASSI { 2641}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 28 and name HB2 ))
3.700 1.700 1.700 peak 2641 spectrum 1 weight 0.10000E+01 volume 0.89724E-03 ppm1 1.582 ppm2 2.077 CV 1
ASSI { 2642}
(( segid " " and resid 31 and name HG1 ))
(( segid " " and resid 31 and name HB1 ))
2.800 1.000 1.000 peak 2642 spectrum 1 weight 0.10000E+01 volume 0.24210E-02 ppm1 1.485 ppm2 1.808 CV 1
ASSI { 2650}
(( segid " " and resid 8 and name HG12))
( segid " " and resid 8 and name HD1%)
2.800 1.000 1.000 peak 2650 spectrum 1 weight 0.10000E+01 volume 0.17501E-02 ppm1 1.520 ppm2 0.587 CV 1
ASSI { 2651}
(( segid " " and resid 8 and name HG12))
(( segid " " and resid 8 and name HA ))
2.700 0.900 0.900 peak 2651 spectrum 1 weight 0.10000E+01 volume 0.17792E-02 ppm1 1.521 ppm2 3.867 CV 1
ASSI { 2654}
(( segid " " and resid 8 and name HG12))
(( segid " " and resid 8 and name HG11))
1.800 0.400 0.400 peak 2654 spectrum 1 weight 0.10000E+01 volume 0.62738E-02 ppm1 1.520 ppm2 0.087 CV 1
ASSI { 2656}
(( segid " " and resid 8 and name HG12))
( segid " " and resid 8 and name HG2%)
3.200 1.300 1.300 peak 2656 spectrum 1 weight 0.10000E+01 volume 0.35785E-02 ppm1 1.520 ppm2 0.512 CV 1
ASSI { 2659}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB2 ))
2.700 0.900 0.900 peak 2659 spectrum 1 weight 0.10000E+01 volume 0.42798E-02 ppm1 4.878 ppm2 3.076 CV 1
ASSI { 2661}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HN ))
3.100 1.200 1.200 peak 2661 spectrum 1 weight 0.10000E+01 volume 0.16831E-02 ppm1 4.880 ppm2 7.758 CV 1
ASSI { 2665}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 44 and name HG1 ))
4.100 2.100 1.900 peak 2665 spectrum 1 weight 0.10000E+01 volume 0.12097E-02 ppm1 4.642 ppm2 2.181 CV 1
ASSI { 2672}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HB1 ))
2.500 0.800 0.800 peak 2672 spectrum 1 weight 0.10000E+01 volume 0.53803E-02 ppm1 4.630 ppm2 2.797 CV 1
ASSI { 2674}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HA ))
4.000 2.000 2.000 peak 2674 spectrum 1 weight 0.10000E+01 volume 0.10778E-02 ppm1 4.630 ppm2 4.007 CV 1
ASSI { 2679}
(( segid " " and resid 15 and name HG11))
( segid " " and resid 15 and name HD1%)
2.300 0.700 0.700 peak 2679 spectrum 1 weight 0.10000E+01 volume 0.63937E-02 ppm1 1.063 ppm2 0.765 CV 1
ASSI { 2680}
(( segid " " and resid 15 and name HG11))
(( segid " " and resid 15 and name HA ))
2.800 1.000 1.000 peak 2680 spectrum 1 weight 0.10000E+01 volume 0.27322E-02 ppm1 1.063 ppm2 3.797 CV 1
ASSI { 2682}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HN ))
2.600 0.900 0.900 peak 2682 spectrum 1 weight 0.10000E+01 volume 0.32735E-02 ppm1 4.630 ppm2 8.126 CV 1
ASSI { 2683}
(( segid " " and resid 15 and name HG11))
(( segid " " and resid 15 and name HG12))
1.900 0.400 0.400 peak 2683 spectrum 1 weight 0.10000E+01 volume 0.73628E-02 ppm1 1.062 ppm2 1.981 CV 1
ASSI { 2687}
(( segid " " and resid 15 and name HG11))
( segid " " and resid 50 and name HB% )
3.900 1.900 1.900 peak 2687 spectrum 1 weight 0.10000E+01 volume 0.17180E-02 ppm1 1.060 ppm2 1.562 CV 1
ASSI { 2690}
(( segid " " and resid 15 and name HG11))
(( segid " " and resid 15 and name HN ))
3.700 1.700 1.700 peak 2690 spectrum 1 weight 0.10000E+01 volume 0.13188E-02 ppm1 1.062 ppm2 8.192 CV 1
ASSI { 2691}
(( segid " " and resid 19 and name HG12))
(( segid " " and resid 19 and name HG11))
1.500 0.300 0.700 peak 2691 spectrum 1 weight 0.10000E+01 volume 0.13074E-01 ppm1 1.643 ppm2 1.346 CV 1
ASSI { 2695}
(( segid " " and resid 19 and name HG12))
(( segid " " and resid 46 and name HB1 ))
3.900 1.900 1.900 peak 2695 spectrum 1 weight 0.10000E+01 volume 0.84089E-03 ppm1 1.639 ppm2 2.166 CV 1
ASSI { 2696}
(( segid " " and resid 19 and name HG11))
( segid " " and resid 47 and name HG2%)
3.200 1.300 1.300 peak 2696 spectrum 1 weight 0.10000E+01 volume 0.33962E-02 ppm1 1.348 ppm2 0.969 CV 1
ASSI { 2697}
(( segid " " and resid 19 and name HG12))
( segid " " and resid 15 and name HG2%)
4.400 2.400 1.600 peak 2697 spectrum 1 weight 0.10000E+01 volume 0.77511E-03 ppm1 1.638 ppm2 1.090 CV 1
ASSI { 2698}
(( segid " " and resid 19 and name HG11))
( segid " " and resid 15 and name HG2%)
3.500 1.500 1.500 peak 2698 spectrum 1 weight 0.10000E+01 volume 0.87725E-03 ppm1 1.348 ppm2 1.092 CV 1
ASSI { 2700}
(( segid " " and resid 19 and name HG12))
(( segid " " and resid 47 and name HA ))
3.700 1.800 1.800 peak 2700 spectrum 1 weight 0.10000E+01 volume 0.26932E-02 ppm1 1.640 ppm2 3.954 CV 1
ASSI { 2702}
(( segid " " and resid 19 and name HG12))
( segid " " and resid 19 and name HD1%)
2.300 0.700 0.700 peak 2702 spectrum 1 weight 0.10000E+01 volume 0.38487E-02 ppm1 1.640 ppm2 0.797 CV 1
ASSI { 2703}
(( segid " " and resid 19 and name HG11))
(( segid " " and resid 47 and name HA ))
3.900 1.900 1.900 peak 2703 spectrum 1 weight 0.10000E+01 volume 0.27690E-02 ppm1 1.348 ppm2 3.955 CV 1
ASSI { 2704}
(( segid " " and resid 19 and name HG12))
(( segid " " and resid 47 and name HN ))
3.100 1.200 1.200 peak 2704 spectrum 1 weight 0.10000E+01 volume 0.23336E-02 ppm1 1.638 ppm2 8.191 CV 1
ASSI { 2705}
(( segid " " and resid 19 and name HG12))
( segid " " and resid 47 and name HG2%)
2.400 0.700 0.700 peak 2705 spectrum 1 weight 0.10000E+01 volume 0.30244E-02 ppm1 1.640 ppm2 0.969 CV 1
ASSI { 2706}
(( segid " " and resid 19 and name HG11))
(( segid " " and resid 46 and name HB1 ))
5.000 3.100 1.000 peak 2706 spectrum 1 weight 0.10000E+01 volume 0.67169E-03 ppm1 1.348 ppm2 2.166 CV 1
ASSI { 2708}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 72 and name HB1 ))
3.200 1.300 1.300 peak 2708 spectrum 1 weight 0.10000E+01 volume 0.22575E-02 ppm1 4.512 ppm2 2.965 CV 1
ASSI { 2712}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 72 and name HB2 ))
3.600 1.700 1.700 peak 2712 spectrum 1 weight 0.10000E+01 volume 0.15360E-02 ppm1 4.512 ppm2 3.189 CV 1
ASSI { 2714}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HG ))
3.600 1.700 1.700 peak 2714 spectrum 1 weight 0.10000E+01 volume 0.12906E-02 ppm1 4.510 ppm2 1.812 CV 1
ASSI { 2715}
(( segid " " and resid 66 and name HA ))
( segid " " and resid 67 and name HD2%)
4.500 2.600 1.500 peak 2715 spectrum 1 weight 0.10000E+01 volume 0.87671E-03 ppm1 4.871 ppm2 0.548 CV 1
ASSI { 2718}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 69 and name HN ))
3.800 1.800 1.800 peak 2718 spectrum 1 weight 0.10000E+01 volume 0.98324E-03 ppm1 4.514 ppm2 8.744 CV 1
ASSI { 2723}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB1 ))
2.900 1.000 1.000 peak 2723 spectrum 1 weight 0.10000E+01 volume 0.17072E-02 ppm1 4.660 ppm2 1.541 CV 1
ASSI { 2726}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HN ))
2.700 0.900 0.900 peak 2726 spectrum 1 weight 0.10000E+01 volume 0.41805E-02 ppm1 4.496 ppm2 8.353 CV 1
ASSI { 2727}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 29 and name HD2%)
4.200 2.200 1.800 peak 2727 spectrum 1 weight 0.10000E+01 volume 0.94332E-03 ppm1 4.659 ppm2 0.911 CV 1
ASSI { 2728}
(( segid " " and resid 30 and name HA ))
( segid " " and resid 29 and name HD1%)
3.800 3.800 2.200 peak 2728 spectrum 1 weight 0.10000E+01 volume 0.18576E-02 ppm1 4.496 ppm2 0.834 CV 1
ASSI { 2729}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB1 ))
2.600 0.800 0.800 peak 2729 spectrum 1 weight 0.10000E+01 volume 0.63918E-02 ppm1 4.497 ppm2 2.612 CV 1
ASSI { 2730}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
2.700 0.900 0.900 peak 2730 spectrum 1 weight 0.10000E+01 volume 0.67687E-02 ppm1 4.497 ppm2 2.797 CV 1
ASSI { 2733}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HN ))
2.800 1.000 1.000 peak 2733 spectrum 1 weight 0.10000E+01 volume 0.29660E-02 ppm1 4.208 ppm2 8.318 CV 1
ASSI { 2734}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB1 ))
3.200 1.300 1.300 peak 2734 spectrum 1 weight 0.10000E+01 volume 0.11273E-02 ppm1 4.387 ppm2 1.814 CV 1
ASSI { 2737}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HN ))
2.200 0.600 0.600 peak 2737 spectrum 1 weight 0.10000E+01 volume 0.82036E-02 ppm1 4.385 ppm2 10.104 CV 1
ASSI { 2738}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HG2 ))
3.000 1.100 1.100 peak 2738 spectrum 1 weight 0.10000E+01 volume 0.29986E-02 ppm1 4.386 ppm2 1.583 CV 1
ASSI { 2740}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 22 and name HG11))
2.600 0.900 0.900 peak 2740 spectrum 1 weight 0.10000E+01 volume 0.91377E-03 ppm1 4.446 ppm2 1.383 CV 1
ASSI { 2741}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HG1 ))
3.500 1.500 1.500 peak 2741 spectrum 1 weight 0.10000E+01 volume 0.16359E-02 ppm1 4.385 ppm2 1.482 CV 1
ASSI { 2743}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 28 and name HB2 ))
3.900 1.900 1.900 peak 2743 spectrum 1 weight 0.10000E+01 volume 0.11878E-02 ppm1 4.387 ppm2 2.075 CV 1
ASSI { 2747}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB1 ))
2.400 0.700 0.700 peak 2747 spectrum 1 weight 0.10000E+01 volume 0.23120E-02 ppm1 4.451 ppm2 1.699 CV 1
ASSI { 2755}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HG ))
3.700 1.700 1.700 peak 2755 spectrum 1 weight 0.10000E+01 volume 0.11413E-02 ppm1 4.449 ppm2 1.468 CV 1
ASSI { 2759}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB1 ))
2.700 0.900 0.900 peak 2759 spectrum 1 weight 0.10000E+01 volume 0.31767E-02 ppm1 4.634 ppm2 2.641 CV 1
ASSI { 2760}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 28 and name HE1 ))
3.800 1.800 1.800 peak 2760 spectrum 1 weight 0.10000E+01 volume 0.12278E-02 ppm1 4.635 ppm2 3.067 CV 1
OR { 2760}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 28 and name HE2 ))
ASSI { 2761}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB2 ))
3.000 1.100 1.100 peak 2761 spectrum 1 weight 0.10000E+01 volume 0.28898E-02 ppm1 4.631 ppm2 2.690 CV 1
ASSI { 2762}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 22 and name HD1%)
4.200 2.200 1.800 peak 2762 spectrum 1 weight 0.10000E+01 volume 0.15929E-02 ppm1 4.635 ppm2 0.833 CV 1
ASSI { 2765}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB1 ))
2.700 0.900 0.900 peak 2765 spectrum 1 weight 0.10000E+01 volume 0.34498E-02 ppm1 4.532 ppm2 2.605 CV 1
ASSI { 2768}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 53 and name HG1 ))
3.100 3.100 2.900 peak 2768 spectrum 1 weight 0.10000E+01 volume 0.15788E-02 ppm1 4.237 ppm2 2.322 CV 1
ASSI { 2775}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB2 ))
3.200 1.300 1.300 peak 2775 spectrum 1 weight 0.10000E+01 volume 0.27051E-02 ppm1 4.531 ppm2 3.264 CV 1
ASSI { 2795}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 15 and name HG2%)
3.400 3.400 2.600 peak 2795 spectrum 1 weight 0.10000E+01 volume 0.48995E-02 ppm1 4.237 ppm2 1.094 CV 1
ASSI { 2801}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 55 and name HE% )
3.800 1.800 1.800 peak 2801 spectrum 1 weight 0.10000E+01 volume 0.74354E-03 ppm1 3.980 ppm2 7.132 CV 1
ASSI { 2807}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 13 and name HN ))
3.300 1.300 1.300 peak 2807 spectrum 1 weight 0.10000E+01 volume 0.14068E-02 ppm1 4.237 ppm2 8.992 CV 1
ASSI { 2810}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 67 and name HD1%)
3.600 1.700 1.700 peak 2810 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 4.130 ppm2 0.437 CV 1
ASSI { 2816}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 54 and name HG2 ))
2.700 0.900 0.900 peak 2816 spectrum 1 weight 0.10000E+01 volume 0.12816E-02 ppm1 3.978 ppm2 0.869 CV 1
ASSI { 2817}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 54 and name HB1 ))
3.400 1.400 1.400 peak 2817 spectrum 1 weight 0.10000E+01 volume 0.24178E-02 ppm1 3.980 ppm2 1.091 CV 1
ASSI { 2822}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB2 ))
2.900 1.000 1.000 peak 2822 spectrum 1 weight 0.10000E+01 volume 0.38390E-02 ppm1 4.342 ppm2 3.151 CV 1
ASSI { 2829}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB1 ))
2.900 1.000 1.000 peak 2829 spectrum 1 weight 0.10000E+01 volume 0.31670E-02 ppm1 4.342 ppm2 2.585 CV 1
ASSI { 2830}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HN ))
2.500 0.800 0.800 peak 2830 spectrum 1 weight 0.10000E+01 volume 0.40749E-02 ppm1 3.979 ppm2 8.910 CV 1
ASSI { 2833}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 73 and name HB% )
2.300 0.700 0.700 peak 2833 spectrum 1 weight 0.10000E+01 volume 0.48436E-02 ppm1 4.131 ppm2 1.538 CV 1
ASSI { 2836}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HN ))
2.700 0.900 0.900 peak 2836 spectrum 1 weight 0.10000E+01 volume 0.36167E-02 ppm1 4.341 ppm2 8.343 CV 1
ASSI { 2837}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 54 and name HB2 ))
4.400 2.400 1.600 peak 2837 spectrum 1 weight 0.10000E+01 volume 0.14677E-02 ppm1 3.980 ppm2 1.579 CV 1
ASSI { 2841}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 80 and name HN ))
3.600 1.600 1.600 peak 2841 spectrum 1 weight 0.10000E+01 volume 0.10155E-02 ppm1 4.411 ppm2 7.726 CV 1
ASSI { 2842}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB2 ))
2.900 1.100 1.100 peak 2842 spectrum 1 weight 0.10000E+01 volume 0.27133E-02 ppm1 4.409 ppm2 2.527 CV 1
ASSI { 2843}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB1 ))
2.900 1.000 1.000 peak 2843 spectrum 1 weight 0.10000E+01 volume 0.41971E-02 ppm1 4.409 ppm2 2.229 CV 1
ASSI { 2844}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HN ))
2.800 1.000 1.000 peak 2844 spectrum 1 weight 0.10000E+01 volume 0.35463E-02 ppm1 4.409 ppm2 8.302 CV 1
ASSI { 2850}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HN ))
2.700 0.900 0.900 peak 2850 spectrum 1 weight 0.10000E+01 volume 0.22796E-02 ppm1 4.063 ppm2 8.991 CV 1
ASSI { 2852}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB1 ))
2.600 0.800 0.800 peak 2852 spectrum 1 weight 0.10000E+01 volume 0.40235E-02 ppm1 5.060 ppm2 2.707 CV 1
ASSI { 2854}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HB2 ))
3.100 1.200 1.200 peak 2854 spectrum 1 weight 0.10000E+01 volume 0.19272E-02 ppm1 5.061 ppm2 3.077 CV 1
ASSI { 2855}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HN ))
3.000 1.100 1.100 peak 2855 spectrum 1 weight 0.10000E+01 volume 0.19707E-02 ppm1 5.063 ppm2 7.816 CV 1
ASSI { 2859}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HN ))
2.900 1.100 1.100 peak 2859 spectrum 1 weight 0.10000E+01 volume 0.10572E-02 ppm1 4.876 ppm2 10.100 CV 1
ASSI { 2862}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 69 and name HA ))
1.800 0.400 0.400 peak 2862 spectrum 1 weight 0.10000E+01 volume 0.44455E-02 ppm1 4.878 ppm2 5.246 CV 1
ASSI { 2863}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB2 ))
2.700 0.900 0.900 peak 2863 spectrum 1 weight 0.10000E+01 volume 0.21743E-02 ppm1 4.879 ppm2 4.107 CV 1
ASSI { 2865}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HG2 ))
3.900 1.900 1.900 peak 2865 spectrum 1 weight 0.10000E+01 volume 0.12828E-02 ppm1 4.453 ppm2 2.717 CV 1
ASSI { 2866}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HG1 ))
3.600 1.700 1.700 peak 2866 spectrum 1 weight 0.10000E+01 volume 0.11896E-02 ppm1 4.454 ppm2 2.575 CV 1
ASSI { 2867}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HB2 ))
2.400 0.700 0.700 peak 2867 spectrum 1 weight 0.10000E+01 volume 0.43908E-02 ppm1 4.453 ppm2 2.354 CV 1
ASSI { 2868}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 82 and name HN ))
2.100 0.500 0.500 peak 2868 spectrum 1 weight 0.10000E+01 volume 0.12146E-01 ppm1 4.456 ppm2 8.317 CV 1
ASSI { 2870}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 77 and name HG12))
2.300 2.300 3.700 peak 2870 spectrum 1 weight 0.10000E+01 volume 0.30511E-02 ppm1 4.452 ppm2 0.952 CV 1
ASSI { 2872}
(( segid " " and resid 81 and name HA ))
( segid " " and resid 57 and name HG2%)
3.000 1.100 1.100 peak 2872 spectrum 1 weight 0.10000E+01 volume 0.36652E-02 ppm1 4.455 ppm2 1.002 CV 1
ASSI { 2882}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 45 and name HG2%)
4.300 2.400 1.700 peak 2882 spectrum 1 weight 0.10000E+01 volume 0.12174E-02 ppm1 4.028 ppm2 1.137 CV 1
ASSI { 2883}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HN ))
3.900 1.900 1.900 peak 2883 spectrum 1 weight 0.10000E+01 volume 0.79959E-03 ppm1 4.633 ppm2 7.814 CV 1
ASSI { 2885}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 39 and name HG1%)
3.400 1.500 1.500 peak 2885 spectrum 1 weight 0.10000E+01 volume 0.34344E-02 ppm1 4.028 ppm2 0.841 CV 1
ASSI { 2891}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB2 ))
2.700 0.900 0.900 peak 2891 spectrum 1 weight 0.10000E+01 volume 0.37162E-02 ppm1 4.635 ppm2 2.782 CV 1
ASSI { 2894}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB2 ))
2.600 0.900 0.900 peak 2894 spectrum 1 weight 0.10000E+01 volume 0.67204E-02 ppm1 4.332 ppm2 2.657 CV 1
ASSI { 2900}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HG11))
3.800 1.900 1.900 peak 2900 spectrum 1 weight 0.10000E+01 volume 0.89156E-03 ppm1 4.345 ppm2 1.380 CV 1
ASSI { 2901}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HN ))
2.500 0.800 0.800 peak 2901 spectrum 1 weight 0.10000E+01 volume 0.22438E-02 ppm1 4.347 ppm2 6.417 CV 1
ASSI { 2902}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HD2 ))
2.200 0.600 0.600 peak 2902 spectrum 1 weight 0.10000E+01 volume 0.82288E-02 ppm1 4.345 ppm2 4.034 CV 1
ASSI { 2903}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HD1 ))
2.200 0.600 0.600 peak 2903 spectrum 1 weight 0.10000E+01 volume 0.48357E-02 ppm1 4.345 ppm2 3.708 CV 1
ASSI { 2905}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HB2 ))
3.200 1.300 1.300 peak 2905 spectrum 1 weight 0.10000E+01 volume 0.26355E-02 ppm1 4.689 ppm2 3.636 CV 1
ASSI { 2907}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HN ))
3.300 1.300 1.300 peak 2907 spectrum 1 weight 0.10000E+01 volume 0.13957E-02 ppm1 4.685 ppm2 7.733 CV 1
ASSI { 2908}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HG12))
3.000 1.100 1.100 peak 2908 spectrum 1 weight 0.10000E+01 volume 0.12477E-02 ppm1 4.345 ppm2 1.305 CV 1
ASSI { 2912}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 57 and name HG1%)
4.500 2.500 1.500 peak 2912 spectrum 1 weight 0.10000E+01 volume 0.77936E-03 ppm1 4.862 ppm2 0.947 CV 1
ASSI { 2916}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 55 and name HD% )
2.500 0.800 0.800 peak 2916 spectrum 1 weight 0.10000E+01 volume 0.50492E-02 ppm1 4.877 ppm2 7.475 CV 1
ASSI { 2920}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 67 and name HD2%)
4.400 2.400 1.600 peak 2920 spectrum 1 weight 0.10000E+01 volume 0.72020E-03 ppm1 4.531 ppm2 0.541 CV 1
ASSI { 2925}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HN ))
3.000 1.100 1.100 peak 2925 spectrum 1 weight 0.10000E+01 volume 0.22145E-02 ppm1 4.287 ppm2 7.883 CV 1
ASSI { 2942}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 67 and name HN ))
3.500 1.600 1.600 peak 2942 spectrum 1 weight 0.10000E+01 volume 0.87005E-03 ppm1 4.033 ppm2 7.760 CV 1
ASSI { 2953}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HG ))
2.700 0.900 0.900 peak 2953 spectrum 1 weight 0.10000E+01 volume 0.28115E-02 ppm1 3.586 ppm2 1.771 CV 1
ASSI { 2954}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 29 and name HD2%)
3.700 1.700 1.700 peak 2954 spectrum 1 weight 0.10000E+01 volume 0.14389E-02 ppm1 3.585 ppm2 0.916 CV 1
ASSI { 2956}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 70 and name HG2%)
2.900 1.000 1.000 peak 2956 spectrum 1 weight 0.10000E+01 volume 0.40213E-02 ppm1 3.586 ppm2 0.645 CV 1
ASSI { 2957}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 12 and name HD2%)
2.400 0.700 0.700 peak 2957 spectrum 1 weight 0.10000E+01 volume 0.55234E-02 ppm1 4.270 ppm2 0.867 CV 1
ASSI { 2958}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 70 and name HB ))
3.400 3.400 2.600 peak 2958 spectrum 1 weight 0.10000E+01 volume 0.34083E-02 ppm1 3.585 ppm2 2.270 CV 1
ASSI { 2960}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HN ))
2.600 0.900 0.900 peak 2960 spectrum 1 weight 0.10000E+01 volume 0.26825E-02 ppm1 3.586 ppm2 8.491 CV 1
ASSI { 2961}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 70 and name HG1%)
3.200 1.300 1.300 peak 2961 spectrum 1 weight 0.10000E+01 volume 0.12183E-02 ppm1 3.586 ppm2 0.445 CV 1
ASSI { 2962}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB2 ))
2.400 0.700 0.700 peak 2962 spectrum 1 weight 0.10000E+01 volume 0.44914E-02 ppm1 4.263 ppm2 2.127 CV 1
ASSI { 2968}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HN ))
2.800 1.000 1.000 peak 2968 spectrum 1 weight 0.10000E+01 volume 0.22848E-02 ppm1 4.264 ppm2 9.277 CV 1
ASSI { 2970}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HG2 ))
3.600 1.600 1.600 peak 2970 spectrum 1 weight 0.10000E+01 volume 0.21649E-02 ppm1 3.942 ppm2 0.873 CV 1
ASSI { 2971}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HG1 ))
3.300 1.300 1.300 peak 2971 spectrum 1 weight 0.10000E+01 volume 0.17148E-02 ppm1 4.537 ppm2 1.779 CV 1
OR { 2971}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 2979}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 57 and name HN ))
3.500 3.500 2.500 peak 2979 spectrum 1 weight 0.10000E+01 volume 0.22343E-02 ppm1 3.943 ppm2 7.763 CV 1
ASSI { 2980}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HN ))
2.700 0.900 0.900 peak 2980 spectrum 1 weight 0.10000E+01 volume 0.38527E-02 ppm1 3.942 ppm2 8.175 CV 1
ASSI { 2982}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HD1 ))
3.100 1.200 1.200 peak 2982 spectrum 1 weight 0.10000E+01 volume 0.16353E-02 ppm1 4.535 ppm2 1.499 CV 1
ASSI { 2983}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB1 ))
2.300 0.600 0.600 peak 2983 spectrum 1 weight 0.10000E+01 volume 0.13743E-01 ppm1 4.070 ppm2 2.015 CV 1
OR { 2983}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
ASSI { 2984}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HN ))
2.500 0.800 0.800 peak 2984 spectrum 1 weight 0.10000E+01 volume 0.65803E-02 ppm1 4.070 ppm2 9.261 CV 1
ASSI { 2985}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 76 and name HE% )
3.400 1.500 1.500 peak 2985 spectrum 1 weight 0.10000E+01 volume 0.18880E-02 ppm1 4.491 ppm2 6.581 CV 1
ASSI { 2989}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 81 and name HE21))
3.200 1.300 1.300 peak 2989 spectrum 1 weight 0.10000E+01 volume 0.21962E-02 ppm1 3.895 ppm2 7.764 CV 1
ASSI { 2990}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 8 and name HG2%)
4.100 2.100 1.900 peak 2990 spectrum 1 weight 0.10000E+01 volume 0.24897E-02 ppm1 3.896 ppm2 0.513 CV 1
ASSI { 2991}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name HB2 ))
5.000 3.100 1.000 peak 2991 spectrum 1 weight 0.10000E+01 volume 0.60104E-03 ppm1 4.489 ppm2 2.413 CV 1
ASSI { 2993}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name HB1 ))
5.200 3.400 0.800 peak 2993 spectrum 1 weight 0.10000E+01 volume 0.80526E-03 ppm1 4.490 ppm2 1.914 CV 1
ASSI { 2994}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 59 and name HG2%)
3.200 1.300 1.300 peak 2994 spectrum 1 weight 0.10000E+01 volume 0.13213E-02 ppm1 4.490 ppm2 0.621 CV 1
ASSI { 2996}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HB2 ))
2.900 1.000 1.000 peak 2996 spectrum 1 weight 0.10000E+01 volume 0.22696E-02 ppm1 3.895 ppm2 1.778 CV 1
ASSI { 2997}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 78 and name HD1%)
3.000 1.200 1.200 peak 2997 spectrum 1 weight 0.10000E+01 volume 0.67569E-02 ppm1 3.898 ppm2 0.829 CV 1
ASSI { 2998}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 81 and name HG2 ))
2.900 1.000 1.000 peak 2998 spectrum 1 weight 0.10000E+01 volume 0.10042E-02 ppm1 3.900 ppm2 2.714 CV 1
ASSI { 3001}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 81 and name HE22))
4.000 2.000 2.000 peak 3001 spectrum 1 weight 0.10000E+01 volume 0.13561E-02 ppm1 3.896 ppm2 7.707 CV 1
ASSI { 3002}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HG2 ))
2.700 0.900 0.900 peak 3002 spectrum 1 weight 0.10000E+01 volume 0.56921E-02 ppm1 4.070 ppm2 2.298 CV 1
OR { 3002}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HG1 ))
ASSI { 3006}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name HG2 ))
5.100 3.200 0.900 peak 3006 spectrum 1 weight 0.10000E+01 volume 0.84010E-03 ppm1 4.491 ppm2 2.015 CV 1
ASSI { 3008}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HG11))
3.100 1.200 1.200 peak 3008 spectrum 1 weight 0.10000E+01 volume 0.18779E-02 ppm1 4.492 ppm2 0.847 CV 1
ASSI { 3012}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB ))
2.300 0.700 0.700 peak 3012 spectrum 1 weight 0.10000E+01 volume 0.36015E-02 ppm1 5.250 ppm2 4.366 CV 1
ASSI { 3015}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HN ))
2.800 1.000 1.000 peak 3015 spectrum 1 weight 0.10000E+01 volume 0.13970E-02 ppm1 5.250 ppm2 8.741 CV 1
ASSI { 3022}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 22 and name HN ))
2.800 1.000 1.000 peak 3022 spectrum 1 weight 0.10000E+01 volume 0.38742E-02 ppm1 4.636 ppm2 6.418 CV 1
ASSI { 3023}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB2 ))
2.800 1.000 1.000 peak 3023 spectrum 1 weight 0.10000E+01 volume 0.57281E-02 ppm1 4.147 ppm2 2.146 CV 1
ASSI { 3024}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HD22))
3.600 1.600 1.600 peak 3024 spectrum 1 weight 0.10000E+01 volume 0.27655E-02 ppm1 4.639 ppm2 8.083 CV 1
ASSI { 3025}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 16 and name HG2%)
4.200 2.200 1.800 peak 3025 spectrum 1 weight 0.10000E+01 volume 0.13637E-02 ppm1 4.638 ppm2 1.202 CV 1
ASSI { 3027}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 20 and name HN ))
2.800 1.000 1.000 peak 3027 spectrum 1 weight 0.10000E+01 volume 0.30053E-02 ppm1 4.640 ppm2 8.689 CV 1
ASSI { 3029}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG2 ))
2.800 1.000 1.000 peak 3029 spectrum 1 weight 0.10000E+01 volume 0.38432E-02 ppm1 4.148 ppm2 2.465 CV 1
ASSI { 3035}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 52 and name HG1 ))
3.000 1.100 1.100 peak 3035 spectrum 1 weight 0.10000E+01 volume 0.30969E-02 ppm1 4.146 ppm2 2.393 CV 1
ASSI { 3037}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HN ))
3.300 1.400 1.400 peak 3037 spectrum 1 weight 0.10000E+01 volume 0.15732E-02 ppm1 4.147 ppm2 8.408 CV 1
ASSI { 3039}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 48 and name HG2%)
4.000 2.000 2.000 peak 3039 spectrum 1 weight 0.10000E+01 volume 0.17394E-02 ppm1 4.048 ppm2 0.967 CV 1
ASSI { 3043}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HB1 ))
2.900 1.000 1.000 peak 3043 spectrum 1 weight 0.10000E+01 volume 0.40771E-02 ppm1 4.050 ppm2 2.160 CV 1
ASSI { 3044}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 45 and name HG2%)
3.500 3.500 2.500 peak 3044 spectrum 1 weight 0.10000E+01 volume 0.31617E-02 ppm1 4.049 ppm2 1.112 CV 1
ASSI { 3046}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HN ))
2.900 1.000 1.000 peak 3046 spectrum 1 weight 0.10000E+01 volume 0.29902E-02 ppm1 4.049 ppm2 6.955 CV 1
ASSI { 3048}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 78 and name HN ))
3.300 1.400 1.400 peak 3048 spectrum 1 weight 0.10000E+01 volume 0.12002E-02 ppm1 3.945 ppm2 8.530 CV 1
ASSI { 3049}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 78 and name HB2 ))
2.500 0.800 0.800 peak 3049 spectrum 1 weight 0.10000E+01 volume 0.28205E-02 ppm1 3.945 ppm2 1.777 CV 1
ASSI { 3052}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HD2 ))
2.800 1.000 1.000 peak 3052 spectrum 1 weight 0.10000E+01 volume 0.24039E-02 ppm1 3.950 ppm2 1.514 CV 1
ASSI { 3053}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HG1 ))
2.900 1.000 1.000 peak 3053 spectrum 1 weight 0.10000E+01 volume 0.24070E-02 ppm1 3.949 ppm2 1.668 CV 1
ASSI { 3054}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HG2 ))
3.200 1.300 1.300 peak 3054 spectrum 1 weight 0.10000E+01 volume 0.20520E-02 ppm1 3.960 ppm2 2.502 CV 1
OR { 3054}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HG1 ))
ASSI { 3055}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HB1 ))
2.700 0.900 0.900 peak 3055 spectrum 1 weight 0.10000E+01 volume 0.40105E-02 ppm1 3.961 ppm2 2.171 CV 1
ASSI { 3065}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG2 ))
3.500 1.500 1.500 peak 3065 spectrum 1 weight 0.10000E+01 volume 0.16917E-02 ppm1 4.198 ppm2 2.874 CV 1
ASSI { 3066}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HG1 ))
3.400 1.400 1.400 peak 3066 spectrum 1 weight 0.10000E+01 volume 0.23432E-02 ppm1 4.197 ppm2 2.386 CV 1
ASSI { 3067}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 56 and name HN ))
4.300 2.300 1.700 peak 3067 spectrum 1 weight 0.10000E+01 volume 0.63138E-03 ppm1 4.198 ppm2 7.853 CV 1
ASSI { 3068}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 77 and name HG12))
3.200 1.300 1.300 peak 3068 spectrum 1 weight 0.10000E+01 volume 0.19656E-02 ppm1 4.198 ppm2 0.948 CV 1
ASSI { 3070}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB1 ))
2.600 0.800 0.800 peak 3070 spectrum 1 weight 0.10000E+01 volume 0.28727E-02 ppm1 4.197 ppm2 2.170 CV 1
ASSI { 3072}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB2 ))
2.900 1.000 1.000 peak 3072 spectrum 1 weight 0.10000E+01 volume 0.18712E-02 ppm1 4.198 ppm2 2.545 CV 1
ASSI { 3077}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 24 and name HG1%)
2.800 1.000 1.000 peak 3077 spectrum 1 weight 0.10000E+01 volume 0.30879E-02 ppm1 3.955 ppm2 0.991 CV 1
ASSI { 3080}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB ))
2.500 0.800 0.800 peak 3080 spectrum 1 weight 0.10000E+01 volume 0.75814E-02 ppm1 4.440 ppm2 4.741 CV 1
ASSI { 3083}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 78 and name HD2%)
2.900 1.100 1.100 peak 3083 spectrum 1 weight 0.10000E+01 volume 0.21246E-02 ppm1 4.438 ppm2 0.829 CV 1
OR { 3083}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 78 and name HD1%)
ASSI { 3084}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HN ))
2.900 1.000 1.000 peak 3084 spectrum 1 weight 0.10000E+01 volume 0.22886E-02 ppm1 4.437 ppm2 8.570 CV 1
ASSI { 3087}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 9 and name HG1%)
3.400 1.400 1.400 peak 3087 spectrum 1 weight 0.10000E+01 volume 0.18969E-02 ppm1 3.959 ppm2 0.906 CV 1
ASSI { 3088}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HG1 ))
3.400 1.400 1.400 peak 3088 spectrum 1 weight 0.10000E+01 volume 0.30614E-02 ppm1 3.955 ppm2 2.341 CV 1
ASSI { 3089}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB1 ))
2.500 0.800 0.800 peak 3089 spectrum 1 weight 0.10000E+01 volume 0.57370E-02 ppm1 3.959 ppm2 1.997 CV 1
ASSI { 3090}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 9 and name HN ))
3.700 1.700 1.700 peak 3090 spectrum 1 weight 0.10000E+01 volume 0.12094E-02 ppm1 3.959 ppm2 8.459 CV 1
ASSI { 3091}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HN ))
2.500 0.800 0.800 peak 3091 spectrum 1 weight 0.10000E+01 volume 0.46149E-02 ppm1 3.959 ppm2 8.848 CV 1
ASSI { 3093}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 8 and name HD1%)
5.100 3.300 0.900 peak 3093 spectrum 1 weight 0.10000E+01 volume 0.83314E-03 ppm1 3.710 ppm2 0.584 CV 1
ASSI { 3094}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 9 and name HN ))
3.300 1.400 1.400 peak 3094 spectrum 1 weight 0.10000E+01 volume 0.17396E-02 ppm1 3.702 ppm2 8.442 CV 1
ASSI { 3095}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HG1 ))
2.900 1.100 1.100 peak 3095 spectrum 1 weight 0.10000E+01 volume 0.26808E-02 ppm1 3.703 ppm2 2.145 CV 1
ASSI { 3096}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 74 and name HG2%)
3.500 1.500 1.500 peak 3096 spectrum 1 weight 0.10000E+01 volume 0.22476E-02 ppm1 3.702 ppm2 1.098 CV 1
ASSI { 3097}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 8 and name HG2%)
2.400 0.700 0.700 peak 3097 spectrum 1 weight 0.10000E+01 volume 0.32172E-02 ppm1 3.701 ppm2 0.512 CV 1
ASSI { 3099}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB2 ))
2.500 0.800 0.800 peak 3099 spectrum 1 weight 0.10000E+01 volume 0.31331E-02 ppm1 3.704 ppm2 2.212 CV 1
ASSI { 3100}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
2.400 0.700 0.700 peak 3100 spectrum 1 weight 0.10000E+01 volume 0.35976E-02 ppm1 3.704 ppm2 9.234 CV 1
ASSI { 3101}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB1 ))
3.100 1.200 1.200 peak 3101 spectrum 1 weight 0.10000E+01 volume 0.20945E-02 ppm1 3.703 ppm2 2.058 CV 1
ASSI { 3102}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HN ))
3.600 1.600 1.600 peak 3102 spectrum 1 weight 0.10000E+01 volume 0.80477E-03 ppm1 4.313 ppm2 8.624 CV 1
ASSI { 3103}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 42 and name HD2%)
2.500 2.500 3.500 peak 3103 spectrum 1 weight 0.10000E+01 volume 0.17305E-02 ppm1 4.312 ppm2 0.966 CV 1
ASSI { 3104}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HG1 ))
4.200 2.200 1.800 peak 3104 spectrum 1 weight 0.10000E+01 volume 0.83669E-03 ppm1 4.316 ppm2 2.335 CV 1
ASSI { 3105}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HG2 ))
4.100 2.100 1.900 peak 3105 spectrum 1 weight 0.10000E+01 volume 0.59220E-03 ppm1 4.313 ppm2 2.493 CV 1
ASSI { 3107}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HN ))
3.300 1.400 1.400 peak 3107 spectrum 1 weight 0.10000E+01 volume 0.13584E-02 ppm1 4.313 ppm2 6.955 CV 1
ASSI { 3108}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HB1 ))
2.700 0.900 0.900 peak 3108 spectrum 1 weight 0.10000E+01 volume 0.24478E-02 ppm1 4.313 ppm2 3.711 CV 1
ASSI { 3109}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HB2 ))
2.800 1.000 1.000 peak 3109 spectrum 1 weight 0.10000E+01 volume 0.38207E-02 ppm1 4.312 ppm2 4.025 CV 1
ASSI { 3110}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 65 and name HB2 ))
3.100 1.200 1.200 peak 3110 spectrum 1 weight 0.10000E+01 volume 0.19735E-02 ppm1 4.013 ppm2 1.814 CV 1
OR { 3110}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 65 and name HB1 ))
ASSI { 3114}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 20 and name HB% )
3.300 1.400 1.400 peak 3114 spectrum 1 weight 0.10000E+01 volume 0.87128E-03 ppm1 3.998 ppm2 1.544 CV 1
ASSI { 3115}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB2 ))
2.300 0.700 0.700 peak 3115 spectrum 1 weight 0.10000E+01 volume 0.97130E-02 ppm1 4.012 ppm2 3.913 CV 1
OR { 3115}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB1 ))
ASSI { 3124}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 39 and name HG1%)
2.900 1.000 1.000 peak 3124 spectrum 1 weight 0.10000E+01 volume 0.43580E-02 ppm1 4.002 ppm2 0.841 CV 1
ASSI { 3127}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB1 ))
2.600 0.800 0.800 peak 3127 spectrum 1 weight 0.10000E+01 volume 0.32540E-02 ppm1 4.371 ppm2 1.920 CV 1
ASSI { 3128}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 59 and name HA ))
4.000 2.000 2.000 peak 3128 spectrum 1 weight 0.10000E+01 volume 0.85140E-03 ppm1 4.370 ppm2 4.493 CV 1
ASSI { 3130}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 76 and name HD% )
3.000 1.100 1.100 peak 3130 spectrum 1 weight 0.10000E+01 volume 0.21032E-02 ppm1 4.206 ppm2 6.805 CV 1
ASSI { 3131}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 77 and name HN ))
3.700 1.700 1.700 peak 3131 spectrum 1 weight 0.10000E+01 volume 0.78617E-03 ppm1 4.204 ppm2 8.483 CV 1
ASSI { 3133}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 79 and name HB2 ))
3.200 1.300 1.300 peak 3133 spectrum 1 weight 0.10000E+01 volume 0.12356E-02 ppm1 4.207 ppm2 2.529 CV 1
ASSI { 3134}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 79 and name HB1 ))
4.000 2.000 2.000 peak 3134 spectrum 1 weight 0.10000E+01 volume 0.68344E-03 ppm1 4.207 ppm2 2.227 CV 1
ASSI { 3137}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 80 and name HD2 ))
3.900 1.900 1.900 peak 3137 spectrum 1 weight 0.10000E+01 volume 0.76604E-03 ppm1 4.205 ppm2 7.062 CV 1
ASSI { 3153}
(( segid " " and resid 43 and name HB1 ))
(( segid " " and resid 43 and name HB2 ))
1.800 0.400 0.400 peak 3153 spectrum 1 weight 0.10000E+01 volume 0.67125E-02 ppm1 3.714 ppm2 4.025 CV 1
ASSI { 3159}
(( segid " " and resid 32 and name HB2 ))
( segid " " and resid 34 and name HG2%)
4.800 2.900 1.200 peak 3159 spectrum 1 weight 0.10000E+01 volume 0.71280E-03 ppm1 4.117 ppm2 1.320 CV 1
ASSI { 3160}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 36 and name HN ))
3.300 1.300 1.300 peak 3160 spectrum 1 weight 0.10000E+01 volume 0.16365E-02 ppm1 3.859 ppm2 7.817 CV 1
ASSI { 3163}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 35 and name HB1 ))
2.800 1.000 1.000 peak 3163 spectrum 1 weight 0.10000E+01 volume 0.12954E-02 ppm1 4.114 ppm2 2.459 CV 1
ASSI { 3164}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HB1 ))
1.700 0.400 0.500 peak 3164 spectrum 1 weight 0.10000E+01 volume 0.12311E-01 ppm1 4.114 ppm2 3.859 CV 1
ASSI { 3169}
(( segid " " and resid 32 and name HB1 ))
( segid " " and resid 34 and name HG2%)
4.000 2.000 2.000 peak 3169 spectrum 1 weight 0.10000E+01 volume 0.11819E-02 ppm1 3.860 ppm2 1.317 CV 1
ASSI { 3170}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 31 and name HA ))
4.900 3.000 1.100 peak 3170 spectrum 1 weight 0.10000E+01 volume 0.81799E-03 ppm1 3.862 ppm2 4.383 CV 1
ASSI { 3172}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 31 and name HA ))
4.500 2.600 1.500 peak 3172 spectrum 1 weight 0.10000E+01 volume 0.86965E-03 ppm1 4.112 ppm2 4.378 CV 1
ASSI { 3173}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HN ))
2.500 0.800 0.800 peak 3173 spectrum 1 weight 0.10000E+01 volume 0.30099E-02 ppm1 4.112 ppm2 10.106 CV 1
ASSI { 3174}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 32 and name HN ))
2.900 1.000 1.000 peak 3174 spectrum 1 weight 0.10000E+01 volume 0.40386E-02 ppm1 3.859 ppm2 10.105 CV 1
ASSI { 3178}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 32 and name HA ))
2.900 1.000 1.000 peak 3178 spectrum 1 weight 0.10000E+01 volume 0.11821E-02 ppm1 3.860 ppm2 4.879 CV 1
ASSI { 3179}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 33 and name HN ))
3.700 1.800 1.800 peak 3179 spectrum 1 weight 0.10000E+01 volume 0.11825E-02 ppm1 4.111 ppm2 8.376 CV 1
ASSI { 3180}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HG11))
3.000 1.100 1.100 peak 3180 spectrum 1 weight 0.10000E+01 volume 0.29826E-02 ppm1 3.955 ppm2 1.346 CV 1
ASSI { 3182}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 19 and name HD1%)
3.900 1.900 1.900 peak 3182 spectrum 1 weight 0.10000E+01 volume 0.21499E-02 ppm1 3.956 ppm2 0.797 CV 1
ASSI { 3183}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 37 and name HD2%)
2.600 0.800 0.800 peak 3183 spectrum 1 weight 0.10000E+01 volume 0.79174E-03 ppm1 4.100 ppm2 0.775 CV 1
ASSI { 3191}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HA ))
3.900 1.900 1.900 peak 3191 spectrum 1 weight 0.10000E+01 volume 0.90676E-03 ppm1 4.326 ppm2 3.624 CV 1
ASSI { 3192}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 25 and name HN ))
3.800 1.800 1.800 peak 3192 spectrum 1 weight 0.10000E+01 volume 0.17201E-02 ppm1 4.335 ppm2 9.261 CV 1
ASSI { 3199}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 17 and name HD22))
3.300 1.400 1.400 peak 3199 spectrum 1 weight 0.10000E+01 volume 0.28473E-02 ppm1 4.327 ppm2 8.082 CV 1
ASSI { 3200}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 17 and name HD21))
2.800 1.000 1.000 peak 3200 spectrum 1 weight 0.10000E+01 volume 0.18414E-02 ppm1 4.325 ppm2 6.871 CV 1
ASSI { 3204}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB2 ))
2.700 0.900 0.900 peak 3204 spectrum 1 weight 0.10000E+01 volume 0.17168E-02 ppm1 4.098 ppm2 3.209 CV 1
ASSI { 3205}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB1 ))
2.900 1.000 1.000 peak 3205 spectrum 1 weight 0.10000E+01 volume 0.10694E-02 ppm1 4.100 ppm2 3.147 CV 1
ASSI { 3206}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HD1 ))
3.700 1.700 1.700 peak 3206 spectrum 1 weight 0.10000E+01 volume 0.75893E-03 ppm1 4.319 ppm2 3.709 CV 1
ASSI { 3207}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 31 and name HB1 ))
4.900 3.000 1.100 peak 3207 spectrum 1 weight 0.10000E+01 volume 0.70495E-03 ppm1 3.552 ppm2 1.815 CV 1
ASSI { 3209}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB ))
3.000 1.100 1.100 peak 3209 spectrum 1 weight 0.10000E+01 volume 0.13829E-02 ppm1 3.553 ppm2 2.345 CV 1
ASSI { 3210}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 27 and name HG1%)
2.300 0.600 0.600 peak 3210 spectrum 1 weight 0.10000E+01 volume 0.66039E-02 ppm1 3.553 ppm2 0.751 CV 1
ASSI { 3211}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 27 and name HG2%)
2.200 0.600 0.600 peak 3211 spectrum 1 weight 0.10000E+01 volume 0.49249E-02 ppm1 3.554 ppm2 0.948 CV 1
ASSI { 3214}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 22 and name HG11))
4.100 2.100 1.900 peak 3214 spectrum 1 weight 0.10000E+01 volume 0.82258E-03 ppm1 3.552 ppm2 1.363 CV 1
ASSI { 3217}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 22 and name HG2%)
3.100 1.200 1.200 peak 3217 spectrum 1 weight 0.10000E+01 volume 0.94752E-03 ppm1 3.553 ppm2 1.015 CV 1
ASSI { 3220}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HG11))
3.700 1.800 1.800 peak 3220 spectrum 1 weight 0.10000E+01 volume 0.19772E-02 ppm1 3.867 ppm2 0.084 CV 1
ASSI { 3221}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 55 and name HZ ))
2.800 1.000 1.000 peak 3221 spectrum 1 weight 0.10000E+01 volume 0.21574E-02 ppm1 3.870 ppm2 7.477 CV 1
ASSI { 3222}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 55 and name HE% )
3.200 1.300 1.300 peak 3222 spectrum 1 weight 0.10000E+01 volume 0.19910E-02 ppm1 3.870 ppm2 7.132 CV 1
ASSI { 3228}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name HN ))
2.500 2.500 3.500 peak 3228 spectrum 1 weight 0.10000E+01 volume 0.70702E-02 ppm1 4.360 ppm2 7.972 CV 1
ASSI { 3229}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HN ))
2.800 1.000 1.000 peak 3229 spectrum 1 weight 0.10000E+01 volume 0.25791E-02 ppm1 4.359 ppm2 8.773 CV 1
ASSI { 3230}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB ))
2.300 0.700 0.700 peak 3230 spectrum 1 weight 0.10000E+01 volume 0.90118E-02 ppm1 4.359 ppm2 4.108 CV 1
ASSI { 3233}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 18 and name HB1 ))
3.700 1.700 1.700 peak 3233 spectrum 1 weight 0.10000E+01 volume 0.12750E-02 ppm1 3.801 ppm2 2.168 CV 1
ASSI { 3235}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HG12))
2.700 0.900 0.900 peak 3235 spectrum 1 weight 0.10000E+01 volume 0.28229E-02 ppm1 3.798 ppm2 1.980 CV 1
ASSI { 3237}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 14 and name HB2 ))
4.100 2.100 1.900 peak 3237 spectrum 1 weight 0.10000E+01 volume 0.13724E-02 ppm1 3.798 ppm2 2.307 CV 1
ASSI { 3245}
(( segid " " and resid 70 and name HA ))
( segid " " and resid 33 and name HE% )
2.600 0.900 0.900 peak 3245 spectrum 1 weight 0.10000E+01 volume 0.21448E-02 ppm1 3.336 ppm2 6.966 CV 1
ASSI { 3246}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 33 and name HZ ))
3.300 1.400 1.400 peak 3246 spectrum 1 weight 0.10000E+01 volume 0.27195E-02 ppm1 3.336 ppm2 6.798 CV 1
ASSI { 3252}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 73 and name HN ))
3.200 1.300 1.300 peak 3252 spectrum 1 weight 0.10000E+01 volume 0.10769E-02 ppm1 3.337 ppm2 8.018 CV 1
ASSI { 3253}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 50 and name HB% )
3.600 1.600 1.600 peak 3253 spectrum 1 weight 0.10000E+01 volume 0.23262E-02 ppm1 3.986 ppm2 1.572 CV 1
ASSI { 3258}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 49 and name HG2%)
2.300 0.700 0.700 peak 3258 spectrum 1 weight 0.10000E+01 volume 0.61303E-02 ppm1 3.985 ppm2 1.111 CV 1
ASSI { 3261}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB ))
2.400 0.700 0.700 peak 3261 spectrum 1 weight 0.10000E+01 volume 0.47261E-02 ppm1 3.625 ppm2 2.060 CV 1
ASSI { 3263}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 24 and name HG1%)
2.400 0.700 0.700 peak 3263 spectrum 1 weight 0.10000E+01 volume 0.69311E-02 ppm1 3.625 ppm2 0.982 CV 1
ASSI { 3269}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 48 and name HA ))
3.700 3.700 2.300 peak 3269 spectrum 1 weight 0.10000E+01 volume 0.15046E-02 ppm1 3.531 ppm2 3.408 CV 1
ASSI { 3273}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 45 and name HA ))
4.500 2.500 1.500 peak 3273 spectrum 1 weight 0.10000E+01 volume 0.93942E-03 ppm1 3.072 ppm2 3.527 CV 1
ASSI { 3274}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HG12))
2.200 0.600 0.600 peak 3274 spectrum 1 weight 0.10000E+01 volume 0.82480E-02 ppm1 3.531 ppm2 0.960 CV 1
ASSI { 3277}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 80 and name HB1 ))
5.000 3.100 1.000 peak 3277 spectrum 1 weight 0.10000E+01 volume 0.68576E-03 ppm1 3.536 ppm2 2.562 CV 1
ASSI { 3280}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 76 and name HD% )
3.300 1.400 1.400 peak 3280 spectrum 1 weight 0.10000E+01 volume 0.12664E-02 ppm1 3.537 ppm2 6.805 CV 1
ASSI { 3284}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 65 and name HB1 ))
3.400 3.400 2.600 peak 3284 spectrum 1 weight 0.10000E+01 volume 0.28289E-02 ppm1 3.084 ppm2 1.817 CV 1
OR { 3284}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 65 and name HB2 ))
ASSI { 3286}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 67 and name HB2 ))
4.900 3.000 1.100 peak 3286 spectrum 1 weight 0.10000E+01 volume 0.92107E-03 ppm1 3.083 ppm2 2.146 CV 1
ASSI { 3294}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 47 and name HG2%)
4.100 2.100 1.900 peak 3294 spectrum 1 weight 0.10000E+01 volume 0.31835E-02 ppm1 3.565 ppm2 0.966 CV 1
ASSI { 3295}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 16 and name HG1%)
2.400 0.700 0.700 peak 3295 spectrum 1 weight 0.10000E+01 volume 0.50097E-02 ppm1 3.568 ppm2 1.004 CV 1
ASSI { 3296}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 19 and name HB ))
2.800 1.000 1.000 peak 3296 spectrum 1 weight 0.10000E+01 volume 0.24520E-02 ppm1 3.568 ppm2 1.664 CV 1
ASSI { 3299}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 20 and name HN ))
3.400 1.500 1.500 peak 3299 spectrum 1 weight 0.10000E+01 volume 0.18468E-02 ppm1 3.569 ppm2 8.691 CV 1
ASSI { 3305}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 77 and name HN ))
3.500 1.500 1.500 peak 3305 spectrum 1 weight 0.10000E+01 volume 0.85465E-03 ppm1 3.683 ppm2 8.458 CV 1
ASSI { 3308}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 8 and name HD1%)
3.600 1.600 1.600 peak 3308 spectrum 1 weight 0.10000E+01 volume 0.99345E-03 ppm1 3.392 ppm2 0.588 CV 1
ASSI { 3310}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 12 and name HB1 ))
3.100 1.200 1.200 peak 3310 spectrum 1 weight 0.10000E+01 volume 0.98724E-03 ppm1 3.392 ppm2 1.244 CV 1
ASSI { 3311}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 13 and name HN ))
3.600 1.600 1.600 peak 3311 spectrum 1 weight 0.10000E+01 volume 0.72449E-03 ppm1 3.392 ppm2 8.992 CV 1
ASSI { 3313}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 12 and name HN ))
3.300 1.300 1.300 peak 3313 spectrum 1 weight 0.10000E+01 volume 0.13770E-02 ppm1 3.393 ppm2 9.277 CV 1
ASSI { 3314}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 12 and name HB2 ))
2.900 1.000 1.000 peak 3314 spectrum 1 weight 0.10000E+01 volume 0.22650E-02 ppm1 3.392 ppm2 2.129 CV 1
ASSI { 3322}
(( segid " " and resid 74 and name HB ))
(( segid " " and resid 71 and name HA1 ))
4.500 2.500 1.500 peak 3322 spectrum 1 weight 0.10000E+01 volume 0.17295E-02 ppm1 4.199 ppm2 3.808 CV 1
ASSI { 3331}
(( segid " " and resid 34 and name HB ))
(( segid " " and resid 34 and name HN ))
3.200 1.300 1.300 peak 3331 spectrum 1 weight 0.10000E+01 volume 0.32941E-02 ppm1 4.110 ppm2 8.774 CV 1
ASSI { 3335}
(( segid " " and resid 69 and name HB ))
(( segid " " and resid 70 and name HB ))
4.700 2.800 1.300 peak 3335 spectrum 1 weight 0.10000E+01 volume 0.64712E-03 ppm1 4.372 ppm2 2.273 CV 1
ASSI { 3337}
(( segid " " and resid 69 and name HB ))
(( segid " " and resid 32 and name HA ))
3.400 1.500 1.500 peak 3337 spectrum 1 weight 0.10000E+01 volume 0.85919E-03 ppm1 4.368 ppm2 4.879 CV 1
ASSI { 3338}
(( segid " " and resid 69 and name HB ))
(( segid " " and resid 30 and name HA ))
3.200 1.300 1.300 peak 3338 spectrum 1 weight 0.10000E+01 volume 0.14454E-02 ppm1 4.369 ppm2 4.495 CV 1
ASSI { 3341}
(( segid " " and resid 69 and name HB ))
(( segid " " and resid 33 and name HN ))
4.500 2.500 1.500 peak 3341 spectrum 1 weight 0.10000E+01 volume 0.10803E-02 ppm1 4.370 ppm2 8.363 CV 1
ASSI { 3345}
(( segid " " and resid 69 and name HB ))
( segid " " and resid 67 and name HD1%)
4.100 2.100 1.900 peak 3345 spectrum 1 weight 0.10000E+01 volume 0.98018E-03 ppm1 4.370 ppm2 0.442 CV 1
ASSI { 3350}
(( segid " " and resid 5 and name HE21))
(( segid " " and resid 5 and name HG2 ))
2.800 1.000 1.000 peak 3350 spectrum 1 weight 0.10000E+01 volume 0.12553E-02 ppm1 6.849 ppm2 2.238 CV 1
set message=on echo=on end
!Ambiguous NOEs from ARIA1.2
ASSI { 13}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 12 and name HD2%)
5.800 4.200 0.200 peak 13 spectrum 1 weight 0.10000E+01 volume 0.23130E-03 ppm1 8.378 ppm2 0.866 CV 1
OR { 13}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 12 and name HD1%)
OR { 13}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 78 and name HD2%)
ASSI { 30}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HA ))
3.200 1.300 1.300 peak 30 spectrum 1 weight 0.10000E+01 volume 0.21419E-02 ppm1 8.735 ppm2 4.519 CV 1
OR { 30}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 67 and name HA ))
ASSI { 32}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HB1 ))
2.600 0.900 0.900 peak 32 spectrum 1 weight 0.10000E+01 volume 0.31895E-02 ppm1 8.736 ppm2 2.120 CV 1
OR { 32}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 67 and name HB2 ))
OR { 32}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HB2 ))
ASSI { 44}
(( segid " " and resid 5 and name HE22))
(( segid " " and resid 29 and name HB1 ))
5.400 3.700 0.600 peak 44 spectrum 1 weight 0.10000E+01 volume 0.23200E-03 ppm1 7.523 ppm2 1.462 CV 1
OR { 44}
(( segid " " and resid 5 and name HE22))
(( segid " " and resid 75 and name HD1 ))
ASSI { 118}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 53 and name HB2 ))
4.000 2.000 2.000 peak 118 spectrum 1 weight 0.10000E+01 volume 0.59429E-03 ppm1 7.762 ppm2 2.133 CV 1
OR { 118}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 81 and name HB1 ))
ASSI { 133}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 39 and name HG2%)
4.600 2.700 1.400 peak 133 spectrum 1 weight 0.10000E+01 volume 0.75012E-03 ppm1 7.438 ppm2 0.949 CV 1
OR { 133}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 19 and name HG2%)
ASSI { 134}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 22 and name HG12))
4.000 2.000 2.000 peak 134 spectrum 1 weight 0.10000E+01 volume 0.34615E-03 ppm1 7.439 ppm2 1.306 CV 1
OR { 134}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 34 and name HG2%)
ASSI { 159}
(( segid " " and resid 17 and name HD22))
(( segid " " and resid 21 and name HA1 ))
5.500 3.700 0.500 peak 159 spectrum 1 weight 0.10000E+01 volume 0.27727E-03 ppm1 8.073 ppm2 3.957 CV 1
OR { 159}
(( segid " " and resid 17 and name HD22))
(( segid " " and resid 14 and name HA ))
ASSI { 160}
(( segid " " and resid 17 and name HD21))
(( segid " " and resid 21 and name HA1 ))
5.300 3.500 0.700 peak 160 spectrum 1 weight 0.10000E+01 volume 0.29165E-03 ppm1 6.858 ppm2 3.945 CV 1
OR { 160}
(( segid " " and resid 17 and name HD21))
(( segid " " and resid 14 and name HA ))
ASSI { 161}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HB2 ))
5.200 3.300 0.800 peak 161 spectrum 1 weight 0.10000E+01 volume 0.36698E-03 ppm1 8.468 ppm2 1.861 CV 1
OR { 161}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 44 and name HB1 ))
ASSI { 212}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 31 and name HG1 ))
4.600 2.600 1.400 peak 212 spectrum 1 weight 0.10000E+01 volume 0.64184E-03 ppm1 7.803 ppm2 1.456 CV 1
OR { 212}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 37 and name HG ))
ASSI { 215}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 31 and name HA ))
5.000 3.100 1.000 peak 215 spectrum 1 weight 0.10000E+01 volume 0.39962E-03 ppm1 7.805 ppm2 4.358 CV 1
OR { 215}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 38 and name HA ))
OR { 215}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 34 and name HA ))
ASSI { 235}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HA ))
3.400 1.400 1.400 peak 235 spectrum 1 weight 0.10000E+01 volume 0.13654E-02 ppm1 7.427 ppm2 3.078 CV 1
OR { 235}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 66 and name HB2 ))
ASSI { 256}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 12 and name HD2%)
3.800 1.800 1.800 peak 256 spectrum 1 weight 0.10000E+01 volume 0.17822E-02 ppm1 8.656 ppm2 0.836 CV 1
OR { 256}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 29 and name HD1%)
OR { 256}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 78 and name HD1%)
OR { 256}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 78 and name HD2%)
ASSI { 265}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
2.800 1.000 1.000 peak 265 spectrum 1 weight 0.10000E+01 volume 0.12625E-02 ppm1 7.312 ppm2 2.298 CV 1
OR { 265}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 70 and name HB ))
ASSI { 267}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 38 and name HA ))
4.900 3.000 1.100 peak 267 spectrum 1 weight 0.10000E+01 volume 0.41975E-03 ppm1 7.307 ppm2 4.342 CV 1
OR { 267}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 34 and name HA ))
OR { 267}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 69 and name HB ))
ASSI { 268}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 39 and name HG2%)
5.900 4.400 0.100 peak 268 spectrum 1 weight 0.10000E+01 volume 0.23513E-03 ppm1 7.307 ppm2 0.953 CV 1
OR { 268}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 27 and name HG2%)
OR { 268}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 48 and name HG2%)
ASSI { 291}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 51 and name HB% )
3.700 1.700 1.700 peak 291 spectrum 1 weight 0.10000E+01 volume 0.12722E-02 ppm1 7.594 ppm2 1.543 CV 1
OR { 291}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 50 and name HB% )
OR { 291}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 59 and name HG12))
ASSI { 299}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HB ))
4.900 3.100 1.100 peak 299 spectrum 1 weight 0.10000E+01 volume 0.30332E-03 ppm1 6.921 ppm2 1.654 CV 1
OR { 299}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 19 and name HG12))
OR { 299}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 19 and name HB ))
ASSI { 305}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 43 and name HA ))
3.300 1.400 1.400 peak 305 spectrum 1 weight 0.10000E+01 volume 0.16103E-02 ppm1 6.927 ppm2 4.309 CV 1
OR { 305}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 42 and name HA ))
ASSI { 306}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 45 and name HG2%)
4.000 2.000 2.000 peak 306 spectrum 1 weight 0.10000E+01 volume 0.13694E-02 ppm1 6.926 ppm2 1.117 CV 1
OR { 306}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 49 and name HG2%)
ASSI { 307}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 45 and name HG1%)
3.400 1.500 1.500 peak 307 spectrum 1 weight 0.10000E+01 volume 0.25148E-02 ppm1 6.927 ppm2 0.954 CV 1
OR { 307}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 47 and name HG2%)
OR { 307}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 48 and name HG2%)
OR { 307}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 39 and name HG2%)
ASSI { 310}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HA ))
2.800 1.000 1.000 peak 310 spectrum 1 weight 0.10000E+01 volume 0.33806E-02 ppm1 6.927 ppm2 4.044 CV 1
OR { 310}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 44 and name HA ))
ASSI { 343}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HD1 ))
3.200 1.200 1.200 peak 343 spectrum 1 weight 0.10000E+01 volume 0.51330E-02 ppm1 7.496 ppm2 1.368 CV 1
OR { 343}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 28 and name HD1 ))
ASSI { 345}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 37 and name HD2%)
5.100 3.200 0.900 peak 345 spectrum 1 weight 0.10000E+01 volume 0.36468E-03 ppm1 7.496 ppm2 0.771 CV 1
OR { 345}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 27 and name HG1%)
ASSI { 378}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HD1 ))
4.700 2.800 1.300 peak 378 spectrum 1 weight 0.10000E+01 volume 0.83489E-03 ppm1 10.104 ppm2 1.379 CV 1
OR { 378}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 22 and name HG11))
ASSI { 401}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HG12))
5.200 3.400 0.800 peak 401 spectrum 1 weight 0.10000E+01 volume 0.40663E-03 ppm1 7.822 ppm2 1.970 CV 1
OR { 401}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 12 and name HG ))
ASSI { 423}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HA ))
3.800 1.800 1.800 peak 423 spectrum 1 weight 0.10000E+01 volume 0.73172E-03 ppm1 7.982 ppm2 4.353 CV 1
OR { 423}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 38 and name HA ))
OR { 423}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 31 and name HA ))
ASSI { 426}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 39 and name HG2%)
4.500 2.600 1.500 peak 426 spectrum 1 weight 0.10000E+01 volume 0.80976E-03 ppm1 8.397 ppm2 0.947 CV 1
OR { 426}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 19 and name HG2%)
OR { 426}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 48 and name HG2%)
ASSI { 428}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 32 and name HB2 ))
2.700 0.900 0.900 peak 428 spectrum 1 weight 0.10000E+01 volume 0.44048E-02 ppm1 7.978 ppm2 4.107 CV 1
OR { 428}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 73 and name HA ))
OR { 428}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HB ))
ASSI { 440}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 67 and name HD2%)
4.000 2.000 2.000 peak 440 spectrum 1 weight 0.10000E+01 volume 0.15823E-02 ppm1 7.965 ppm2 0.538 CV 1
OR { 440}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 77 and name HG2%)
OR { 440}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 8 and name HG2%)
ASSI { 441}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HD1 ))
4.200 2.300 1.800 peak 441 spectrum 1 weight 0.10000E+01 volume 0.98173E-03 ppm1 7.965 ppm2 1.477 CV 1
OR { 441}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 31 and name HG1 ))
OR { 441}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 37 and name HG ))
ASSI { 447}
(( segid " " and resid 35 and name HN ))
( segid " " and resid 70 and name HG1%)
4.900 3.000 1.100 peak 447 spectrum 1 weight 0.10000E+01 volume 0.29897E-03 ppm1 7.966 ppm2 0.420 CV 1
OR { 447}
(( segid " " and resid 35 and name HN ))
( segid " " and resid 67 and name HD1%)
ASSI { 462}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HA ))
3.400 1.400 1.400 peak 462 spectrum 1 weight 0.10000E+01 volume 0.13993E-02 ppm1 8.159 ppm2 3.950 CV 1
OR { 462}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 51 and name HA ))
ASSI { 498}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 12 and name HD2%)
3.700 1.700 1.700 peak 498 spectrum 1 weight 0.10000E+01 volume 0.22792E-02 ppm1 8.183 ppm2 0.862 CV 1
OR { 498}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 12 and name HD1%)
OR { 498}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 54 and name HG2 ))
OR { 498}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 59 and name HG11))
ASSI { 503}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 50 and name HB% )
5.000 3.100 1.000 peak 503 spectrum 1 weight 0.10000E+01 volume 0.42080E-03 ppm1 8.184 ppm2 1.540 CV 1
OR { 503}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 51 and name HB% )
ASSI { 526}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 19 and name HG2%)
3.700 1.700 1.700 peak 526 spectrum 1 weight 0.10000E+01 volume 0.15519E-02 ppm1 8.692 ppm2 0.966 CV 1
OR { 526}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 39 and name HG2%)
ASSI { 579}
(( segid " " and resid 7 and name HN ))
( segid " " and resid 3 and name HB% )
4.400 2.500 1.600 peak 579 spectrum 1 weight 0.10000E+01 volume 0.84753E-03 ppm1 7.694 ppm2 1.542 CV 1
OR { 579}
(( segid " " and resid 7 and name HN ))
( segid " " and resid 10 and name HB% )
ASSI { 580}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HB1 ))
4.100 2.100 1.900 peak 580 spectrum 1 weight 0.10000E+01 volume 0.12152E-02 ppm1 7.695 ppm2 2.023 CV 1
OR { 580}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 9 and name HB ))
ASSI { 582}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HG2 ))
2.700 0.900 0.900 peak 582 spectrum 1 weight 0.10000E+01 volume 0.42293E-02 ppm1 7.695 ppm2 2.474 CV 1
OR { 582}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HG2 ))
ASSI { 589}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 16 and name HG1%)
4.400 2.400 1.600 peak 589 spectrum 1 weight 0.10000E+01 volume 0.86454E-03 ppm1 8.275 ppm2 0.997 CV 1
OR { 589}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 47 and name HG2%)
OR { 589}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 19 and name HG2%)
ASSI { 590}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HB ))
4.600 2.600 1.400 peak 590 spectrum 1 weight 0.10000E+01 volume 0.82922E-03 ppm1 8.273 ppm2 1.643 CV 1
OR { 590}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HG12))
OR { 590}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 47 and name HB ))
ASSI { 599}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 16 and name HG1%)
3.300 1.400 1.400 peak 599 spectrum 1 weight 0.10000E+01 volume 0.30735E-02 ppm1 8.688 ppm2 0.989 CV 1
OR { 599}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 22 and name HG2%)
OR { 599}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 48 and name HG2%)
OR { 599}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 47 and name HG2%)
OR { 599}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 24 and name HG1%)
ASSI { 610}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 22 and name HB ))
4.800 2.900 1.200 peak 610 spectrum 1 weight 0.10000E+01 volume 0.29775E-03 ppm1 8.689 ppm2 1.670 CV 1
OR { 610}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 19 and name HB ))
OR { 610}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 47 and name HB ))
ASSI { 615}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HA ))
3.700 1.700 1.700 peak 615 spectrum 1 weight 0.10000E+01 volume 0.71576E-03 ppm1 8.153 ppm2 3.680 CV 1
OR { 615}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 5 and name HA ))
ASSI { 616}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HB ))
2.600 0.800 0.800 peak 616 spectrum 1 weight 0.10000E+01 volume 0.39584E-02 ppm1 8.153 ppm2 4.187 CV 1
OR { 616}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 76 and name HA ))
ASSI { 623}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HG2 ))
4.800 2.800 1.200 peak 623 spectrum 1 weight 0.10000E+01 volume 0.32422E-03 ppm1 8.155 ppm2 1.766 CV 1
OR { 623}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 29 and name HG ))
OR { 623}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 78 and name HB2 ))
ASSI { 627}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 17 and name HD22))
5.100 3.200 0.900 peak 627 spectrum 1 weight 0.10000E+01 volume 0.35836E-03 ppm1 6.412 ppm2 8.104 CV 1
OR { 627}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 40 and name HN ))
ASSI { 629}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 17 and name HB2 ))
4.500 2.500 1.500 peak 629 spectrum 1 weight 0.10000E+01 volume 0.43244E-03 ppm1 6.413 ppm2 3.090 CV 1
OR { 629}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 36 and name HB2 ))
ASSI { 657}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HA ))
3.800 1.800 1.800 peak 657 spectrum 1 weight 0.10000E+01 volume 0.77881E-03 ppm1 8.469 ppm2 4.185 CV 1
OR { 657}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 74 and name HB ))
ASSI { 658}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 77 and name HG2%)
3.300 1.300 1.300 peak 658 spectrum 1 weight 0.10000E+01 volume 0.21637E-02 ppm1 8.517 ppm2 0.535 CV 1
OR { 658}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 8 and name HG2%)
ASSI { 659}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HB2 ))
2.400 0.700 0.700 peak 659 spectrum 1 weight 0.10000E+01 volume 0.51976E-02 ppm1 8.517 ppm2 1.785 CV 1
OR { 659}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HB ))
ASSI { 676}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HA ))
3.300 1.300 1.300 peak 676 spectrum 1 weight 0.10000E+01 volume 0.15339E-02 ppm1 7.812 ppm2 4.002 CV 1
OR { 676}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HA ))
ASSI { 683}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 29 and name HA ))
4.900 2.900 1.100 peak 683 spectrum 1 weight 0.10000E+01 volume 0.73108E-03 ppm1 8.076 ppm2 3.578 CV 1
OR { 683}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 27 and name HA ))
ASSI { 696}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 12 and name HD1%)
4.200 2.200 1.800 peak 696 spectrum 1 weight 0.10000E+01 volume 0.50851E-03 ppm1 8.969 ppm2 0.898 CV 1
OR { 696}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 9 and name HG1%)
ASSI { 704}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 67 and name HG ))
4.400 2.500 1.600 peak 704 spectrum 1 weight 0.10000E+01 volume 0.61195E-03 ppm1 7.578 ppm2 1.813 CV 1
OR { 704}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HB2 ))
OR { 704}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HB1 ))
ASSI { 719}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 39 and name HG1%)
3.300 1.400 1.400 peak 719 spectrum 1 weight 0.10000E+01 volume 0.18433E-02 ppm1 8.614 ppm2 0.825 CV 1
OR { 719}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 19 and name HD1%)
ASSI { 726}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 44 and name HA ))
2.900 1.100 1.100 peak 726 spectrum 1 weight 0.10000E+01 volume 0.31032E-02 ppm1 8.026 ppm2 4.027 CV 1
OR { 726}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 71 and name HA2 ))
OR { 726}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 46 and name HA ))
ASSI { 727}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 46 and name HB1 ))
3.800 1.800 1.800 peak 727 spectrum 1 weight 0.10000E+01 volume 0.15728E-02 ppm1 8.027 ppm2 2.183 CV 1
OR { 727}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 44 and name HG1 ))
ASSI { 734}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 15 and name HG2%)
4.100 2.100 1.900 peak 734 spectrum 1 weight 0.10000E+01 volume 0.66250E-03 ppm1 8.026 ppm2 1.111 CV 1
OR { 734}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 74 and name HG2%)
OR { 734}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 45 and name HG2%)
OR { 734}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 49 and name HG2%)
ASSI { 752}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 39 and name HG2%)
3.800 1.800 1.800 peak 752 spectrum 1 weight 0.10000E+01 volume 0.43901E-03 ppm1 8.615 ppm2 0.949 CV 1
OR { 752}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 19 and name HG2%)
OR { 752}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 48 and name HG2%)
ASSI { 794}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 42 and name HD1%)
4.800 2.900 1.200 peak 794 spectrum 1 weight 0.10000E+01 volume 0.77752E-03 ppm1 7.870 ppm2 0.930 CV 1
OR { 794}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 39 and name HG2%)
ASSI { 796}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
2.900 1.000 1.000 peak 796 spectrum 1 weight 0.10000E+01 volume 0.29700E-02 ppm1 7.869 ppm2 4.286 CV 1
OR { 796}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HA ))
ASSI { 800}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB1 ))
3.000 1.100 1.100 peak 800 spectrum 1 weight 0.10000E+01 volume 0.23752E-02 ppm1 7.750 ppm2 0.921 CV 1
OR { 800}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 64 and name HG2%)
ASSI { 807}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 45 and name HG2%)
3.700 3.700 2.300 peak 807 spectrum 1 weight 0.10000E+01 volume 0.28868E-03 ppm1 7.750 ppm2 1.123 CV 1
OR { 807}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 74 and name HG2%)
ASSI { 808}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 64 and name HA ))
3.700 1.700 1.700 peak 808 spectrum 1 weight 0.10000E+01 volume 0.19470E-02 ppm1 7.750 ppm2 3.080 CV 1
OR { 808}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HB2 ))
ASSI { 826}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HD1 ))
3.300 1.400 1.400 peak 826 spectrum 1 weight 0.10000E+01 volume 0.37495E-02 ppm1 6.307 ppm2 1.355 CV 1
OR { 826}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 22 and name HG11))
ASSI { 842}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 9 and name HG2%)
5.100 3.300 0.900 peak 842 spectrum 1 weight 0.10000E+01 volume 0.57441E-03 ppm1 8.401 ppm2 1.070 CV 1
OR { 842}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 74 and name HG2%)
ASSI { 844}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HG12))
3.400 1.400 1.400 peak 844 spectrum 1 weight 0.10000E+01 volume 0.36938E-02 ppm1 8.402 ppm2 1.527 CV 1
OR { 844}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 10 and name HB% )
ASSI { 851}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 5 and name HA ))
4.100 2.100 1.900 peak 851 spectrum 1 weight 0.10000E+01 volume 0.49439E-03 ppm1 8.402 ppm2 3.696 CV 1
OR { 851}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 74 and name HA ))
ASSI { 852}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 49 and name HN ))
4.300 2.400 1.700 peak 852 spectrum 1 weight 0.10000E+01 volume 0.36571E-03 ppm1 8.886 ppm2 8.178 CV 1
OR { 852}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 54 and name HN ))
ASSI { 853}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 48 and name HG1%)
4.300 2.300 1.700 peak 853 spectrum 1 weight 0.10000E+01 volume 0.31738E-03 ppm1 8.884 ppm2 0.637 CV 1
OR { 853}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 47 and name HG1%)
ASSI { 855}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 15 and name HG2%)
4.000 2.000 2.000 peak 855 spectrum 1 weight 0.10000E+01 volume 0.86879E-03 ppm1 8.885 ppm2 1.084 CV 1
OR { 855}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 49 and name HG2%)
OR { 855}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 15 and name HG11))
ASSI { 898}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 68 and name HB2 ))
4.700 2.700 1.300 peak 898 spectrum 1 weight 0.10000E+01 volume 0.23283E-03 ppm1 8.360 ppm2 2.121 CV 1
OR { 898}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 68 and name HB1 ))
OR { 898}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 900}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 70 and name HG1%)
5.100 3.200 0.900 peak 900 spectrum 1 weight 0.10000E+01 volume 0.37556E-03 ppm1 8.356 ppm2 0.440 CV 1
OR { 900}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 67 and name HD1%)
ASSI { 901}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 69 and name HB ))
4.800 2.800 1.200 peak 901 spectrum 1 weight 0.10000E+01 volume 0.74989E-03 ppm1 8.356 ppm2 4.363 CV 1
OR { 901}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 34 and name HA ))
ASSI { 911}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 37 and name HB2 ))
4.900 3.000 1.100 peak 911 spectrum 1 weight 0.10000E+01 volume 0.28852E-03 ppm1 8.354 ppm2 2.278 CV 1
OR { 911}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 70 and name HB ))
ASSI { 913}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 68 and name HA ))
4.100 2.100 1.900 peak 913 spectrum 1 weight 0.10000E+01 volume 0.37627E-03 ppm1 8.356 ppm2 4.530 CV 1
OR { 913}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 67 and name HA ))
ASSI { 922}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 56 and name HB1 ))
4.200 2.200 1.800 peak 922 spectrum 1 weight 0.10000E+01 volume 0.42635E-03 ppm1 8.323 ppm2 2.581 CV 1
OR { 922}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HG1 ))
ASSI { 19}
( segid " " and resid 73 and name HB% )
(( segid " " and resid 78 and name HG ))
3.100 3.100 2.900 peak 19 spectrum 1 weight 0.10000E+01 volume 0.34306E-02 ppm1 1.525 ppm2 1.629 CV 1
OR { 19}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 78 and name HG ))
ASSI { 25}
( segid " " and resid 73 and name HB% )
(( segid " " and resid 77 and name HA ))
3.800 1.800 1.800 peak 25 spectrum 1 weight 0.10000E+01 volume 0.82788E-03 ppm1 1.541 ppm2 3.553 CV 1
OR { 25}
( segid " " and resid 51 and name HB% )
(( segid " " and resid 77 and name HA ))
ASSI { 30}
( segid " " and resid 73 and name HB% )
( segid " " and resid 12 and name HD2%)
3.200 1.300 1.300 peak 30 spectrum 1 weight 0.10000E+01 volume 0.15264E-02 ppm1 1.538 ppm2 0.853 CV 1
OR { 30}
( segid " " and resid 73 and name HB% )
(( segid " " and resid 59 and name HG11))
OR { 30}
( segid " " and resid 73 and name HB% )
( segid " " and resid 78 and name HD2%)
OR { 30}
( segid " " and resid 10 and name HB% )
( segid " " and resid 12 and name HD2%)
ASSI { 51}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 54 and name HG2 ))
4.000 2.000 2.000 peak 51 spectrum 1 weight 0.10000E+01 volume 0.90038E-03 ppm1 1.555 ppm2 0.862 CV 1
OR { 51}
( segid " " and resid 50 and name HB% )
( segid " " and resid 12 and name HD2%)
OR { 51}
( segid " " and resid 50 and name HB% )
( segid " " and resid 12 and name HD1%)
ASSI { 62}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 2 and name HN ))
2.900 1.000 1.000 peak 62 spectrum 1 weight 0.10000E+01 volume 0.30860E-02 ppm1 1.520 ppm2 7.707 CV 1
OR { 62}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 81 and name HE22))
ASSI { 65}
( segid " " and resid 2 and name HB% )
(( segid " " and resid 81 and name HG2 ))
4.200 2.200 1.800 peak 65 spectrum 1 weight 0.10000E+01 volume 0.78416E-03 ppm1 1.521 ppm2 2.714 CV 1
OR { 65}
( segid " " and resid 50 and name HB% )
(( segid " " and resid 54 and name HD1 ))
ASSI { 72}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 81 and name HE22))
3.500 1.600 1.600 peak 72 spectrum 1 weight 0.10000E+01 volume 0.18800E-02 ppm1 1.571 ppm2 7.711 CV 1
OR { 72}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 7 and name HN ))
ASSI { 79}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 8 and name HA ))
3.400 1.400 1.400 peak 79 spectrum 1 weight 0.10000E+01 volume 0.10836E-02 ppm1 1.569 ppm2 3.871 CV 1
OR { 79}
( segid " " and resid 3 and name HB% )
(( segid " " and resid 11 and name HA1 ))
ASSI { 88}
( segid " " and resid 20 and name HB% )
( segid " " and resid 16 and name HG1%)
2.400 0.700 0.700 peak 88 spectrum 1 weight 0.10000E+01 volume 0.99538E-02 ppm1 1.548 ppm2 1.003 CV 1
OR { 88}
( segid " " and resid 20 and name HB% )
( segid " " and resid 22 and name HG2%)
ASSI { 92}
( segid " " and resid 20 and name HB% )
( segid " " and resid 39 and name HG2%)
2.200 2.200 3.800 peak 92 spectrum 1 weight 0.10000E+01 volume 0.12084E-01 ppm1 1.549 ppm2 0.952 CV 1
OR { 92}
( segid " " and resid 20 and name HB% )
( segid " " and resid 27 and name HG2%)
OR { 92}
( segid " " and resid 20 and name HB% )
( segid " " and resid 48 and name HG2%)
ASSI { 97}
( segid " " and resid 20 and name HB% )
(( segid " " and resid 16 and name HA ))
4.000 2.000 2.000 peak 97 spectrum 1 weight 0.10000E+01 volume 0.11435E-02 ppm1 1.548 ppm2 3.565 CV 1
OR { 97}
( segid " " and resid 20 and name HB% )
(( segid " " and resid 27 and name HA ))
ASSI { 109}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 33 and name HB1 ))
3.500 1.500 1.500 peak 109 spectrum 1 weight 0.10000E+01 volume 0.99409E-03 ppm1 1.304 ppm2 3.147 CV 1
OR { 109}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 68 and name HE1 ))
OR { 109}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 68 and name HE2 ))
ASSI { 111}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 75 and name HD1 ))
3.100 3.100 2.900 peak 111 spectrum 1 weight 0.10000E+01 volume 0.59290E-02 ppm1 1.374 ppm2 1.479 CV 1
OR { 111}
( segid " " and resid 4 and name HG2%)
(( segid " " and resid 29 and name HB1 ))
ASSI { 132}
(( segid " " and resid 60 and name HG2 ))
(( segid " " and resid 63 and name HN ))
4.700 2.700 1.300 peak 132 spectrum 1 weight 0.10000E+01 volume 0.70857E-03 ppm1 2.019 ppm2 7.565 CV 1
OR { 132}
(( segid " " and resid 60 and name HG2 ))
(( segid " " and resid 64 and name HN ))
ASSI { 151}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 24 and name HG2%)
4.200 2.200 1.800 peak 151 spectrum 1 weight 0.10000E+01 volume 0.82654E-03 ppm1 2.014 ppm2 1.011 CV 1
OR { 151}
(( segid " " and resid 25 and name HB1 ))
( segid " " and resid 24 and name HG2%)
OR { 151}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 22 and name HG2%)
ASSI { 153}
(( segid " " and resid 81 and name HB1 ))
( segid " " and resid 57 and name HG2%)
4.000 2.000 2.000 peak 153 spectrum 1 weight 0.10000E+01 volume 0.11451E-02 ppm1 2.144 ppm2 1.005 CV 1
OR { 153}
(( segid " " and resid 23 and name HG2 ))
( segid " " and resid 22 and name HG2%)
OR { 153}
(( segid " " and resid 23 and name HG2 ))
( segid " " and resid 24 and name HG2%)
ASSI { 157}
(( segid " " and resid 81 and name HB1 ))
(( segid " " and resid 81 and name HG2 ))
2.900 1.000 1.000 peak 157 spectrum 1 weight 0.10000E+01 volume 0.19209E-02 ppm1 2.148 ppm2 2.712 CV 1
OR { 157}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 26 and name HB2 ))
ASSI { 162}
(( segid " " and resid 81 and name HB1 ))
(( segid " " and resid 81 and name HB2 ))
1.800 0.400 0.400 peak 162 spectrum 1 weight 0.10000E+01 volume 0.12317E-01 ppm1 2.150 ppm2 2.353 CV 1
OR { 162}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 23 and name HB2 ))
ASSI { 172}
(( segid " " and resid 5 and name HB1 ))
( segid " " and resid 78 and name HD1%)
4.100 2.100 1.900 peak 172 spectrum 1 weight 0.10000E+01 volume 0.16848E-02 ppm1 2.064 ppm2 0.828 CV 1
OR { 172}
(( segid " " and resid 5 and name HB1 ))
( segid " " and resid 29 and name HD1%)
OR { 172}
(( segid " " and resid 5 and name HB1 ))
( segid " " and resid 78 and name HD2%)
ASSI { 175}
(( segid " " and resid 5 and name HB2 ))
( segid " " and resid 78 and name HD1%)
3.100 1.200 1.200 peak 175 spectrum 1 weight 0.10000E+01 volume 0.20299E-02 ppm1 2.204 ppm2 0.827 CV 1
OR { 175}
(( segid " " and resid 5 and name HB2 ))
( segid " " and resid 29 and name HD1%)
OR { 175}
(( segid " " and resid 5 and name HB2 ))
( segid " " and resid 78 and name HD2%)
ASSI { 180}
(( segid " " and resid 81 and name HB2 ))
( segid " " and resid 57 and name HG1%)
2.800 2.800 3.200 peak 180 spectrum 1 weight 0.10000E+01 volume 0.89129E-03 ppm1 2.350 ppm2 0.966 CV 1
OR { 180}
(( segid " " and resid 81 and name HB2 ))
(( segid " " and resid 77 and name HG12))
ASSI { 213}
(( segid " " and resid 46 and name HB1 ))
( segid " " and resid 47 and name HG2%)
3.000 1.100 1.100 peak 213 spectrum 1 weight 0.10000E+01 volume 0.20734E-02 ppm1 2.161 ppm2 0.969 CV 1
OR { 213}
(( segid " " and resid 18 and name HB1 ))
( segid " " and resid 47 and name HG2%)
OR { 213}
(( segid " " and resid 46 and name HB1 ))
( segid " " and resid 48 and name HG2%)
ASSI { 219}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
2.800 1.000 1.000 peak 219 spectrum 1 weight 0.10000E+01 volume 0.27818E-02 ppm1 2.360 ppm2 4.054 CV 1
OR { 219}
(( segid " " and resid 27 and name HB ))
(( segid " " and resid 13 and name HA ))
ASSI { 222}
(( segid " " and resid 46 and name HB1 ))
( segid " " and resid 19 and name HD1%)
3.300 1.400 1.400 peak 222 spectrum 1 weight 0.10000E+01 volume 0.27945E-02 ppm1 2.162 ppm2 0.797 CV 1
OR { 222}
(( segid " " and resid 18 and name HB1 ))
( segid " " and resid 19 and name HD1%)
ASSI { 223}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 19 and name HG11))
3.600 1.600 1.600 peak 223 spectrum 1 weight 0.10000E+01 volume 0.74196E-03 ppm1 2.163 ppm2 1.348 CV 1
OR { 223}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 19 and name HG11))
ASSI { 226}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 18 and name HA ))
2.900 1.000 1.000 peak 226 spectrum 1 weight 0.10000E+01 volume 0.37214E-02 ppm1 2.173 ppm2 3.958 CV 1
OR { 226}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 54 and name HA ))
OR { 226}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 47 and name HA ))
OR { 226}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 19 and name HA ))
ASSI { 227}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 19 and name HD1%)
4.300 2.300 1.700 peak 227 spectrum 1 weight 0.10000E+01 volume 0.13052E-02 ppm1 2.347 ppm2 0.791 CV 1
OR { 227}
(( segid " " and resid 27 and name HB ))
( segid " " and resid 37 and name HD2%)
ASSI { 228}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 18 and name HG1 ))
2.800 1.000 1.000 peak 228 spectrum 1 weight 0.10000E+01 volume 0.37448E-02 ppm1 2.306 ppm2 2.497 CV 1
OR { 228}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HG2 ))
OR { 228}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 18 and name HG2 ))
ASSI { 230}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 19 and name HG12))
3.200 1.300 1.300 peak 230 spectrum 1 weight 0.10000E+01 volume 0.20191E-02 ppm1 2.176 ppm2 1.626 CV 1
OR { 230}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 19 and name HG12))
ASSI { 232}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 15 and name HA ))
3.500 1.500 1.500 peak 232 spectrum 1 weight 0.10000E+01 volume 0.10539E-02 ppm1 2.306 ppm2 3.799 CV 1
OR { 232}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 15 and name HA ))
ASSI { 233}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 19 and name HG12))
3.500 1.500 1.500 peak 233 spectrum 1 weight 0.10000E+01 volume 0.20944E-02 ppm1 2.303 ppm2 1.626 CV 1
OR { 233}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 19 and name HG12))
ASSI { 235}
(( segid " " and resid 14 and name HB2 ))
( segid " " and resid 10 and name HB% )
3.000 3.000 3.000 peak 235 spectrum 1 weight 0.10000E+01 volume 0.23150E-02 ppm1 2.305 ppm2 1.526 CV 1
OR { 235}
(( segid " " and resid 14 and name HB2 ))
( segid " " and resid 51 and name HB% )
OR { 235}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 51 and name HB% )
OR { 235}
(( segid " " and resid 27 and name HB ))
( segid " " and resid 73 and name HB% )
OR { 235}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 51 and name HB% )
ASSI { 238}
(( segid " " and resid 14 and name HB1 ))
( segid " " and resid 10 and name HB% )
3.500 1.600 1.600 peak 238 spectrum 1 weight 0.10000E+01 volume 0.13821E-02 ppm1 2.242 ppm2 1.532 CV 1
OR { 238}
(( segid " " and resid 14 and name HB1 ))
( segid " " and resid 51 and name HB% )
OR { 238}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 20 and name HB% )
OR { 238}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 51 and name HB% )
ASSI { 244}
(( segid " " and resid 27 and name HB ))
( segid " " and resid 27 and name HG2%)
2.300 0.700 0.700 peak 244 spectrum 1 weight 0.10000E+01 volume 0.69561E-02 ppm1 2.346 ppm2 0.951 CV 1
OR { 244}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 47 and name HG2%)
ASSI { 245}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 51 and name HB% )
3.800 1.900 1.900 peak 245 spectrum 1 weight 0.10000E+01 volume 0.23411E-02 ppm1 2.170 ppm2 1.513 CV 1
OR { 245}
(( segid " " and resid 18 and name HB1 ))
( segid " " and resid 51 and name HB% )
OR { 245}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 59 and name HG12))
OR { 245}
(( segid " " and resid 46 and name HB1 ))
( segid " " and resid 51 and name HB% )
ASSI { 259}
(( segid " " and resid 52 and name HB1 ))
( segid " " and resid 57 and name HG1%)
3.000 1.100 1.100 peak 259 spectrum 1 weight 0.10000E+01 volume 0.35141E-02 ppm1 2.166 ppm2 0.958 CV 1
OR { 259}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 77 and name HG12))
OR { 259}
(( segid " " and resid 18 and name HB1 ))
( segid " " and resid 47 and name HG2%)
ASSI { 341}
(( segid " " and resid 48 and name HB ))
(( segid " " and resid 44 and name HA ))
3.200 1.300 1.300 peak 341 spectrum 1 weight 0.10000E+01 volume 0.20334E-02 ppm1 2.383 ppm2 4.027 CV 1
OR { 341}
(( segid " " and resid 48 and name HB ))
(( segid " " and resid 65 and name HA ))
ASSI { 355}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 27 and name HG2%)
3.200 1.300 1.300 peak 355 spectrum 1 weight 0.10000E+01 volume 0.15414E-02 ppm1 2.262 ppm2 0.946 CV 1
OR { 355}
(( segid " " and resid 70 and name HB ))
( segid " " and resid 27 and name HG2%)
OR { 355}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 39 and name HG2%)
ASSI { 366}
(( segid " " and resid 64 and name HB ))
( segid " " and resid 49 and name HG1%)
2.800 1.000 1.000 peak 366 spectrum 1 weight 0.10000E+01 volume 0.39486E-02 ppm1 2.063 ppm2 1.001 CV 1
OR { 366}
(( segid " " and resid 9 and name HB ))
( segid " " and resid 24 and name HG1%)
OR { 366}
(( segid " " and resid 9 and name HB ))
( segid " " and resid 22 and name HG2%)
OR { 366}
(( segid " " and resid 9 and name HB ))
( segid " " and resid 16 and name HG1%)
ASSI { 372}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 46 and name HN ))
3.200 1.300 1.300 peak 372 spectrum 1 weight 0.10000E+01 volume 0.16399E-02 ppm1 2.232 ppm2 6.955 CV 1
OR { 372}
(( segid " " and resid 70 and name HB ))
( segid " " and resid 33 and name HE% )
OR { 372}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 33 and name HE% )
ASSI { 375}
(( segid " " and resid 45 and name HB ))
( segid " " and resid 45 and name HG2%)
2.400 0.700 0.700 peak 375 spectrum 1 weight 0.10000E+01 volume 0.52239E-02 ppm1 2.235 ppm2 1.119 CV 1
OR { 375}
(( segid " " and resid 45 and name HB ))
( segid " " and resid 49 and name HG2%)
ASSI { 378}
(( segid " " and resid 39 and name HB ))
( segid " " and resid 20 and name HB% )
3.900 1.900 1.900 peak 378 spectrum 1 weight 0.10000E+01 volume 0.80150E-03 ppm1 2.024 ppm2 1.534 CV 1
OR { 378}
(( segid " " and resid 9 and name HB ))
( segid " " and resid 10 and name HB% )
OR { 378}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 8 and name HG12))
OR { 378}
(( segid " " and resid 39 and name HB ))
( segid " " and resid 73 and name HB% )
ASSI { 384}
(( segid " " and resid 64 and name HB ))
( segid " " and resid 64 and name HG2%)
2.300 0.700 0.700 peak 384 spectrum 1 weight 0.10000E+01 volume 0.49024E-02 ppm1 2.070 ppm2 0.936 CV 1
OR { 384}
(( segid " " and resid 64 and name HB ))
( segid " " and resid 45 and name HG1%)
ASSI { 400}
(( segid " " and resid 70 and name HB ))
( segid " " and resid 27 and name HG1%)
3.500 1.600 1.600 peak 400 spectrum 1 weight 0.10000E+01 volume 0.24780E-02 ppm1 2.266 ppm2 0.752 CV 1
OR { 400}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 27 and name HG1%)
ASSI { 410}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 31 and name HG2 ))
3.300 1.400 1.400 peak 410 spectrum 1 weight 0.10000E+01 volume 0.28676E-02 ppm1 2.235 ppm2 1.566 CV 1
OR { 410}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 20 and name HB% )
ASSI { 412}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 37 and name HG ))
2.300 0.600 0.600 peak 412 spectrum 1 weight 0.10000E+01 volume 0.61380E-02 ppm1 2.235 ppm2 1.476 CV 1
OR { 412}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 31 and name HG1 ))
OR { 412}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 37 and name HG ))
ASSI { 426}
(( segid " " and resid 45 and name HB ))
( segid " " and resid 45 and name HG1%)
2.200 0.600 0.600 peak 426 spectrum 1 weight 0.10000E+01 volume 0.90029E-02 ppm1 2.236 ppm2 0.965 CV 1
OR { 426}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 27 and name HG2%)
OR { 426}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 48 and name HG2%)
ASSI { 450}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 11 and name HN ))
3.500 3.500 2.500 peak 450 spectrum 1 weight 0.10000E+01 volume 0.27443E-02 ppm1 2.062 ppm2 8.372 CV 1
OR { 450}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 33 and name HN ))
ASSI { 451}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 62 and name HA ))
4.600 2.700 1.400 peak 451 spectrum 1 weight 0.10000E+01 volume 0.68694E-03 ppm1 2.064 ppm2 4.326 CV 1
OR { 451}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 23 and name HA ))
ASSI { 453}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 25 and name HN ))
3.100 1.200 1.200 peak 453 spectrum 1 weight 0.10000E+01 volume 0.25304E-02 ppm1 2.061 ppm2 9.262 CV 1
OR { 453}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 12 and name HN ))
ASSI { 454}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HG2 ))
2.300 0.700 0.700 peak 454 spectrum 1 weight 0.10000E+01 volume 0.43223E-02 ppm1 2.067 ppm2 1.569 CV 1
OR { 454}
(( segid " " and resid 49 and name HB ))
( segid " " and resid 50 and name HB% )
ASSI { 461}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 24 and name HG1%)
4.100 2.100 1.900 peak 461 spectrum 1 weight 0.10000E+01 volume 0.10346E-02 ppm1 2.370 ppm2 1.010 CV 1
OR { 461}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 22 and name HG2%)
OR { 461}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 24 and name HG2%)
ASSI { 489}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 36 and name HB1 ))
4.700 2.700 1.300 peak 489 spectrum 1 weight 0.10000E+01 volume 0.58313E-03 ppm1 1.392 ppm2 2.709 CV 1
OR { 489}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 26 and name HB2 ))
ASSI { 494}
(( segid " " and resid 31 and name HD2 ))
( segid " " and resid 37 and name HD2%)
3.400 1.500 1.500 peak 494 spectrum 1 weight 0.10000E+01 volume 0.26963E-02 ppm1 2.074 ppm2 0.770 CV 1
OR { 494}
(( segid " " and resid 49 and name HB ))
( segid " " and resid 64 and name HG1%)
ASSI { 496}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 31 and name HG1 ))
2.600 0.800 0.800 peak 496 spectrum 1 weight 0.10000E+01 volume 0.17301E-02 ppm1 1.390 ppm2 1.477 CV 1
OR { 496}
(( segid " " and resid 31 and name HD1 ))
(( segid " " and resid 37 and name HG ))
ASSI { 499}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 31 and name HG1 ))
3.100 1.200 1.200 peak 499 spectrum 1 weight 0.10000E+01 volume 0.13695E-02 ppm1 2.079 ppm2 1.476 CV 1
OR { 499}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 37 and name HG ))
ASSI { 570}
(( segid " " and resid 5 and name HG2 ))
( segid " " and resid 29 and name HD1%)
3.200 1.300 1.300 peak 570 spectrum 1 weight 0.10000E+01 volume 0.18516E-02 ppm1 2.246 ppm2 0.824 CV 1
OR { 570}
(( segid " " and resid 5 and name HG2 ))
( segid " " and resid 78 and name HD1%)
ASSI { 603}
(( segid " " and resid 18 and name HG1 ))
(( segid " " and resid 19 and name HG12))
3.800 1.900 1.900 peak 603 spectrum 1 weight 0.10000E+01 volume 0.12518E-02 ppm1 2.507 ppm2 1.627 CV 1
OR { 603}
(( segid " " and resid 18 and name HG2 ))
(( segid " " and resid 19 and name HG12))
OR { 603}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 19 and name HG12))
ASSI { 605}
(( segid " " and resid 18 and name HG2 ))
(( segid " " and resid 18 and name HA ))
3.400 1.400 1.400 peak 605 spectrum 1 weight 0.10000E+01 volume 0.16832E-02 ppm1 2.504 ppm2 3.959 CV 1
OR { 605}
(( segid " " and resid 18 and name HG1 ))
(( segid " " and resid 18 and name HA ))
OR { 605}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 47 and name HA ))
OR { 605}
(( segid " " and resid 18 and name HG2 ))
(( segid " " and resid 19 and name HA ))
ASSI { 606}
(( segid " " and resid 46 and name HG1 ))
(( segid " " and resid 46 and name HB1 ))
2.400 0.700 0.700 peak 606 spectrum 1 weight 0.10000E+01 volume 0.63381E-02 ppm1 2.308 ppm2 2.168 CV 1
OR { 606}
(( segid " " and resid 53 and name HG1 ))
(( segid " " and resid 53 and name HB2 ))
ASSI { 608}
(( segid " " and resid 53 and name HG2 ))
(( segid " " and resid 53 and name HB2 ))
2.600 0.800 0.800 peak 608 spectrum 1 weight 0.10000E+01 volume 0.54858E-02 ppm1 2.489 ppm2 2.167 CV 1
OR { 608}
(( segid " " and resid 18 and name HG2 ))
(( segid " " and resid 18 and name HB1 ))
OR { 608}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 46 and name HB1 ))
OR { 608}
(( segid " " and resid 18 and name HG1 ))
(( segid " " and resid 18 and name HB1 ))
ASSI { 609}
(( segid " " and resid 46 and name HG2 ))
( segid " " and resid 47 and name HG2%)
3.500 1.600 1.600 peak 609 spectrum 1 weight 0.10000E+01 volume 0.98445E-03 ppm1 2.460 ppm2 0.957 CV 1
OR { 609}
(( segid " " and resid 46 and name HG2 ))
( segid " " and resid 45 and name HG1%)
ASSI { 618}
( segid " " and resid 59 and name HG2%)
(( segid " " and resid 77 and name HG12))
2.700 0.900 0.900 peak 618 spectrum 1 weight 0.10000E+01 volume 0.31038E-02 ppm1 0.622 ppm2 0.947 CV 1
OR { 618}
( segid " " and resid 59 and name HG2%)
( segid " " and resid 57 and name HG1%)
OR { 618}
( segid " " and resid 59 and name HG2%)
( segid " " and resid 64 and name HG2%)
ASSI { 631}
(( segid " " and resid 18 and name HG2 ))
(( segid " " and resid 18 and name HA ))
3.500 1.500 1.500 peak 631 spectrum 1 weight 0.10000E+01 volume 0.13303E-02 ppm1 2.496 ppm2 3.955 CV 1
OR { 631}
(( segid " " and resid 18 and name HG1 ))
(( segid " " and resid 18 and name HA ))
OR { 631}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 47 and name HA ))
ASSI { 632}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 7 and name HA ))
3.200 1.300 1.300 peak 632 spectrum 1 weight 0.10000E+01 volume 0.13886E-02 ppm1 2.468 ppm2 4.149 CV 1
OR { 632}
(( segid " " and resid 53 and name HG2 ))
(( segid " " and resid 53 and name HA ))
ASSI { 633}
(( segid " " and resid 53 and name HG1 ))
(( segid " " and resid 53 and name HA ))
3.600 1.600 1.600 peak 633 spectrum 1 weight 0.10000E+01 volume 0.13178E-02 ppm1 2.288 ppm2 4.146 CV 1
OR { 633}
(( segid " " and resid 7 and name HG1 ))
(( segid " " and resid 7 and name HA ))
ASSI { 634}
(( segid " " and resid 53 and name HG1 ))
( segid " " and resid 49 and name HG1%)
3.100 1.200 1.200 peak 634 spectrum 1 weight 0.10000E+01 volume 0.14883E-02 ppm1 2.298 ppm2 1.004 CV 1
OR { 634}
(( segid " " and resid 25 and name HG2 ))
( segid " " and resid 24 and name HG2%)
OR { 634}
(( segid " " and resid 25 and name HG1 ))
( segid " " and resid 24 and name HG2%)
ASSI { 635}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 23 and name HB1 ))
4.100 2.100 1.900 peak 635 spectrum 1 weight 0.10000E+01 volume 0.92312E-03 ppm1 2.302 ppm2 1.767 CV 1
OR { 635}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 23 and name HB1 ))
OR { 635}
(( segid " " and resid 7 and name HG1 ))
(( segid " " and resid 8 and name HB ))
ASSI { 637}
(( segid " " and resid 14 and name HG1 ))
(( segid " " and resid 14 and name HA ))
2.900 1.100 1.100 peak 637 spectrum 1 weight 0.10000E+01 volume 0.24387E-02 ppm1 2.341 ppm2 3.957 CV 1
OR { 637}
(( segid " " and resid 46 and name HG1 ))
(( segid " " and resid 47 and name HA ))
ASSI { 644}
(( segid " " and resid 46 and name HG1 ))
( segid " " and resid 47 and name HG2%)
3.600 1.700 1.700 peak 644 spectrum 1 weight 0.10000E+01 volume 0.11790E-02 ppm1 2.319 ppm2 0.974 CV 1
OR { 644}
(( segid " " and resid 53 and name HG1 ))
( segid " " and resid 57 and name HG1%)
OR { 644}
(( segid " " and resid 14 and name HG1 ))
( segid " " and resid 24 and name HG1%)
ASSI { 686}
(( segid " " and resid 52 and name HG1 ))
(( segid " " and resid 54 and name HG2 ))
4.200 2.200 1.800 peak 686 spectrum 1 weight 0.10000E+01 volume 0.92704E-03 ppm1 2.388 ppm2 0.854 CV 1
OR { 686}
(( segid " " and resid 52 and name HG1 ))
(( segid " " and resid 59 and name HG11))
OR { 686}
(( segid " " and resid 52 and name HG1 ))
( segid " " and resid 12 and name HD2%)
ASSI { 690}
(( segid " " and resid 52 and name HG2 ))
( segid " " and resid 12 and name HD2%)
3.700 1.700 1.700 peak 690 spectrum 1 weight 0.10000E+01 volume 0.14509E-02 ppm1 2.876 ppm2 0.853 CV 1
OR { 690}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 59 and name HG11))
OR { 690}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 54 and name HG2 ))
ASSI { 708}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 12 and name HA ))
3.000 1.100 1.100 peak 708 spectrum 1 weight 0.10000E+01 volume 0.56302E-02 ppm1 0.765 ppm2 4.260 CV 1
OR { 708}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 50 and name HA ))
ASSI { 710}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 54 and name HG2 ))
2.900 1.100 1.100 peak 710 spectrum 1 weight 0.10000E+01 volume 0.98021E-02 ppm1 0.765 ppm2 0.866 CV 1
OR { 710}
( segid " " and resid 15 and name HD1%)
( segid " " and resid 12 and name HD2%)
OR { 710}
( segid " " and resid 15 and name HD1%)
( segid " " and resid 12 and name HD1%)
ASSI { 738}
(( segid " " and resid 8 and name HB ))
( segid " " and resid 8 and name HD1%)
2.900 1.000 1.000 peak 738 spectrum 1 weight 0.10000E+01 volume 0.46714E-02 ppm1 1.776 ppm2 0.588 CV 1
OR { 738}
(( segid " " and resid 77 and name HB ))
( segid " " and resid 8 and name HD1%)
ASSI { 739}
(( segid " " and resid 8 and name HB ))
( segid " " and resid 78 and name HD2%)
3.300 1.300 1.300 peak 739 spectrum 1 weight 0.10000E+01 volume 0.82082E-03 ppm1 1.783 ppm2 0.837 CV 1
OR { 739}
(( segid " " and resid 77 and name HB ))
( segid " " and resid 78 and name HD2%)
OR { 739}
(( segid " " and resid 8 and name HB ))
( segid " " and resid 78 and name HD1%)
OR { 739}
(( segid " " and resid 77 and name HB ))
( segid " " and resid 78 and name HD1%)
ASSI { 741}
(( segid " " and resid 77 and name HB ))
(( segid " " and resid 74 and name HA ))
2.800 0.900 0.900 peak 741 spectrum 1 weight 0.10000E+01 volume 0.17413E-02 ppm1 1.796 ppm2 3.689 CV 1
OR { 741}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 5 and name HA ))
ASSI { 743}
(( segid " " and resid 77 and name HB ))
( segid " " and resid 78 and name HD2%)
3.900 1.900 1.900 peak 743 spectrum 1 weight 0.10000E+01 volume 0.79108E-03 ppm1 1.811 ppm2 0.840 CV 1
OR { 743}
(( segid " " and resid 77 and name HB ))
( segid " " and resid 12 and name HD2%)
OR { 743}
(( segid " " and resid 77 and name HB ))
( segid " " and resid 78 and name HD1%)
ASSI { 749}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 20 and name HB% )
3.400 1.500 1.500 peak 749 spectrum 1 weight 0.10000E+01 volume 0.41077E-02 ppm1 0.797 ppm2 1.553 CV 1
OR { 749}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 50 and name HB% )
ASSI { 752}
(( segid " " and resid 59 and name HB ))
(( segid " " and resid 77 and name HG12))
3.900 1.900 1.900 peak 752 spectrum 1 weight 0.10000E+01 volume 0.10913E-02 ppm1 1.663 ppm2 0.935 CV 1
OR { 752}
(( segid " " and resid 59 and name HB ))
( segid " " and resid 64 and name HG2%)
ASSI { 753}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 19 and name HA ))
3.700 1.700 1.700 peak 753 spectrum 1 weight 0.10000E+01 volume 0.26086E-02 ppm1 0.797 ppm2 3.954 CV 1
OR { 753}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 47 and name HA ))
ASSI { 761}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 19 and name HG2%)
2.000 0.500 0.500 peak 761 spectrum 1 weight 0.10000E+01 volume 0.16061E-01 ppm1 0.797 ppm2 0.970 CV 1
OR { 761}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 48 and name HG2%)
OR { 761}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 47 and name HG2%)
ASSI { 764}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 37 and name HG ))
4.000 2.000 2.000 peak 764 spectrum 1 weight 0.10000E+01 volume 0.78969E-03 ppm1 0.795 ppm2 1.465 CV 1
OR { 764}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 31 and name HG1 ))
ASSI { 765}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 44 and name HA ))
2.700 0.900 0.900 peak 765 spectrum 1 weight 0.10000E+01 volume 0.10786E-02 ppm1 0.797 ppm2 4.037 CV 1
OR { 765}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 43 and name HB2 ))
ASSI { 768}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 46 and name HG2 ))
4.600 2.600 1.400 peak 768 spectrum 1 weight 0.10000E+01 volume 0.76225E-03 ppm1 0.797 ppm2 2.493 CV 1
OR { 768}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 18 and name HG1 ))
OR { 768}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 18 and name HG2 ))
ASSI { 786}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 12 and name HG ))
4.400 2.400 1.600 peak 786 spectrum 1 weight 0.10000E+01 volume 0.63589E-03 ppm1 0.515 ppm2 1.990 CV 1
OR { 786}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 6 and name HB1 ))
ASSI { 787}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 77 and name HG12))
4.700 2.700 1.300 peak 787 spectrum 1 weight 0.10000E+01 volume 0.76543E-03 ppm1 0.515 ppm2 0.944 CV 1
OR { 787}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 57 and name HG1%)
OR { 787}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 27 and name HG2%)
ASSI { 788}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 12 and name HB2 ))
4.000 2.000 2.000 peak 788 spectrum 1 weight 0.10000E+01 volume 0.60102E-03 ppm1 0.513 ppm2 2.143 CV 1
OR { 788}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 5 and name HG1 ))
OR { 788}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 7 and name HB1 ))
OR { 788}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 81 and name HB1 ))
ASSI { 792}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HG12))
3.000 1.100 1.100 peak 792 spectrum 1 weight 0.10000E+01 volume 0.48333E-02 ppm1 0.512 ppm2 1.515 CV 1
OR { 792}
( segid " " and resid 8 and name HG2%)
( segid " " and resid 10 and name HB% )
ASSI { 823}
(( segid " " and resid 15 and name HB ))
( segid " " and resid 51 and name HB% )
2.700 0.900 0.900 peak 823 spectrum 1 weight 0.10000E+01 volume 0.50579E-02 ppm1 2.128 ppm2 1.532 CV 1
OR { 823}
(( segid " " and resid 67 and name HB2 ))
( segid " " and resid 73 and name HB% )
ASSI { 829}
(( segid " " and resid 15 and name HB ))
( segid " " and resid 47 and name HG1%)
4.700 2.800 1.300 peak 829 spectrum 1 weight 0.10000E+01 volume 0.64008E-03 ppm1 2.131 ppm2 0.644 CV 1
OR { 829}
(( segid " " and resid 15 and name HB ))
( segid " " and resid 48 and name HG1%)
ASSI { 848}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HA ))
3.200 1.200 1.200 peak 848 spectrum 1 weight 0.10000E+01 volume 0.20539E-02 ppm1 3.263 ppm2 4.530 CV 1
OR { 848}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 68 and name HA ))
ASSI { 856}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 64 and name HA ))
5.100 3.200 0.900 peak 856 spectrum 1 weight 0.10000E+01 volume 0.55592E-03 ppm1 0.929 ppm2 3.084 CV 1
OR { 856}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 66 and name HB2 ))
ASSI { 868}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 67 and name HD2%)
3.300 1.400 1.400 peak 868 spectrum 1 weight 0.10000E+01 volume 0.26359E-02 ppm1 3.102 ppm2 0.541 CV 1
OR { 868}
(( segid " " and resid 66 and name HB2 ))
( segid " " and resid 67 and name HD2%)
ASSI { 871}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 73 and name HA ))
3.600 1.600 1.600 peak 871 spectrum 1 weight 0.10000E+01 volume 0.16934E-02 ppm1 3.113 ppm2 4.126 CV 1
OR { 871}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 34 and name HB ))
OR { 871}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 32 and name HB2 ))
ASSI { 873}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 67 and name HG ))
4.000 2.000 2.000 peak 873 spectrum 1 weight 0.10000E+01 volume 0.16912E-02 ppm1 3.107 ppm2 1.815 CV 1
OR { 873}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 77 and name HB ))
ASSI { 874}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 33 and name HA ))
2.800 1.000 1.000 peak 874 spectrum 1 weight 0.10000E+01 volume 0.17036E-02 ppm1 3.140 ppm2 4.110 CV 1
OR { 874}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 34 and name HB ))
OR { 874}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 32 and name HB2 ))
ASSI { 876}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HA ))
2.800 1.000 1.000 peak 876 spectrum 1 weight 0.10000E+01 volume 0.17462E-02 ppm1 3.206 ppm2 4.098 CV 1
OR { 876}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 32 and name HB2 ))
ASSI { 877}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 39 and name HB ))
3.700 1.700 1.700 peak 877 spectrum 1 weight 0.10000E+01 volume 0.11775E-02 ppm1 3.151 ppm2 1.984 CV 1
OR { 877}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 39 and name HB ))
ASSI { 878}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 37 and name HB1 ))
4.000 2.000 2.000 peak 878 spectrum 1 weight 0.10000E+01 volume 0.15532E-02 ppm1 3.152 ppm2 1.703 CV 1
OR { 878}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 37 and name HB1 ))
ASSI { 881}
(( segid " " and resid 33 and name HB1 ))
( segid " " and resid 67 and name HD1%)
3.600 1.600 1.600 peak 881 spectrum 1 weight 0.10000E+01 volume 0.22302E-02 ppm1 3.152 ppm2 0.458 CV 1
OR { 881}
(( segid " " and resid 33 and name HB1 ))
( segid " " and resid 70 and name HG1%)
ASSI { 885}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 67 and name HD1%)
3.000 1.100 1.100 peak 885 spectrum 1 weight 0.10000E+01 volume 0.32868E-02 ppm1 3.210 ppm2 0.456 CV 1
OR { 885}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 70 and name HG1%)
ASSI { 886}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 39 and name HG2%)
4.600 2.700 1.400 peak 886 spectrum 1 weight 0.10000E+01 volume 0.95987E-03 ppm1 3.203 ppm2 0.949 CV 1
OR { 886}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 48 and name HG2%)
OR { 886}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 64 and name HG2%)
ASSI { 890}
(( segid " " and resid 33 and name HB1 ))
( segid " " and resid 39 and name HG2%)
4.100 2.100 1.900 peak 890 spectrum 1 weight 0.10000E+01 volume 0.14155E-02 ppm1 3.150 ppm2 0.950 CV 1
OR { 890}
(( segid " " and resid 33 and name HB1 ))
( segid " " and resid 48 and name HG2%)
OR { 890}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 77 and name HG12))
OR { 890}
(( segid " " and resid 38 and name HB2 ))
( segid " " and resid 39 and name HG2%)
OR { 890}
(( segid " " and resid 76 and name HB2 ))
( segid " " and resid 57 and name HG1%)
ASSI { 908}
(( segid " " and resid 22 and name HB ))
( segid " " and resid 22 and name HG2%)
2.200 0.600 0.600 peak 908 spectrum 1 weight 0.10000E+01 volume 0.72397E-02 ppm1 1.665 ppm2 1.004 CV 1
OR { 908}
(( segid " " and resid 19 and name HB ))
( segid " " and resid 16 and name HG1%)
OR { 908}
(( segid " " and resid 22 and name HB ))
( segid " " and resid 16 and name HG1%)
ASSI { 909}
(( segid " " and resid 19 and name HB ))
(( segid " " and resid 19 and name HG11))
2.400 0.700 0.700 peak 909 spectrum 1 weight 0.10000E+01 volume 0.35676E-02 ppm1 1.659 ppm2 1.365 CV 1
OR { 909}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 22 and name HG11))
OR { 909}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 19 and name HG11))
ASSI { 911}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 47 and name HA ))
3.400 1.400 1.400 peak 911 spectrum 1 weight 0.10000E+01 volume 0.97620E-03 ppm1 1.689 ppm2 3.953 CV 1
OR { 911}
(( segid " " and resid 19 and name HB ))
(( segid " " and resid 19 and name HA ))
OR { 911}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 19 and name HA ))
ASSI { 912}
(( segid " " and resid 47 and name HB ))
( segid " " and resid 51 and name HB% )
3.500 1.600 1.600 peak 912 spectrum 1 weight 0.10000E+01 volume 0.52230E-02 ppm1 1.662 ppm2 1.520 CV 1
OR { 912}
(( segid " " and resid 19 and name HB ))
( segid " " and resid 51 and name HB% )
ASSI { 1106}
( segid " " and resid 22 and name HG2%)
( segid " " and resid 37 and name HD2%)
3.000 1.200 1.200 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.53705E-02 ppm1 1.012 ppm2 0.772 CV 1
OR { 1106}
( segid " " and resid 19 and name HG2%)
( segid " " and resid 64 and name HG1%)
ASSI { 1139}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 43 and name HB2 ))
3.600 1.600 1.600 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.14855E-02 ppm1 0.973 ppm2 4.026 CV 1
OR { 1139}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 44 and name HA ))
ASSI { 1142}
( segid " " and resid 19 and name HG2%)
( segid " " and resid 12 and name HD1%)
3.300 3.300 2.700 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.66476E-02 ppm1 0.972 ppm2 0.865 CV 1
OR { 1142}
( segid " " and resid 19 and name HG2%)
( segid " " and resid 22 and name HD1%)
OR { 1142}
( segid " " and resid 19 and name HG2%)
( segid " " and resid 12 and name HD2%)
ASSI { 1144}
( segid " " and resid 19 and name HG2%)
( segid " " and resid 20 and name HB% )
3.000 1.100 1.100 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.30518E-02 ppm1 0.974 ppm2 1.552 CV 1
OR { 1144}
( segid " " and resid 22 and name HG2%)
( segid " " and resid 20 and name HB% )
ASSI { 1161}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 46 and name HG2 ))
4.500 2.500 1.500 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.61472E-03 ppm1 0.972 ppm2 2.491 CV 1
OR { 1161}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 18 and name HG1 ))
OR { 1161}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 18 and name HG2 ))
ASSI { 1248}
(( segid " " and resid 37 and name HB1 ))
( segid " " and resid 39 and name HG1%)
4.100 2.100 1.900 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.10996E-02 ppm1 1.703 ppm2 0.843 CV 1
OR { 1248}
(( segid " " and resid 37 and name HB1 ))
( segid " " and resid 22 and name HD1%)
ASSI { 1249}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 39 and name HG1%)
3.800 1.800 1.800 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.76336E-03 ppm1 2.308 ppm2 0.843 CV 1
OR { 1249}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 22 and name HD1%)
ASSI { 1251}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 44 and name HG1 ))
4.800 2.900 1.200 peak 1251 spectrum 1 weight 0.10000E+01 volume 0.63976E-03 ppm1 3.180 ppm2 2.182 CV 1
OR { 1251}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 46 and name HB1 ))
ASSI { 1258}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 16 and name HG1%)
4.300 2.300 1.700 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.83586E-03 ppm1 2.308 ppm2 1.008 CV 1
OR { 1258}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 22 and name HG2%)
ASSI { 1259}
(( segid " " and resid 37 and name HB1 ))
( segid " " and resid 16 and name HG1%)
3.100 1.200 1.200 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.10504E-02 ppm1 1.703 ppm2 1.006 CV 1
OR { 1259}
(( segid " " and resid 37 and name HB1 ))
( segid " " and resid 22 and name HG2%)
ASSI { 1287}
(( segid " " and resid 12 and name HB1 ))
( segid " " and resid 27 and name HG1%)
3.200 1.300 1.300 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.93280E-03 ppm1 1.248 ppm2 0.755 CV 1
OR { 1287}
(( segid " " and resid 12 and name HB1 ))
( segid " " and resid 15 and name HD1%)
ASSI { 1293}
(( segid " " and resid 12 and name HB2 ))
( segid " " and resid 70 and name HG2%)
4.600 2.600 1.400 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.77332E-03 ppm1 2.131 ppm2 0.644 CV 1
OR { 1293}
(( segid " " and resid 12 and name HB2 ))
( segid " " and resid 48 and name HG1%)
ASSI { 1297}
(( segid " " and resid 12 and name HB1 ))
( segid " " and resid 70 and name HG2%)
3.900 1.900 1.900 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.84766E-03 ppm1 1.246 ppm2 0.641 CV 1
OR { 1297}
(( segid " " and resid 12 and name HB1 ))
( segid " " and resid 48 and name HG1%)
ASSI { 1306}
(( segid " " and resid 12 and name HB2 ))
( segid " " and resid 27 and name HG1%)
4.400 2.500 1.600 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.76760E-03 ppm1 2.130 ppm2 0.754 CV 1
OR { 1306}
(( segid " " and resid 12 and name HB2 ))
( segid " " and resid 15 and name HD1%)
ASSI { 1340}
(( segid " " and resid 65 and name HE2 ))
(( segid " " and resid 65 and name HG2 ))
2.700 0.900 0.900 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.66849E-02 ppm1 3.022 ppm2 1.683 CV 1
OR { 1340}
(( segid " " and resid 65 and name HE1 ))
(( segid " " and resid 65 and name HG2 ))
OR { 1340}
(( segid " " and resid 65 and name HE2 ))
(( segid " " and resid 65 and name HG1 ))
OR { 1340}
(( segid " " and resid 75 and name HE1 ))
(( segid " " and resid 75 and name HG1 ))
OR { 1340}
(( segid " " and resid 75 and name HE2 ))
(( segid " " and resid 75 and name HG1 ))
OR { 1340}
(( segid " " and resid 65 and name HE1 ))
(( segid " " and resid 65 and name HG1 ))
ASSI { 1347}
(( segid " " and resid 65 and name HE1 ))
(( segid " " and resid 65 and name HD1 ))
2.700 0.900 0.900 peak 1347 spectrum 1 weight 0.10000E+01 volume 0.34040E-02 ppm1 3.025 ppm2 1.362 CV 1
OR { 1347}
(( segid " " and resid 65 and name HE2 ))
(( segid " " and resid 65 and name HD1 ))
OR { 1347}
(( segid " " and resid 31 and name HE2 ))
(( segid " " and resid 22 and name HG11))
ASSI { 1350}
(( segid " " and resid 31 and name HE2 ))
(( segid " " and resid 31 and name HB1 ))
3.400 1.400 1.400 peak 1350 spectrum 1 weight 0.10000E+01 volume 0.24911E-02 ppm1 3.026 ppm2 1.806 CV 1
OR { 1350}
(( segid " " and resid 65 and name HE2 ))
(( segid " " and resid 65 and name HB1 ))
OR { 1350}
(( segid " " and resid 65 and name HE1 ))
(( segid " " and resid 65 and name HB1 ))
OR { 1350}
(( segid " " and resid 65 and name HE2 ))
(( segid " " and resid 65 and name HB2 ))
OR { 1350}
(( segid " " and resid 65 and name HE1 ))
(( segid " " and resid 65 and name HB2 ))
ASSI { 1375}
(( segid " " and resid 31 and name HE1 ))
(( segid " " and resid 31 and name HG1 ))
2.300 0.700 0.700 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.20759E-02 ppm1 2.962 ppm2 1.480 CV 1
OR { 1375}
(( segid " " and resid 31 and name HE1 ))
(( segid " " and resid 37 and name HG ))
ASSI { 1380}
(( segid " " and resid 31 and name HE1 ))
(( segid " " and resid 31 and name HB1 ))
3.600 1.600 1.600 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.15656E-02 ppm1 2.962 ppm2 1.816 CV 1
OR { 1380}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 67 and name HG ))
ASSI { 1382}
(( segid " " and resid 75 and name HE1 ))
(( segid " " and resid 75 and name HD1 ))
2.700 0.900 0.900 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.33062E-02 ppm1 3.026 ppm2 1.469 CV 1
OR { 1382}
(( segid " " and resid 65 and name HE2 ))
(( segid " " and resid 65 and name HD2 ))
OR { 1382}
(( segid " " and resid 75 and name HE2 ))
(( segid " " and resid 75 and name HD1 ))
OR { 1382}
(( segid " " and resid 65 and name HE1 ))
(( segid " " and resid 65 and name HD2 ))
ASSI { 1384}
(( segid " " and resid 31 and name HE1 ))
(( segid " " and resid 22 and name HG11))
2.200 0.600 0.600 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.30201E-02 ppm1 2.965 ppm2 1.371 CV 1
OR { 1384}
(( segid " " and resid 31 and name HE1 ))
(( segid " " and resid 31 and name HD1 ))
ASSI { 1388}
(( segid " " and resid 75 and name HE1 ))
(( segid " " and resid 75 and name HG1 ))
3.100 1.200 1.200 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.37906E-02 ppm1 3.064 ppm2 1.660 CV 1
OR { 1388}
(( segid " " and resid 75 and name HE2 ))
(( segid " " and resid 75 and name HG1 ))
OR { 1388}
(( segid " " and resid 31 and name HE2 ))
(( segid " " and resid 22 and name HB ))
ASSI { 1391}
(( segid " " and resid 75 and name HE1 ))
(( segid " " and resid 29 and name HB2 ))
2.600 2.600 3.400 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.24755E-02 ppm1 3.068 ppm2 1.751 CV 1
OR { 1391}
(( segid " " and resid 75 and name HE2 ))
(( segid " " and resid 29 and name HB2 ))
OR { 1391}
(( segid " " and resid 28 and name HE2 ))
(( segid " " and resid 29 and name HB2 ))
OR { 1391}
(( segid " " and resid 28 and name HE1 ))
(( segid " " and resid 29 and name HB2 ))
OR { 1391}
(( segid " " and resid 75 and name HE2 ))
(( segid " " and resid 8 and name HB ))
OR { 1391}
(( segid " " and resid 75 and name HE1 ))
(( segid " " and resid 8 and name HB ))
OR { 1391}
(( segid " " and resid 31 and name HE2 ))
(( segid " " and resid 29 and name HB2 ))
ASSI { 1392}
(( segid " " and resid 31 and name HE2 ))
(( segid " " and resid 26 and name HA ))
3.400 1.500 1.500 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.13360E-02 ppm1 3.069 ppm2 4.638 CV 1
OR { 1392}
(( segid " " and resid 28 and name HE1 ))
(( segid " " and resid 28 and name HA ))
ASSI { 1550}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 12 and name HB2 ))
3.200 1.300 1.300 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.68196E-03 ppm1 0.591 ppm2 2.135 CV 1
OR { 1550}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 5 and name HG1 ))
ASSI { 1569}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 77 and name HG11))
4.400 2.500 1.600 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.80551E-03 ppm1 0.591 ppm2 2.030 CV 1
OR { 1569}
( segid " " and resid 8 and name HD1%)
(( segid " " and resid 9 and name HB ))
ASSI { 1600}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 48 and name HG2%)
2.700 0.900 0.900 peak 1600 spectrum 1 weight 0.10000E+01 volume 0.72642E-02 ppm1 1.097 ppm2 0.976 CV 1
OR { 1600}
( segid " " and resid 15 and name HG2%)
( segid " " and resid 47 and name HG2%)
ASSI { 1633}
( segid " " and resid 47 and name HG1%)
( segid " " and resid 15 and name HG2%)
2.300 0.700 0.700 peak 1633 spectrum 1 weight 0.10000E+01 volume 0.54240E-02 ppm1 0.640 ppm2 1.094 CV 1
OR { 1633}
( segid " " and resid 48 and name HG1%)
( segid " " and resid 15 and name HG2%)
ASSI { 1638}
( segid " " and resid 48 and name HG1%)
( segid " " and resid 64 and name HG1%)
3.500 1.500 1.500 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.88562E-03 ppm1 0.640 ppm2 0.788 CV 1
OR { 1638}
( segid " " and resid 47 and name HG1%)
( segid " " and resid 19 and name HD1%)
ASSI { 1647}
( segid " " and resid 48 and name HG1%)
( segid " " and resid 16 and name HG2%)
3.600 1.600 1.600 peak 1647 spectrum 1 weight 0.10000E+01 volume 0.23105E-02 ppm1 0.640 ppm2 1.199 CV 1
OR { 1647}
( segid " " and resid 47 and name HG1%)
( segid " " and resid 16 and name HG2%)
ASSI { 1835}
( segid " " and resid 57 and name HG1%)
(( segid " " and resid 82 and name HN ))
3.700 1.700 1.700 peak 1835 spectrum 1 weight 0.10000E+01 volume 0.27370E-02 ppm1 0.951 ppm2 8.319 CV 1
OR { 1835}
( segid " " and resid 57 and name HG1%)
(( segid " " and resid 79 and name HN ))
ASSI { 1840}
( segid " " and resid 57 and name HG1%)
(( segid " " and resid 59 and name HG12))
3.500 1.500 1.500 peak 1840 spectrum 1 weight 0.10000E+01 volume 0.19257E-02 ppm1 0.953 ppm2 1.513 CV 1
OR { 1840}
( segid " " and resid 57 and name HG1%)
(( segid " " and resid 8 and name HG12))
OR { 1840}
( segid " " and resid 45 and name HG1%)
(( segid " " and resid 59 and name HG12))
ASSI { 1866}
( segid " " and resid 57 and name HG1%)
( segid " " and resid 76 and name HD% )
4.400 2.400 1.600 peak 1866 spectrum 1 weight 0.10000E+01 volume 0.77065E-03 ppm1 0.953 ppm2 6.805 CV 1
OR { 1866}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 33 and name HZ ))
OR { 1866}
( segid " " and resid 45 and name HG1%)
(( segid " " and resid 33 and name HZ ))
ASSI { 1889}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 67 and name HD2%)
3.200 3.200 2.800 peak 1889 spectrum 1 weight 0.10000E+01 volume 0.50343E-02 ppm1 0.643 ppm2 0.546 CV 1
OR { 1889}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 77 and name HG2%)
ASSI { 1890}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 29 and name HD1%)
2.700 0.900 0.900 peak 1890 spectrum 1 weight 0.10000E+01 volume 0.58419E-02 ppm1 0.643 ppm2 0.832 CV 1
OR { 1890}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 78 and name HD1%)
OR { 1890}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 78 and name HD2%)
ASSI { 1907}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 37 and name HB2 ))
2.700 2.700 3.300 peak 1907 spectrum 1 weight 0.10000E+01 volume 0.96033E-03 ppm1 0.667 ppm2 2.317 CV 1
OR { 1907}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 14 and name HB2 ))
ASSI { 1942}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 24 and name HA ))
2.600 0.900 0.900 peak 1942 spectrum 1 weight 0.10000E+01 volume 0.42120E-02 ppm1 0.953 ppm2 3.622 CV 1
OR { 1942}
( segid " " and resid 24 and name HG1%)
(( segid " " and resid 24 and name HA ))
ASSI { 1943}
( segid " " and resid 27 and name HG2%)
( segid " " and resid 13 and name HB% )
2.400 0.700 0.700 peak 1943 spectrum 1 weight 0.10000E+01 volume 0.54342E-02 ppm1 0.948 ppm2 1.703 CV 1
OR { 1943}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 37 and name HB1 ))
ASSI { 1948}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 77 and name HA ))
3.200 3.200 2.800 peak 1948 spectrum 1 weight 0.10000E+01 volume 0.57174E-02 ppm1 1.099 ppm2 3.554 CV 1
OR { 1948}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 27 and name HA ))
ASSI { 1954}
( segid " " and resid 74 and name HG2%)
( segid " " and resid 16 and name HG2%)
2.300 2.300 3.700 peak 1954 spectrum 1 weight 0.10000E+01 volume 0.51870E-02 ppm1 1.099 ppm2 1.204 CV 1
OR { 1954}
( segid " " and resid 69 and name HG2%)
( segid " " and resid 16 and name HG2%)
ASSI { 1957}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 12 and name HB2 ))
2.700 0.900 0.900 peak 1957 spectrum 1 weight 0.10000E+01 volume 0.47267E-02 ppm1 1.099 ppm2 2.143 CV 1
OR { 1957}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 5 and name HG1 ))
OR { 1957}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 67 and name HB2 ))
ASSI { 1958}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 8 and name HB ))
3.300 1.300 1.300 peak 1958 spectrum 1 weight 0.10000E+01 volume 0.38634E-02 ppm1 1.098 ppm2 1.766 CV 1
OR { 1958}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 29 and name HG ))
OR { 1958}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 78 and name HB2 ))
ASSI { 1980}
( segid " " and resid 24 and name HG1%)
(( segid " " and resid 25 and name HA ))
3.500 1.600 1.600 peak 1980 spectrum 1 weight 0.10000E+01 volume 0.20525E-02 ppm1 1.004 ppm2 4.058 CV 1
OR { 1980}
( segid " " and resid 49 and name HG1%)
(( segid " " and resid 46 and name HA ))
OR { 1980}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 13 and name HA ))
OR { 1980}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 25 and name HA ))
OR { 1980}
( segid " " and resid 24 and name HG1%)
(( segid " " and resid 13 and name HA ))
ASSI { 1996}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 24 and name HB ))
2.100 0.600 0.600 peak 1996 spectrum 1 weight 0.10000E+01 volume 0.14044E-01 ppm1 0.992 ppm2 2.062 CV 1
OR { 1996}
( segid " " and resid 24 and name HG1%)
(( segid " " and resid 24 and name HB ))
OR { 1996}
( segid " " and resid 49 and name HG1%)
(( segid " " and resid 49 and name HB ))
ASSI { 1997}
( segid " " and resid 27 and name HG2%)
( segid " " and resid 13 and name HB% )
2.400 0.700 0.700 peak 1997 spectrum 1 weight 0.10000E+01 volume 0.72287E-02 ppm1 0.980 ppm2 1.699 CV 1
OR { 1997}
( segid " " and resid 24 and name HG1%)
( segid " " and resid 13 and name HB% )
ASSI { 1998}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 24 and name HA ))
2.300 0.700 0.700 peak 1998 spectrum 1 weight 0.10000E+01 volume 0.74348E-02 ppm1 0.982 ppm2 3.623 CV 1
OR { 1998}
( segid " " and resid 24 and name HG1%)
(( segid " " and resid 24 and name HA ))
OR { 1998}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 80 and name HB2 ))
ASSI { 1999}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 17 and name HB1 ))
2.700 2.700 3.300 peak 1999 spectrum 1 weight 0.10000E+01 volume 0.16149E-02 ppm1 0.984 ppm2 2.773 CV 1
OR { 1999}
( segid " " and resid 24 and name HG1%)
(( segid " " and resid 17 and name HB1 ))
OR { 1999}
( segid " " and resid 27 and name HG2%)
(( segid " " and resid 17 and name HB1 ))
OR { 1999}
( segid " " and resid 45 and name HG1%)
(( segid " " and resid 66 and name HB1 ))
ASSI { 2000}
( segid " " and resid 24 and name HG1%)
(( segid " " and resid 17 and name HB2 ))
2.700 0.900 0.900 peak 2000 spectrum 1 weight 0.10000E+01 volume 0.24856E-02 ppm1 0.981 ppm2 3.110 CV 1
OR { 2000}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 76 and name HB2 ))
ASSI { 2010}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 68 and name HB1 ))
2.700 0.900 0.900 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.35042E-02 ppm1 1.066 ppm2 2.118 CV 1
OR { 2010}
( segid " " and resid 74 and name HG2%)
(( segid " " and resid 12 and name HB2 ))
OR { 2010}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 68 and name HB2 ))
ASSI { 2015}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 32 and name HB2 ))
3.500 1.500 1.500 peak 2015 spectrum 1 weight 0.10000E+01 volume 0.22929E-02 ppm1 1.066 ppm2 4.111 CV 1
OR { 2015}
( segid " " and resid 69 and name HG2%)
(( segid " " and resid 33 and name HA ))
ASSI { 2025}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 74 and name HB ))
4.200 2.200 1.800 peak 2025 spectrum 1 weight 0.10000E+01 volume 0.85232E-03 ppm1 0.777 ppm2 4.188 CV 1
OR { 2025}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 52 and name HA ))
OR { 2025}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 74 and name HB ))
OR { 2025}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 76 and name HA ))
ASSI { 2029}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 12 and name HD1%)
2.700 0.900 0.900 peak 2029 spectrum 1 weight 0.10000E+01 volume 0.70885E-02 ppm1 0.776 ppm2 0.874 CV 1
OR { 2029}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 12 and name HD1%)
ASSI { 2033}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 77 and name HD1%)
2.900 2.900 3.100 peak 2033 spectrum 1 weight 0.10000E+01 volume 0.44650E-02 ppm1 0.776 ppm2 0.671 CV 1
OR { 2033}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 77 and name HD1%)
ASSI { 2058}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 77 and name HA ))
2.800 1.000 1.000 peak 2058 spectrum 1 weight 0.10000E+01 volume 0.19959E-02 ppm1 1.004 ppm2 3.535 CV 1
OR { 2058}
( segid " " and resid 49 and name HG1%)
(( segid " " and resid 45 and name HA ))
ASSI { 2060}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 52 and name HA ))
4.000 2.000 2.000 peak 2060 spectrum 1 weight 0.10000E+01 volume 0.19997E-02 ppm1 1.003 ppm2 4.196 CV 1
OR { 2060}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 82 and name HA ))
OR { 2060}
( segid " " and resid 49 and name HG1%)
(( segid " " and resid 52 and name HA ))
ASSI { 2062}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 82 and name HN ))
3.700 1.700 1.700 peak 2062 spectrum 1 weight 0.10000E+01 volume 0.20004E-02 ppm1 1.002 ppm2 8.320 CV 1
OR { 2062}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 79 and name HN ))
ASSI { 2071}
( segid " " and resid 57 and name HG2%)
( segid " " and resid 76 and name HD% )
4.000 2.000 2.000 peak 2071 spectrum 1 weight 0.10000E+01 volume 0.77406E-03 ppm1 1.004 ppm2 6.805 CV 1
OR { 2071}
( segid " " and resid 49 and name HG1%)
( segid " " and resid 76 and name HD% )
ASSI { 2072}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 73 and name HB% )
3.700 1.700 1.700 peak 2072 spectrum 1 weight 0.10000E+01 volume 0.29707E-02 ppm1 1.101 ppm2 1.546 CV 1
OR { 2072}
( segid " " and resid 69 and name HG2%)
( segid " " and resid 73 and name HB% )
ASSI { 2075}
( segid " " and resid 49 and name HG1%)
(( segid " " and resid 59 and name HG12))
3.500 1.600 1.600 peak 2075 spectrum 1 weight 0.10000E+01 volume 0.14419E-02 ppm1 1.004 ppm2 1.515 CV 1
OR { 2075}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 59 and name HG12))
OR { 2075}
( segid " " and resid 49 and name HG1%)
( segid " " and resid 51 and name HB% )
OR { 2075}
( segid " " and resid 57 and name HG2%)
(( segid " " and resid 8 and name HG12))
OR { 2075}
( segid " " and resid 57 and name HG2%)
( segid " " and resid 2 and name HB% )
ASSI { 2081}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 22 and name HG2%)
3.300 1.400 1.400 peak 2081 spectrum 1 weight 0.10000E+01 volume 0.37123E-02 ppm1 0.750 ppm2 1.010 CV 1
OR { 2081}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 16 and name HG1%)
ASSI { 2082}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 12 and name HD2%)
3.600 1.600 1.600 peak 2082 spectrum 1 weight 0.10000E+01 volume 0.24149E-02 ppm1 0.747 ppm2 0.847 CV 1
OR { 2082}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 12 and name HD2%)
OR { 2082}
( segid " " and resid 64 and name HG1%)
(( segid " " and resid 59 and name HG11))
OR { 2082}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 22 and name HD1%)
ASSI { 2083}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 13 and name HB% )
2.600 0.800 0.800 peak 2083 spectrum 1 weight 0.10000E+01 volume 0.57999E-02 ppm1 0.746 ppm2 1.698 CV 1
OR { 2083}
( segid " " and resid 27 and name HG1%)
(( segid " " and resid 28 and name HG1 ))
ASSI { 2084}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 27 and name HG2%)
2.100 0.600 0.600 peak 2084 spectrum 1 weight 0.10000E+01 volume 0.11706E-01 ppm1 0.751 ppm2 0.946 CV 1
OR { 2084}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 64 and name HG2%)
ASSI { 2089}
( segid " " and resid 27 and name HG1%)
( segid " " and resid 16 and name HG2%)
3.000 1.100 1.100 peak 2089 spectrum 1 weight 0.10000E+01 volume 0.36277E-02 ppm1 0.748 ppm2 1.197 CV 1
OR { 2089}
( segid " " and resid 64 and name HG1%)
( segid " " and resid 16 and name HG2%)
ASSI { 2097}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 33 and name HA ))
2.500 2.500 3.500 peak 2097 spectrum 1 weight 0.10000E+01 volume 0.15620E-02 ppm1 0.948 ppm2 4.096 CV 1
OR { 2097}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 34 and name HB ))
ASSI { 2126}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 45 and name HG1%)
2.000 0.500 0.500 peak 2126 spectrum 1 weight 0.10000E+01 volume 0.17672E-01 ppm1 1.117 ppm2 0.963 CV 1
OR { 2126}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 48 and name HG2%)
ASSI { 2134}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 43 and name HN ))
4.500 2.500 1.500 peak 2134 spectrum 1 weight 0.10000E+01 volume 0.75870E-03 ppm1 0.840 ppm2 8.400 CV 1
OR { 2134}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 11 and name HN ))
OR { 2134}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 68 and name HN ))
ASSI { 2136}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 44 and name HG1 ))
4.300 2.300 1.700 peak 2136 spectrum 1 weight 0.10000E+01 volume 0.78356E-03 ppm1 0.842 ppm2 2.172 CV 1
OR { 2136}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 52 and name HB1 ))
ASSI { 2137}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 36 and name HN ))
3.000 3.000 3.000 peak 2137 spectrum 1 weight 0.10000E+01 volume 0.14519E-02 ppm1 0.845 ppm2 7.799 CV 1
OR { 2137}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 26 and name HN ))
OR { 2137}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 36 and name HN ))
ASSI { 2141}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 48 and name HB ))
4.800 2.900 1.200 peak 2141 spectrum 1 weight 0.10000E+01 volume 0.71978E-03 ppm1 0.841 ppm2 2.379 CV 1
OR { 2141}
( segid " " and resid 39 and name HG1%)
(( segid " " and resid 48 and name HB ))
ASSI { 2161}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 67 and name HB1 ))
2.500 0.800 0.800 peak 2161 spectrum 1 weight 0.10000E+01 volume 0.31373E-02 ppm1 0.540 ppm2 0.934 CV 1
OR { 2161}
( segid " " and resid 67 and name HD2%)
( segid " " and resid 64 and name HG2%)
ASSI { 2172}
( segid " " and resid 67 and name HD2%)
( segid " " and resid 76 and name HD% )
3.100 1.200 1.200 peak 2172 spectrum 1 weight 0.10000E+01 volume 0.25143E-02 ppm1 0.539 ppm2 6.804 CV 1
OR { 2172}
( segid " " and resid 67 and name HD2%)
(( segid " " and resid 33 and name HZ ))
ASSI { 2186}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 16 and name HG2%)
2.000 0.500 0.500 peak 2186 spectrum 1 weight 0.10000E+01 volume 0.15282E-01 ppm1 1.004 ppm2 1.201 CV 1
OR { 2186}
( segid " " and resid 48 and name HG2%)
( segid " " and resid 16 and name HG2%)
ASSI { 2188}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 15 and name HG2%)
3.000 1.100 1.100 peak 2188 spectrum 1 weight 0.10000E+01 volume 0.27123E-02 ppm1 0.869 ppm2 1.108 CV 1
OR { 2188}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 74 and name HG2%)
OR { 2188}
( segid " " and resid 39 and name HG1%)
( segid " " and resid 45 and name HG2%)
ASSI { 2190}
( segid " " and resid 49 and name HG2%)
(( segid " " and resid 59 and name HG11))
3.000 3.000 3.000 peak 2190 spectrum 1 weight 0.10000E+01 volume 0.45524E-02 ppm1 1.113 ppm2 0.859 CV 1
OR { 2190}
( segid " " and resid 49 and name HG2%)
( segid " " and resid 12 and name HD2%)
ASSI { 2192}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 33 and name HE% )
3.900 1.900 1.900 peak 2192 spectrum 1 weight 0.10000E+01 volume 0.72992E-03 ppm1 0.866 ppm2 6.966 CV 1
OR { 2192}
( segid " " and resid 39 and name HG1%)
( segid " " and resid 33 and name HE% )
ASSI { 2200}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 77 and name HD1%)
3.600 1.600 1.600 peak 2200 spectrum 1 weight 0.10000E+01 volume 0.27174E-02 ppm1 0.867 ppm2 0.668 CV 1
OR { 2200}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 47 and name HG1%)
ASSI { 2201}
( segid " " and resid 49 and name HG2%)
(( segid " " and resid 53 and name HB2 ))
4.400 2.400 1.600 peak 2201 spectrum 1 weight 0.10000E+01 volume 0.79246E-03 ppm1 1.114 ppm2 2.163 CV 1
OR { 2201}
( segid " " and resid 49 and name HG2%)
(( segid " " and resid 52 and name HB1 ))
OR { 2201}
( segid " " and resid 49 and name HG2%)
(( segid " " and resid 44 and name HG1 ))
ASSI { 2208}
( segid " " and resid 48 and name HG2%)
( segid " " and resid 12 and name HD2%)
2.800 0.900 0.900 peak 2208 spectrum 1 weight 0.10000E+01 volume 0.94507E-02 ppm1 0.964 ppm2 0.854 CV 1
OR { 2208}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 39 and name HG1%)
OR { 2208}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 22 and name HD1%)
OR { 2208}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 12 and name HD2%)
ASSI { 2222}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 37 and name HD2%)
3.200 1.300 1.300 peak 2222 spectrum 1 weight 0.10000E+01 volume 0.62542E-02 ppm1 1.009 ppm2 0.770 CV 1
OR { 2222}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 64 and name HG1%)
ASSI { 2225}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 19 and name HG12))
2.800 1.000 1.000 peak 2225 spectrum 1 weight 0.10000E+01 volume 0.15807E-02 ppm1 0.966 ppm2 1.655 CV 1
OR { 2225}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 47 and name HB ))
OR { 2225}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 19 and name HB ))
OR { 2225}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 22 and name HB ))
OR { 2225}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 47 and name HB ))
ASSI { 2226}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 13 and name HA ))
4.200 2.200 1.800 peak 2226 spectrum 1 weight 0.10000E+01 volume 0.10431E-02 ppm1 1.007 ppm2 4.058 CV 1
OR { 2226}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 46 and name HA ))
OR { 2226}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 21 and name HA2 ))
ASSI { 2231}
( segid " " and resid 48 and name HG2%)
( segid " " and resid 15 and name HG2%)
2.800 1.000 1.000 peak 2231 spectrum 1 weight 0.10000E+01 volume 0.61975E-02 ppm1 0.965 ppm2 1.079 CV 1
OR { 2231}
( segid " " and resid 47 and name HG2%)
( segid " " and resid 15 and name HG2%)
OR { 2231}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 15 and name HG2%)
ASSI { 2237}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 20 and name HB% )
2.500 0.800 0.800 peak 2237 spectrum 1 weight 0.10000E+01 volume 0.69252E-02 ppm1 1.008 ppm2 1.548 CV 1
OR { 2237}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 73 and name HB% )
ASSI { 2239}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 19 and name HG12))
2.200 0.600 0.600 peak 2239 spectrum 1 weight 0.10000E+01 volume 0.57570E-02 ppm1 1.006 ppm2 1.659 CV 1
OR { 2239}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 47 and name HB ))
OR { 2239}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 19 and name HB ))
OR { 2239}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 22 and name HB ))
ASSI { 2241}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 27 and name HG1%)
2.600 0.900 0.900 peak 2241 spectrum 1 weight 0.10000E+01 volume 0.92003E-02 ppm1 0.864 ppm2 0.765 CV 1
OR { 2241}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 64 and name HG1%)
OR { 2241}
( segid " " and resid 12 and name HD1%)
( segid " " and resid 15 and name HD1%)
ASSI { 2242}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 46 and name HB1 ))
3.600 1.600 1.600 peak 2242 spectrum 1 weight 0.10000E+01 volume 0.66370E-03 ppm1 0.965 ppm2 2.152 CV 1
OR { 2242}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 18 and name HB1 ))
ASSI { 2244}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 44 and name HB2 ))
3.800 1.800 1.800 peak 2244 spectrum 1 weight 0.10000E+01 volume 0.20721E-02 ppm1 1.007 ppm2 2.022 CV 1
OR { 2244}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 44 and name HB2 ))
ASSI { 2246}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 16 and name HA ))
2.400 0.700 0.700 peak 2246 spectrum 1 weight 0.10000E+01 volume 0.53650E-02 ppm1 1.006 ppm2 3.565 CV 1
OR { 2246}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 16 and name HA ))
ASSI { 2247}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 33 and name HE% )
3.100 1.200 1.200 peak 2247 spectrum 1 weight 0.10000E+01 volume 0.12622E-02 ppm1 0.964 ppm2 6.958 CV 1
OR { 2247}
( segid " " and resid 48 and name HG2%)
( segid " " and resid 33 and name HE% )
ASSI { 2248}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 16 and name HA ))
3.000 1.100 1.100 peak 2248 spectrum 1 weight 0.10000E+01 volume 0.17487E-02 ppm1 0.965 ppm2 3.563 CV 1
OR { 2248}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 16 and name HA ))
OR { 2248}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 16 and name HA ))
ASSI { 2252}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 19 and name HN ))
3.500 1.500 1.500 peak 2252 spectrum 1 weight 0.10000E+01 volume 0.23087E-02 ppm1 0.966 ppm2 8.143 CV 1
OR { 2252}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 19 and name HN ))
ASSI { 2275}
( segid " " and resid 70 and name HG1%)
( segid " " and resid 22 and name HG2%)
2.700 2.700 3.300 peak 2275 spectrum 1 weight 0.10000E+01 volume 0.95397E-03 ppm1 0.446 ppm2 1.014 CV 1
OR { 2275}
( segid " " and resid 70 and name HG1%)
( segid " " and resid 16 and name HG1%)
ASSI { 2283}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 27 and name HG1%)
3.000 1.100 1.100 peak 2283 spectrum 1 weight 0.10000E+01 volume 0.42552E-02 ppm1 1.200 ppm2 0.750 CV 1
OR { 2283}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 15 and name HD1%)
ASSI { 2284}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 20 and name HB% )
4.700 2.700 1.300 peak 2284 spectrum 1 weight 0.10000E+01 volume 0.72434E-03 ppm1 1.199 ppm2 1.557 CV 1
OR { 2284}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 73 and name HB% )
OR { 2284}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 50 and name HB% )
ASSI { 2288}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 22 and name HB ))
4.000 2.000 2.000 peak 2288 spectrum 1 weight 0.10000E+01 volume 0.11018E-02 ppm1 1.196 ppm2 1.667 CV 1
OR { 2288}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 19 and name HB ))
OR { 2288}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 47 and name HB ))
ASSI { 2289}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 14 and name HB1 ))
2.500 2.500 3.500 peak 2289 spectrum 1 weight 0.10000E+01 volume 0.38928E-02 ppm1 1.199 ppm2 2.239 CV 1
OR { 2289}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 45 and name HB ))
OR { 2289}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 5 and name HG2 ))
ASSI { 2290}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 37 and name HB2 ))
4.000 2.000 2.000 peak 2290 spectrum 1 weight 0.10000E+01 volume 0.15838E-02 ppm1 1.200 ppm2 2.304 CV 1
OR { 2290}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 14 and name HB2 ))
ASSI { 2292}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 48 and name HG2%)
2.300 0.700 0.700 peak 2292 spectrum 1 weight 0.10000E+01 volume 0.90730E-02 ppm1 1.200 ppm2 0.956 CV 1
OR { 2292}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 27 and name HG2%)
ASSI { 2293}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 17 and name HN ))
3.900 1.900 1.900 peak 2293 spectrum 1 weight 0.10000E+01 volume 0.16899E-02 ppm1 1.200 ppm2 8.690 CV 1
OR { 2293}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 20 and name HN ))
ASSI { 2298}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 70 and name HG2%)
3.000 1.200 1.200 peak 2298 spectrum 1 weight 0.10000E+01 volume 0.39617E-02 ppm1 1.200 ppm2 0.637 CV 1
OR { 2298}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 48 and name HG1%)
OR { 2298}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 47 and name HG1%)
ASSI { 2306}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 15 and name HB ))
3.900 1.900 1.900 peak 2306 spectrum 1 weight 0.10000E+01 volume 0.11649E-02 ppm1 1.202 ppm2 2.134 CV 1
OR { 2306}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 12 and name HB2 ))
ASSI { 2314}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 43 and name HB2 ))
4.400 2.400 1.600 peak 2314 spectrum 1 weight 0.10000E+01 volume 0.61384E-03 ppm1 0.878 ppm2 4.029 CV 1
OR { 2314}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 44 and name HA ))
OR { 2314}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 65 and name HA ))
ASSI { 2357}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 5 and name HA ))
3.700 1.800 1.800 peak 2357 spectrum 1 weight 0.10000E+01 volume 0.89913E-03 ppm1 1.056 ppm2 3.688 CV 1
OR { 2357}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 74 and name HA ))
ASSI { 2371}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 5 and name HG1 ))
3.600 1.700 1.700 peak 2371 spectrum 1 weight 0.10000E+01 volume 0.16933E-02 ppm1 1.056 ppm2 2.137 CV 1
OR { 2371}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 12 and name HB2 ))
ASSI { 2372}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 29 and name HD1%)
2.300 0.700 0.700 peak 2372 spectrum 1 weight 0.10000E+01 volume 0.12501E-01 ppm1 1.056 ppm2 0.818 CV 1
OR { 2372}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 78 and name HD1%)
ASSI { 2375}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 28 and name HB1 ))
4.000 2.000 2.000 peak 2375 spectrum 1 weight 0.10000E+01 volume 0.84508E-03 ppm1 1.057 ppm2 1.538 CV 1
OR { 2375}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 8 and name HG12))
OR { 2375}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 73 and name HB% )
OR { 2375}
( segid " " and resid 9 and name HG2%)
( segid " " and resid 51 and name HB% )
ASSI { 2381}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 52 and name HA ))
3.400 3.400 2.600 peak 2381 spectrum 1 weight 0.10000E+01 volume 0.42328E-02 ppm1 0.936 ppm2 4.187 CV 1
OR { 2381}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 76 and name HA ))
ASSI { 2423}
( segid " " and resid 67 and name HD1%)
( segid " " and resid 44 and name HE% )
2.800 1.000 1.000 peak 2423 spectrum 1 weight 0.10000E+01 volume 0.28830E-02 ppm1 0.437 ppm2 0.238 CV 1
OR { 2423}
( segid " " and resid 67 and name HD1%)
( segid " " and resid 59 and name HD1%)
ASSI { 2425}
( segid " " and resid 67 and name HD1%)
( segid " " and resid 12 and name HD1%)
3.900 1.900 1.900 peak 2425 spectrum 1 weight 0.10000E+01 volume 0.13991E-02 ppm1 0.438 ppm2 0.860 CV 1
OR { 2425}
( segid " " and resid 67 and name HD1%)
( segid " " and resid 12 and name HD2%)
OR { 2425}
( segid " " and resid 67 and name HD1%)
(( segid " " and resid 59 and name HG11))
ASSI { 2432}
( segid " " and resid 67 and name HD1%)
( segid " " and resid 48 and name HG1%)
3.700 1.700 1.700 peak 2432 spectrum 1 weight 0.10000E+01 volume 0.12372E-02 ppm1 0.438 ppm2 0.623 CV 1
OR { 2432}
( segid " " and resid 67 and name HD1%)
( segid " " and resid 70 and name HG2%)
ASSI { 2441}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 31 and name HA ))
3.900 1.900 1.900 peak 2441 spectrum 1 weight 0.10000E+01 volume 0.80583E-03 ppm1 1.371 ppm2 4.384 CV 1
OR { 2441}
(( segid " " and resid 28 and name HD1 ))
(( segid " " and resid 69 and name HB ))
ASSI { 2453}
( segid " " and resid 78 and name HD1%)
( segid " " and resid 70 and name HG2%)
3.300 3.300 2.700 peak 2453 spectrum 1 weight 0.10000E+01 volume 0.10388E-02 ppm1 0.827 ppm2 0.642 CV 1
OR { 2453}
( segid " " and resid 78 and name HD2%)
( segid " " and resid 59 and name HG2%)
OR { 2453}
( segid " " and resid 78 and name HD2%)
( segid " " and resid 70 and name HG2%)
ASSI { 2454}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 5 and name HA ))
2.700 0.900 0.900 peak 2454 spectrum 1 weight 0.10000E+01 volume 0.21914E-02 ppm1 0.828 ppm2 3.699 CV 1
OR { 2454}
( segid " " and resid 78 and name HD2%)
(( segid " " and resid 5 and name HA ))
OR { 2454}
( segid " " and resid 78 and name HD1%)
(( segid " " and resid 74 and name HA ))
ASSI { 2473}
( segid " " and resid 37 and name HD1%)
( segid " " and resid 27 and name HG2%)
2.500 0.800 0.800 peak 2473 spectrum 1 weight 0.10000E+01 volume 0.38350E-02 ppm1 0.592 ppm2 0.947 CV 1
OR { 2473}
( segid " " and resid 37 and name HD1%)
( segid " " and resid 39 and name HG2%)
ASSI { 2519}
(( segid " " and resid 54 and name HG1 ))
(( segid " " and resid 8 and name HG12))
3.700 3.700 2.300 peak 2519 spectrum 1 weight 0.10000E+01 volume 0.77595E-03 ppm1 0.699 ppm2 1.505 CV 1
OR { 2519}
(( segid " " and resid 54 and name HG1 ))
( segid " " and resid 2 and name HB% )
ASSI { 2543}
(( segid " " and resid 29 and name HG ))
( segid " " and resid 9 and name HG2%)
3.700 1.800 1.800 peak 2543 spectrum 1 weight 0.10000E+01 volume 0.10409E-02 ppm1 1.788 ppm2 1.056 CV 1
OR { 2543}
(( segid " " and resid 29 and name HG ))
( segid " " and resid 69 and name HG2%)
ASSI { 2551}
(( segid " " and resid 12 and name HG ))
(( segid " " and resid 71 and name HA2 ))
4.000 2.000 2.000 peak 2551 spectrum 1 weight 0.10000E+01 volume 0.82783E-03 ppm1 1.963 ppm2 4.036 CV 1
OR { 2551}
(( segid " " and resid 12 and name HG ))
(( segid " " and resid 44 and name HA ))
ASSI { 2576}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 48 and name HG1%)
2.700 0.900 0.900 peak 2576 spectrum 1 weight 0.10000E+01 volume 0.29888E-02 ppm1 0.851 ppm2 0.655 CV 1
OR { 2576}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 70 and name HG2%)
ASSI { 2580}
(( segid " " and resid 54 and name HG2 ))
( segid " " and resid 15 and name HD1%)
3.300 1.400 1.400 peak 2580 spectrum 1 weight 0.10000E+01 volume 0.51791E-02 ppm1 0.851 ppm2 0.762 CV 1
OR { 2580}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 15 and name HD1%)
OR { 2580}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 64 and name HG1%)
OR { 2580}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 27 and name HG1%)
ASSI { 2584}
( segid " " and resid 12 and name HD2%)
(( segid " " and resid 77 and name HG12))
3.100 1.200 1.200 peak 2584 spectrum 1 weight 0.10000E+01 volume 0.54775E-02 ppm1 0.850 ppm2 0.937 CV 1
OR { 2584}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 64 and name HG2%)
OR { 2584}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 57 and name HG1%)
OR { 2584}
(( segid " " and resid 54 and name HG2 ))
( segid " " and resid 57 and name HG1%)
OR { 2584}
( segid " " and resid 12 and name HD2%)
( segid " " and resid 27 and name HG2%)
ASSI { 2596}
( segid " " and resid 12 and name HD2%)
(( segid " " and resid 16 and name HA ))
3.900 1.900 1.900 peak 2596 spectrum 1 weight 0.10000E+01 volume 0.17205E-02 ppm1 0.848 ppm2 3.553 CV 1
OR { 2596}
( segid " " and resid 12 and name HD2%)
(( segid " " and resid 77 and name HA ))
OR { 2596}
( segid " " and resid 12 and name HD2%)
(( segid " " and resid 27 and name HA ))
ASSI { 2615}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 27 and name HG2%)
4.400 2.400 1.600 peak 2615 spectrum 1 weight 0.10000E+01 volume 0.13232E-02 ppm1 1.310 ppm2 0.947 CV 1
OR { 2615}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 39 and name HG2%)
ASSI { 2675}
(( segid " " and resid 15 and name HG12))
(( segid " " and resid 12 and name HA ))
4.600 2.600 1.400 peak 2675 spectrum 1 weight 0.10000E+01 volume 0.59835E-03 ppm1 1.986 ppm2 4.261 CV 1
OR { 2675}
(( segid " " and resid 15 and name HG12))
(( segid " " and resid 50 and name HA ))
ASSI { 2687}
(( segid " " and resid 15 and name HG11))
( segid " " and resid 50 and name HB% )
3.800 1.800 1.800 peak 2687 spectrum 1 weight 0.10000E+01 volume 0.16780E-02 ppm1 1.060 ppm2 1.562 CV 1
OR { 2687}
(( segid " " and resid 15 and name HG11))
(( segid " " and resid 54 and name HB2 ))
ASSI { 2689}
(( segid " " and resid 15 and name HG11))
(( segid " " and resid 12 and name HA ))
4.300 2.400 1.700 peak 2689 spectrum 1 weight 0.10000E+01 volume 0.55836E-03 ppm1 1.062 ppm2 4.262 CV 1
OR { 2689}
(( segid " " and resid 15 and name HG11))
(( segid " " and resid 50 and name HA ))
ASSI { 2739}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 22 and name HD1%)
4.200 2.200 1.800 peak 2739 spectrum 1 weight 0.10000E+01 volume 0.20504E-02 ppm1 4.384 ppm2 0.833 CV 1
OR { 2739}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 29 and name HD1%)
ASSI { 2746}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 16 and name HG1%)
4.200 2.200 1.800 peak 2746 spectrum 1 weight 0.10000E+01 volume 0.12135E-02 ppm1 4.450 ppm2 1.011 CV 1
OR { 2746}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 22 and name HG2%)
ASSI { 2748}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 27 and name HG2%)
4.700 2.700 1.300 peak 2748 spectrum 1 weight 0.10000E+01 volume 0.74284E-03 ppm1 4.453 ppm2 0.948 CV 1
OR { 2748}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 39 and name HG2%)
ASSI { 2770}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 15 and name HD1%)
4.400 2.400 1.600 peak 2770 spectrum 1 weight 0.10000E+01 volume 0.60614E-03 ppm1 4.254 ppm2 0.759 CV 1
OR { 2770}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 27 and name HG1%)
ASSI { 2772}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HN ))
3.000 1.100 1.100 peak 2772 spectrum 1 weight 0.10000E+01 volume 0.15096E-02 ppm1 3.979 ppm2 8.911 CV 1
OR { 2772}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name HN ))
ASSI { 2780}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 24 and name HG1%)
3.100 1.200 1.200 peak 2780 spectrum 1 weight 0.10000E+01 volume 0.20241E-02 ppm1 4.263 ppm2 1.000 CV 1
OR { 2780}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 49 and name HG1%)
ASSI { 2782}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 27 and name HG2%)
3.900 1.900 1.900 peak 2782 spectrum 1 weight 0.10000E+01 volume 0.15543E-02 ppm1 4.265 ppm2 0.956 CV 1
OR { 2782}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 57 and name HG1%)
OR { 2782}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 45 and name HG1%)
ASSI { 2784}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 53 and name HB2 ))
3.000 1.100 1.100 peak 2784 spectrum 1 weight 0.10000E+01 volume 0.17289E-02 ppm1 4.266 ppm2 2.160 CV 1
OR { 2784}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 52 and name HB1 ))
ASSI { 2787}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 24 and name HB ))
3.400 1.500 1.500 peak 2787 spectrum 1 weight 0.10000E+01 volume 0.19146E-02 ppm1 4.265 ppm2 2.074 CV 1
OR { 2787}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 49 and name HB ))
OR { 2787}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 53 and name HB1 ))
ASSI { 2797}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 54 and name HB2 ))
4.800 2.800 1.200 peak 2797 spectrum 1 weight 0.10000E+01 volume 0.51958E-03 ppm1 4.236 ppm2 1.584 CV 1
OR { 2797}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 3 and name HB% )
ASSI { 2818}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 49 and name HG2%)
3.100 1.200 1.200 peak 2818 spectrum 1 weight 0.10000E+01 volume 0.45229E-02 ppm1 4.238 ppm2 1.095 CV 1
OR { 2818}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 15 and name HG2%)
OR { 2818}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 54 and name HB1 ))
ASSI { 2824}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 10 and name HB% )
2.400 0.700 0.700 peak 2824 spectrum 1 weight 0.10000E+01 volume 0.74832E-02 ppm1 4.268 ppm2 1.545 CV 1
OR { 2824}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 50 and name HB% )
ASSI { 2847}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 16 and name HG1%)
4.600 2.600 1.400 peak 2847 spectrum 1 weight 0.10000E+01 volume 0.10316E-02 ppm1 4.060 ppm2 1.009 CV 1
OR { 2847}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 22 and name HG2%)
OR { 2847}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 24 and name HG1%)
ASSI { 2875}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 48 and name HG1%)
4.800 2.900 1.200 peak 2875 spectrum 1 weight 0.10000E+01 volume 0.97320E-03 ppm1 4.027 ppm2 0.637 CV 1
OR { 2875}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 47 and name HG1%)
ASSI { 2878}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 48 and name HG2%)
2.500 0.800 0.800 peak 2878 spectrum 1 weight 0.10000E+01 volume 0.32801E-02 ppm1 4.028 ppm2 0.962 CV 1
OR { 2878}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 39 and name HG2%)
OR { 2878}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 19 and name HG2%)
ASSI { 2917}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 8 and name HG12))
4.000 2.000 2.000 peak 2917 spectrum 1 weight 0.10000E+01 volume 0.13063E-02 ppm1 4.880 ppm2 1.538 CV 1
OR { 2917}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 51 and name HB% )
OR { 2917}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 2 and name HB% )
ASSI { 2931}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 42 and name HD2%)
3.500 1.500 1.500 peak 2931 spectrum 1 weight 0.10000E+01 volume 0.19330E-02 ppm1 4.288 ppm2 0.965 CV 1
OR { 2931}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 45 and name HG1%)
OR { 2931}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 48 and name HG2%)
ASSI { 2952}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 15 and name HG2%)
3.600 1.600 1.600 peak 2952 spectrum 1 weight 0.10000E+01 volume 0.12390E-02 ppm1 4.265 ppm2 1.092 CV 1
OR { 2952}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 74 and name HG2%)
ASSI { 2965}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 15 and name HD1%)
3.300 1.400 1.400 peak 2965 spectrum 1 weight 0.10000E+01 volume 0.38777E-02 ppm1 4.263 ppm2 0.764 CV 1
OR { 2965}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 27 and name HG1%)
OR { 2965}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 64 and name HG1%)
ASSI { 2969}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 39 and name HG1%)
3.200 3.200 2.800 peak 2969 spectrum 1 weight 0.10000E+01 volume 0.85670E-03 ppm1 4.059 ppm2 0.838 CV 1
OR { 2969}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 22 and name HD1%)
OR { 2969}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 59 and name HG11))
OR { 2969}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 12 and name HD2%)
ASSI { 3021}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 16 and name HG1%)
3.400 1.500 1.500 peak 3021 spectrum 1 weight 0.10000E+01 volume 0.13837E-02 ppm1 4.642 ppm2 1.004 CV 1
OR { 3021}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 22 and name HG2%)
OR { 3021}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 24 and name HG1%)
ASSI { 3030}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 22 and name HB ))
3.900 1.900 1.900 peak 3030 spectrum 1 weight 0.10000E+01 volume 0.83692E-03 ppm1 4.637 ppm2 1.665 CV 1
OR { 3030}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 19 and name HB ))
ASSI { 3032}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 49 and name HG2%)
3.900 1.900 1.900 peak 3032 spectrum 1 weight 0.10000E+01 volume 0.15526E-02 ppm1 4.147 ppm2 1.094 CV 1
OR { 3032}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HB1 ))
OR { 3032}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 74 and name HG2%)
ASSI { 3034}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 49 and name HG1%)
3.500 1.500 1.500 peak 3034 spectrum 1 weight 0.10000E+01 volume 0.15454E-02 ppm1 4.054 ppm2 0.996 CV 1
OR { 3034}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 22 and name HG2%)
ASSI { 3064}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 57 and name HG2%)
4.000 2.000 2.000 peak 3064 spectrum 1 weight 0.10000E+01 volume 0.19976E-02 ppm1 4.197 ppm2 1.005 CV 1
OR { 3064}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 49 and name HG1%)
ASSI { 3071}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 15 and name HG2%)
4.700 2.700 1.300 peak 3071 spectrum 1 weight 0.10000E+01 volume 0.56021E-03 ppm1 3.956 ppm2 1.082 CV 1
OR { 3071}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 15 and name HG2%)
ASSI { 3111}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 44 and name HB1 ))
4.200 2.200 1.800 peak 3111 spectrum 1 weight 0.10000E+01 volume 0.12386E-02 ppm1 4.012 ppm2 1.861 CV 1
OR { 3111}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HB1 ))
OR { 3111}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 42 and name HB2 ))
ASSI { 3156}
(( segid " " and resid 43 and name HB1 ))
( segid " " and resid 19 and name HG2%)
2.600 0.800 0.800 peak 3156 spectrum 1 weight 0.10000E+01 volume 0.22786E-02 ppm1 3.712 ppm2 0.967 CV 1
OR { 3156}
(( segid " " and resid 43 and name HB1 ))
( segid " " and resid 39 and name HG2%)
ASSI { 3166}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 69 and name HA ))
4.400 2.400 1.600 peak 3166 spectrum 1 weight 0.10000E+01 volume 0.59004E-03 ppm1 4.112 ppm2 5.248 CV 1
OR { 3166}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 69 and name HA ))
ASSI { 3181}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 39 and name HG2%)
4.100 2.100 1.900 peak 3181 spectrum 1 weight 0.10000E+01 volume 0.15701E-02 ppm1 4.100 ppm2 0.949 CV 1
OR { 3181}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 48 and name HG2%)
OR { 3181}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 27 and name HG2%)
ASSI { 3188}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 37 and name HG ))
3.200 1.300 1.300 peak 3188 spectrum 1 weight 0.10000E+01 volume 0.97694E-03 ppm1 4.100 ppm2 1.471 CV 1
OR { 3188}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 31 and name HG1 ))
ASSI { 3193}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 70 and name HG1%)
3.700 1.700 1.700 peak 3193 spectrum 1 weight 0.10000E+01 volume 0.25174E-02 ppm1 4.098 ppm2 0.459 CV 1
OR { 3193}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 67 and name HD1%)
ASSI { 3201}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 24 and name HG2%)
3.900 1.900 1.900 peak 3201 spectrum 1 weight 0.10000E+01 volume 0.21100E-02 ppm1 4.326 ppm2 1.012 CV 1
OR { 3201}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 22 and name HG2%)
ASSI { 3202}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 68 and name HB2 ))
4.300 2.300 1.700 peak 3202 spectrum 1 weight 0.10000E+01 volume 0.55264E-03 ppm1 4.103 ppm2 2.102 CV 1
OR { 3202}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 68 and name HB1 ))
OR { 3202}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 68 and name HB1 ))
ASSI { 3208}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 31 and name HD2 ))
3.400 1.400 1.400 peak 3208 spectrum 1 weight 0.10000E+01 volume 0.53553E-03 ppm1 3.552 ppm2 2.080 CV 1
OR { 3208}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HB2 ))
ASSI { 3213}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HN ))
2.700 0.900 0.900 peak 3213 spectrum 1 weight 0.10000E+01 volume 0.22009E-02 ppm1 3.553 ppm2 7.496 CV 1
OR { 3213}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 31 and name HN ))
ASSI { 3251}
(( segid " " and resid 70 and name HA ))
( segid " " and resid 12 and name HD2%)
3.800 1.800 1.800 peak 3251 spectrum 1 weight 0.10000E+01 volume 0.75058E-03 ppm1 3.334 ppm2 0.853 CV 1
OR { 3251}
(( segid " " and resid 70 and name HA ))
( segid " " and resid 39 and name HG1%)
ASSI { 3264}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 12 and name HD2%)
3.900 1.900 1.900 peak 3264 spectrum 1 weight 0.10000E+01 volume 0.12164E-02 ppm1 3.987 ppm2 0.856 CV 1
OR { 3264}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 59 and name HG11))
OR { 3264}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 54 and name HG2 ))
ASSI { 3265}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 13 and name HA ))
4.300 2.300 1.700 peak 3265 spectrum 1 weight 0.10000E+01 volume 0.85887E-03 ppm1 3.626 ppm2 4.063 CV 1
OR { 3265}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HA ))
ASSI { 3270}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 12 and name HD2%)
3.500 3.500 2.500 peak 3270 spectrum 1 weight 0.10000E+01 volume 0.23480E-02 ppm1 3.528 ppm2 0.862 CV 1
OR { 3270}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 59 and name HG11))
OR { 3270}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 12 and name HD2%)
OR { 3270}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 12 and name HD1%)
ASSI { 3301}
(( segid " " and resid 74 and name HA ))
( segid " " and resid 78 and name HD1%)
3.600 1.600 1.600 peak 3301 spectrum 1 weight 0.10000E+01 volume 0.15679E-02 ppm1 3.681 ppm2 0.847 CV 1
OR { 3301}
(( segid " " and resid 74 and name HA ))
( segid " " and resid 78 and name HD2%)
OR { 3301}
(( segid " " and resid 74 and name HA ))
( segid " " and resid 12 and name HD2%)
ASSI { 3307}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 47 and name HG1%)
4.100 2.100 1.900 peak 3307 spectrum 1 weight 0.10000E+01 volume 0.79869E-03 ppm1 3.568 ppm2 0.638 CV 1
OR { 3307}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 48 and name HG1%)
ASSI { 3309}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 70 and name HG2%)
3.700 1.700 1.700 peak 3309 spectrum 1 weight 0.10000E+01 volume 0.13436E-02 ppm1 3.392 ppm2 0.643 CV 1
OR { 3309}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 48 and name HG1%)
ASSI { 3318}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 12 and name HD2%)
3.900 1.900 1.900 peak 3318 spectrum 1 weight 0.10000E+01 volume 0.23855E-02 ppm1 3.391 ppm2 0.847 CV 1
OR { 3318}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 78 and name HD1%)
OR { 3318}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 78 and name HD2%)
ASSI { 3324}
(( segid " " and resid 74 and name HB ))
( segid " " and resid 78 and name HD1%)
2.800 1.000 1.000 peak 3324 spectrum 1 weight 0.10000E+01 volume 0.22195E-02 ppm1 4.199 ppm2 0.821 CV 1
OR { 3324}
(( segid " " and resid 74 and name HB ))
( segid " " and resid 29 and name HD1%)
Contact the webmaster for help, if required. Friday, May 10, 2024 5:45:16 AM GMT (wattos1)