NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
457038 |
2knz   |
16484 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
ASSI { 1}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 47 and name HN ))
2.600 0.900 0.900 peak 1 spectrum 1 weight 0.11000E+01 volume 0.34793E-02 ppm1 2.963 ppm2 8.390 CV 1
ASSI { 1}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HN ))
2.800 1.000 1.000 peak 1 spectrum 1 weight 0.11000E+01 volume 0.20879E-02 ppm1 3.617 ppm2 8.632 CV 1
ASSI { 2}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 11 and name HD% )
3.100 3.100 2.900 peak 2 spectrum 1 weight 0.11000E+01 volume 0.54512E-02 ppm1 3.616 ppm2 7.017 CV 1
ASSI { 3}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name HN ))
3.500 3.500 2.500 peak 3 spectrum 1 weight 0.11000E+01 volume 0.10076E-02 ppm1 3.613 ppm2 7.703 CV 1
ASSI { 6}
(( segid " " and resid 5 and name HB1 ))
(( segid " " and resid 5 and name HN ))
2.900 1.100 1.100 peak 6 spectrum 1 weight 0.11000E+01 volume 0.54999E-02 ppm1 3.780 ppm2 8.092 CV 1
ASSI { 8}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HN ))
2.700 0.900 0.900 peak 8 spectrum 1 weight 0.11000E+01 volume 0.34384E-02 ppm1 3.883 ppm2 7.991 CV 1
ASSI { 9}
(( segid " " and resid 50 and name HB1 ))
(( segid " " and resid 50 and name HN ))
3.100 1.200 1.200 peak 9 spectrum 1 weight 0.11000E+01 volume 0.40875E-02 ppm1 3.844 ppm2 7.990 CV 1
ASSI { 10}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 3 and name HN ))
2.400 0.700 0.700 peak 10 spectrum 1 weight 0.11000E+01 volume 0.59684E-02 ppm1 4.418 ppm2 8.638 CV 1
ASSI { 15}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HN ))
2.700 0.900 0.900 peak 15 spectrum 1 weight 0.11000E+01 volume 0.33369E-02 ppm1 4.509 ppm2 7.687 CV 1
ASSI { 18}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 27 and name HN ))
3.400 1.400 1.400 peak 18 spectrum 1 weight 0.11000E+01 volume 0.96579E-03 ppm1 3.767 ppm2 8.337 CV 1
ASSI { 20}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HN ))
2.700 0.900 0.900 peak 20 spectrum 1 weight 0.11000E+01 volume 0.31437E-02 ppm1 3.969 ppm2 8.296 CV 1
ASSI { 21}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HN ))
2.800 1.000 1.000 peak 21 spectrum 1 weight 0.11000E+01 volume 0.31748E-02 ppm1 3.873 ppm2 7.227 CV 1
ASSI { 22}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HN ))
2.300 0.700 0.700 peak 22 spectrum 1 weight 0.11000E+01 volume 0.56244E-02 ppm1 4.106 ppm2 7.880 CV 1
ASSI { 23}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HN ))
2.800 1.000 1.000 peak 23 spectrum 1 weight 0.11000E+01 volume 0.25938E-02 ppm1 4.101 ppm2 8.301 CV 1
ASSI { 24}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HN ))
2.700 0.900 0.900 peak 24 spectrum 1 weight 0.11000E+01 volume 0.29968E-02 ppm1 4.062 ppm2 9.042 CV 1
ASSI { 25}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HN ))
2.600 0.800 0.800 peak 25 spectrum 1 weight 0.11000E+01 volume 0.49182E-02 ppm1 4.039 ppm2 8.296 CV 1
ASSI { 26}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HN ))
2.800 1.000 1.000 peak 26 spectrum 1 weight 0.11000E+01 volume 0.27858E-02 ppm1 4.416 ppm2 7.991 CV 1
ASSI { 27}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 51 and name HN ))
2.600 0.900 0.900 peak 27 spectrum 1 weight 0.11000E+01 volume 0.37863E-02 ppm1 4.415 ppm2 8.292 CV 1
ASSI { 29}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HN ))
2.800 1.000 1.000 peak 29 spectrum 1 weight 0.11000E+01 volume 0.31872E-02 ppm1 4.024 ppm2 7.463 CV 1
ASSI { 30}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HN ))
2.400 0.700 0.700 peak 30 spectrum 1 weight 0.11000E+01 volume 0.62349E-02 ppm1 3.865 ppm2 8.121 CV 1
ASSI { 31}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 16 and name HN ))
2.700 0.900 0.900 peak 31 spectrum 1 weight 0.11000E+01 volume 0.31348E-02 ppm1 3.849 ppm2 7.887 CV 1
ASSI { 33}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HN ))
2.500 0.800 0.800 peak 33 spectrum 1 weight 0.11000E+01 volume 0.63377E-02 ppm1 4.372 ppm2 8.499 CV 1
ASSI { 34}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
2.900 1.100 1.100 peak 34 spectrum 1 weight 0.11000E+01 volume 0.26403E-02 ppm1 4.372 ppm2 8.087 CV 1
ASSI { 37}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
2.200 0.600 0.600 peak 37 spectrum 1 weight 0.11000E+01 volume 0.55414E-02 ppm1 4.617 ppm2 7.768 CV 1
ASSI { 38}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 23 and name HD% )
3.200 1.200 1.200 peak 38 spectrum 1 weight 0.11000E+01 volume 0.12436E-02 ppm1 4.615 ppm2 7.236 CV 1
ASSI { 39}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HN ))
2.500 0.800 0.800 peak 39 spectrum 1 weight 0.11000E+01 volume 0.47090E-02 ppm1 4.356 ppm2 7.910 CV 1
ASSI { 40}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 46 and name HN ))
4.800 2.900 1.200 peak 40 spectrum 1 weight 0.11000E+01 volume 0.48803E-03 ppm1 3.929 ppm2 7.459 CV 1
ASSI { 41}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HN ))
2.600 0.800 0.800 peak 41 spectrum 1 weight 0.11000E+01 volume 0.42758E-02 ppm1 3.933 ppm2 8.374 CV 1
ASSI { 42}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HN ))
2.800 1.000 1.000 peak 42 spectrum 1 weight 0.11000E+01 volume 0.16546E-02 ppm1 3.593 ppm2 8.062 CV 1
ASSI { 43}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HN ))
2.600 0.900 0.900 peak 43 spectrum 1 weight 0.11000E+01 volume 0.34384E-02 ppm1 4.317 ppm2 7.931 CV 1
ASSI { 45}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HN ))
2.700 0.900 0.900 peak 45 spectrum 1 weight 0.11000E+01 volume 0.34823E-02 ppm1 4.346 ppm2 7.648 CV 1
ASSI { 46}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HN ))
2.300 0.600 0.600 peak 46 spectrum 1 weight 0.11000E+01 volume 0.10836E-01 ppm1 4.320 ppm2 8.291 CV 1
ASSI { 48}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 6 and name HN ))
3.100 3.100 2.900 peak 48 spectrum 1 weight 0.11000E+01 volume 0.43498E-02 ppm1 4.261 ppm2 8.515 CV 1
ASSI { 49}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HN ))
2.600 0.800 0.800 peak 49 spectrum 1 weight 0.11000E+01 volume 0.38948E-02 ppm1 4.261 ppm2 8.449 CV 1
ASSI { 54}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HN ))
2.700 0.900 0.900 peak 54 spectrum 1 weight 0.11000E+01 volume 0.40134E-02 ppm1 4.373 ppm2 7.954 CV 1
ASSI { 56}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HN ))
2.600 0.800 0.800 peak 56 spectrum 1 weight 0.11000E+01 volume 0.51202E-02 ppm1 4.125 ppm2 7.708 CV 1
ASSI { 59}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HN ))
2.900 1.000 1.000 peak 59 spectrum 1 weight 0.11000E+01 volume 0.24460E-02 ppm1 4.139 ppm2 8.084 CV 1
ASSI { 62}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 38 and name HN ))
3.200 3.200 2.800 peak 62 spectrum 1 weight 0.11000E+01 volume 0.63485E-02 ppm1 4.521 ppm2 8.835 CV 1
ASSI { 65}
(( segid " " and resid 37 and name HA1 ))
( segid " " and resid 11 and name HE% )
4.800 4.800 1.200 peak 65 spectrum 1 weight 0.11000E+01 volume 0.53227E-03 ppm1 3.980 ppm2 7.007 CV 1
ASSI { 66}
(( segid " " and resid 37 and name HA2 ))
(( segid " " and resid 36 and name HN ))
3.300 1.400 1.400 peak 66 spectrum 1 weight 0.11000E+01 volume 0.83128E-02 ppm1 3.979 ppm2 7.636 CV 1
ASSI { 69}
(( segid " " and resid 49 and name HA1 ))
(( segid " " and resid 49 and name HN ))
2.900 1.000 1.000 peak 69 spectrum 1 weight 0.11000E+01 volume 0.26264E-02 ppm1 3.908 ppm2 7.817 CV 1
ASSI { 72}
(( segid " " and resid 38 and name HA2 ))
( segid " " and resid 11 and name HD% )
3.100 3.100 2.900 peak 72 spectrum 1 weight 0.11000E+01 volume 0.15104E-02 ppm1 3.974 ppm2 7.021 CV 1
ASSI { 73}
(( segid " " and resid 4 and name HA1 ))
(( segid " " and resid 4 and name HN ))
2.300 0.700 0.700 peak 73 spectrum 1 weight 0.11000E+01 volume 0.80896E-02 ppm1 3.880 ppm2 8.494 CV 1
ASSI { 75}
(( segid " " and resid 22 and name HA2 ))
(( segid " " and resid 21 and name HN ))
3.600 1.600 1.600 peak 75 spectrum 1 weight 0.11000E+01 volume 0.33492E-02 ppm1 4.074 ppm2 7.676 CV 1
ASSI { 76}
(( segid " " and resid 4 and name HA1 ))
(( segid " " and resid 5 and name HN ))
2.600 0.800 0.800 peak 76 spectrum 1 weight 0.11000E+01 volume 0.59725E-02 ppm1 3.879 ppm2 8.091 CV 1
ASSI { 77}
(( segid " " and resid 22 and name HA1 ))
(( segid " " and resid 22 and name HN ))
2.900 1.000 1.000 peak 77 spectrum 1 weight 0.11000E+01 volume 0.42050E-02 ppm1 3.445 ppm2 7.827 CV 1
ASSI { 78}
(( segid " " and resid 22 and name HA1 ))
(( segid " " and resid 21 and name HN ))
3.400 1.500 1.500 peak 78 spectrum 1 weight 0.11000E+01 volume 0.45507E-02 ppm1 3.445 ppm2 7.672 CV 1
ASSI { 79}
(( segid " " and resid 26 and name HD1 ))
(( segid " " and resid 26 and name HH11))
4.300 2.300 1.700 peak 79 spectrum 1 weight 0.11000E+01 volume 0.54968E-03 ppm1 3.181 ppm2 7.553 CV 1
ASSI { 81}
(( segid " " and resid 10 and name HD2 ))
(( segid " " and resid 10 and name HH11))
3.400 1.500 1.500 peak 81 spectrum 1 weight 0.11000E+01 volume 0.51982E-03 ppm1 2.788 ppm2 7.034 CV 1
ASSI { 88}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HH11))
3.100 1.200 1.200 peak 88 spectrum 1 weight 0.11000E+01 volume 0.81008E-03 ppm1 2.913 ppm2 7.421 CV 1
ASSI { 89}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HN ))
3.000 3.000 3.000 peak 89 spectrum 1 weight 0.11000E+01 volume 0.10193E-02 ppm1 1.803 ppm2 8.390 CV 1
ASSI { 92}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 52 and name HN ))
3.000 1.100 1.100 peak 92 spectrum 1 weight 0.11000E+01 volume 0.47753E-02 ppm1 1.614 ppm2 8.290 CV 1
ASSI { 93}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HN ))
2.700 2.700 3.300 peak 93 spectrum 1 weight 0.11000E+01 volume 0.35490E-02 ppm1 1.594 ppm2 8.290 CV 1
ASSI { 94}
(( segid " " and resid 3 and name HB1 ))
(( segid " " and resid 3 and name HN ))
3.600 1.600 1.600 peak 94 spectrum 1 weight 0.11000E+01 volume 0.11673E-02 ppm1 1.536 ppm2 8.640 CV 1
ASSI { 95}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 48 and name HN ))
2.400 2.400 3.600 peak 95 spectrum 1 weight 0.11000E+01 volume 0.31659E-02 ppm1 1.507 ppm2 8.384 CV 1
ASSI { 100}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HN ))
3.100 1.200 1.200 peak 100 spectrum 1 weight 0.11000E+01 volume 0.30276E-02 ppm1 1.868 ppm2 8.420 CV 1
ASSI { 101}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 30 and name HN ))
2.600 2.600 3.400 peak 101 spectrum 1 weight 0.11000E+01 volume 0.25966E-02 ppm1 1.600 ppm2 8.423 CV 1
ASSI { 104}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HN ))
2.300 0.600 0.600 peak 104 spectrum 1 weight 0.11000E+01 volume 0.45273E-02 ppm1 2.888 ppm2 7.918 CV 1
ASSI { 106}
(( segid " " and resid 19 and name HB1 ))
(( segid " " and resid 19 and name HN ))
2.600 0.800 0.800 peak 106 spectrum 1 weight 0.11000E+01 volume 0.48749E-02 ppm1 2.733 ppm2 7.919 CV 1
ASSI { 109}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 38 and name HN ))
2.600 2.600 3.400 peak 109 spectrum 1 weight 0.11000E+01 volume 0.14278E-02 ppm1 1.674 ppm2 8.842 CV 1
ASSI { 113}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 44 and name HN ))
2.600 0.800 0.800 peak 113 spectrum 1 weight 0.11000E+01 volume 0.52681E-02 ppm1 1.726 ppm2 8.249 CV 1
ASSI { 116}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HD21))
2.400 0.700 0.700 peak 116 spectrum 1 weight 0.11000E+01 volume 0.42662E-02 ppm1 2.822 ppm2 7.929 CV 1
ASSI { 117}
(( segid " " and resid 41 and name HB1 ))
(( segid " " and resid 41 and name HD21))
3.000 1.200 1.200 peak 117 spectrum 1 weight 0.11000E+01 volume 0.47379E-02 ppm1 2.666 ppm2 7.929 CV 1
ASSI { 118}
(( segid " " and resid 8 and name HG1 ))
(( segid " " and resid 8 and name HN ))
3.900 1.900 1.900 peak 118 spectrum 1 weight 0.11000E+01 volume 0.92367E-03 ppm1 2.183 ppm2 9.221 CV 1
ASSI { 119}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 27 and name HN ))
2.600 0.800 0.800 peak 119 spectrum 1 weight 0.11000E+01 volume 0.34396E-02 ppm1 2.278 ppm2 8.293 CV 1
ASSI { 120}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HN ))
3.800 3.800 2.200 peak 120 spectrum 1 weight 0.11000E+01 volume 0.15878E-02 ppm1 2.446 ppm2 7.860 CV 1
ASSI { 121}
(( segid " " and resid 45 and name HG2 ))
(( segid " " and resid 45 and name HN ))
3.000 1.100 1.100 peak 121 spectrum 1 weight 0.11000E+01 volume 0.18923E-02 ppm1 2.360 ppm2 7.228 CV 1
ASSI { 122}
(( segid " " and resid 16 and name HG1 ))
(( segid " " and resid 16 and name HN ))
2.800 0.900 0.900 peak 122 spectrum 1 weight 0.11000E+01 volume 0.10177E-02 ppm1 2.316 ppm2 7.854 CV 1
ASSI { 123}
(( segid " " and resid 45 and name HG2 ))
(( segid " " and resid 46 and name HN ))
5.000 3.100 1.000 peak 123 spectrum 1 weight 0.11000E+01 volume 0.20401E-03 ppm1 2.361 ppm2 7.463 CV 1
ASSI { 125}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HN ))
3.200 1.300 1.300 peak 125 spectrum 1 weight 0.11000E+01 volume 0.66444E-03 ppm1 2.452 ppm2 9.040 CV 1
ASSI { 126}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 13 and name HN ))
4.800 2.900 1.200 peak 126 spectrum 1 weight 0.11000E+01 volume 0.57240E-03 ppm1 2.347 ppm2 9.044 CV 1
ASSI { 127}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HN ))
2.700 0.900 0.900 peak 127 spectrum 1 weight 0.11000E+01 volume 0.41562E-02 ppm1 2.471 ppm2 7.893 CV 1
ASSI { 129}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 23 and name HN ))
2.300 2.300 3.700 peak 129 spectrum 1 weight 0.11000E+01 volume 0.45823E-02 ppm1 2.435 ppm2 7.889 CV 1
ASSI { 130}
(( segid " " and resid 17 and name HG1 ))
(( segid " " and resid 17 and name HN ))
3.400 1.500 1.500 peak 130 spectrum 1 weight 0.11000E+01 volume 0.36587E-02 ppm1 2.335 ppm2 8.293 CV 1
ASSI { 131}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 10 and name HN ))
2.900 1.100 1.100 peak 131 spectrum 1 weight 0.11000E+01 volume 0.17585E-02 ppm1 2.065 ppm2 8.116 CV 1
ASSI { 132}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 9 and name HN ))
3.000 1.100 1.100 peak 132 spectrum 1 weight 0.11000E+01 volume 0.11267E-02 ppm1 2.064 ppm2 7.539 CV 1
ASSI { 133}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HN ))
2.900 1.100 1.100 peak 133 spectrum 1 weight 0.11000E+01 volume 0.14958E-02 ppm1 1.328 ppm2 8.140 CV 1
ASSI { 134}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 10 and name HN ))
3.800 1.800 1.800 peak 134 spectrum 1 weight 0.11000E+01 volume 0.15119E-02 ppm1 1.054 ppm2 8.142 CV 1
ASSI { 135}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 47 and name HN ))
2.400 0.700 0.700 peak 135 spectrum 1 weight 0.11000E+01 volume 0.39634E-02 ppm1 1.845 ppm2 8.354 CV 1
ASSI { 136}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HN ))
2.300 0.600 0.600 peak 136 spectrum 1 weight 0.11000E+01 volume 0.50882E-02 ppm1 1.842 ppm2 7.461 CV 1
ASSI { 137}
(( segid " " and resid 16 and name HB1 ))
(( segid " " and resid 16 and name HN ))
2.900 1.000 1.000 peak 137 spectrum 1 weight 0.11000E+01 volume 0.79759E-02 ppm1 2.152 ppm2 7.852 CV 1
ASSI { 138}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HN ))
2.300 0.700 0.700 peak 138 spectrum 1 weight 0.11000E+01 volume 0.73758E-02 ppm1 2.118 ppm2 8.293 CV 1
ASSI { 140}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 46 and name HN ))
2.800 2.800 3.200 peak 140 spectrum 1 weight 0.11000E+01 volume 0.27652E-02 ppm1 2.011 ppm2 7.466 CV 1
ASSI { 143}
(( segid " " and resid 8 and name HB1 ))
(( segid " " and resid 8 and name HN ))
3.300 1.400 1.400 peak 143 spectrum 1 weight 0.11000E+01 volume 0.24830E-02 ppm1 1.918 ppm2 9.218 CV 1
ASSI { 144}
(( segid " " and resid 12 and name HB1 ))
(( segid " " and resid 12 and name HN ))
3.300 1.300 1.300 peak 144 spectrum 1 weight 0.11000E+01 volume 0.98896E-03 ppm1 2.090 ppm2 7.385 CV 1
ASSI { 145}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HN ))
2.700 0.900 0.900 peak 145 spectrum 1 weight 0.11000E+01 volume 0.24328E-02 ppm1 2.217 ppm2 8.294 CV 1
ASSI { 146}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 32 and name HN ))
2.700 0.900 0.900 peak 146 spectrum 1 weight 0.11000E+01 volume 0.28444E-02 ppm1 2.069 ppm2 8.051 CV 1
ASSI { 149}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 14 and name HN ))
2.400 0.700 0.700 peak 149 spectrum 1 weight 0.11000E+01 volume 0.37809E-02 ppm1 2.047 ppm2 9.295 CV 1
ASSI { 150}
(( segid " " and resid 13 and name HB1 ))
(( segid " " and resid 13 and name HN ))
2.800 1.000 1.000 peak 150 spectrum 1 weight 0.11000E+01 volume 0.95339E-02 ppm1 2.047 ppm2 9.042 CV 1
ASSI { 151}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HN ))
2.200 0.600 0.600 peak 151 spectrum 1 weight 0.11000E+01 volume 0.79128E-02 ppm1 2.046 ppm2 7.891 CV 1
ASSI { 157}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 18 and name HN ))
3.500 1.500 1.500 peak 157 spectrum 1 weight 0.11000E+01 volume 0.19017E-02 ppm1 0.498 ppm2 8.752 CV 1
ASSI { 159}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 24 and name HN ))
4.500 2.500 1.500 peak 159 spectrum 1 weight 0.11000E+01 volume 0.11770E-02 ppm1 1.095 ppm2 7.757 CV 1
ASSI { 160}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 48 and name HN ))
3.700 1.700 1.700 peak 160 spectrum 1 weight 0.11000E+01 volume 0.17600E-02 ppm1 0.875 ppm2 8.391 CV 1
ASSI { 161}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 23 and name HZ ))
3.200 1.200 1.200 peak 161 spectrum 1 weight 0.11000E+01 volume 0.19402E-02 ppm1 0.877 ppm2 7.138 CV 1
ASSI { 162}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 15 and name HN ))
5.000 3.200 1.000 peak 162 spectrum 1 weight 0.11000E+01 volume 0.32204E-03 ppm1 0.894 ppm2 8.743 CV 1
ASSI { 164}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 29 and name HN ))
5.500 3.800 0.500 peak 164 spectrum 1 weight 0.11000E+01 volume 0.28664E-03 ppm1 0.788 ppm2 8.616 CV 1
ASSI { 165}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 30 and name HN ))
3.200 1.300 1.300 peak 165 spectrum 1 weight 0.11000E+01 volume 0.10987E-02 ppm1 0.796 ppm2 8.421 CV 1
ASSI { 166}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 30 and name HN ))
5.100 3.200 0.900 peak 166 spectrum 1 weight 0.11000E+01 volume 0.36541E-03 ppm1 0.937 ppm2 8.423 CV 1
ASSI { 167}
( segid " " and resid 30 and name HD1%)
( segid " " and resid 11 and name HD% )
3.400 3.400 2.600 peak 167 spectrum 1 weight 0.11000E+01 volume 0.23756E-02 ppm1 0.935 ppm2 7.017 CV 1
ASSI { 168}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name HN ))
3.800 1.800 1.800 peak 168 spectrum 1 weight 0.11000E+01 volume 0.11207E-02 ppm1 0.496 ppm2 8.753 CV 1
ASSI { 169}
( segid " " and resid 18 and name HD1%)
( segid " " and resid 23 and name HD% )
3.500 3.500 2.500 peak 169 spectrum 1 weight 0.11000E+01 volume 0.21691E-02 ppm1 0.496 ppm2 7.219 CV 1
ASSI { 171}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 48 and name HN ))
3.100 1.200 1.200 peak 171 spectrum 1 weight 0.11000E+01 volume 0.20681E-02 ppm1 0.983 ppm2 8.381 CV 1
ASSI { 172}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 23 and name HZ ))
2.500 0.800 0.800 peak 172 spectrum 1 weight 0.11000E+01 volume 0.70858E-02 ppm1 0.984 ppm2 7.119 CV 1
ASSI { 173}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 47 and name HN ))
3.400 1.400 1.400 peak 173 spectrum 1 weight 0.11000E+01 volume 0.29094E-02 ppm1 0.724 ppm2 8.369 CV 1
ASSI { 178}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 43 and name HN ))
3.300 1.400 1.400 peak 178 spectrum 1 weight 0.11000E+01 volume 0.88877E-03 ppm1 0.945 ppm2 8.332 CV 1
ASSI { 179}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 36 and name HN ))
2.600 2.600 3.400 peak 179 spectrum 1 weight 0.11000E+01 volume 0.32252E-02 ppm1 0.945 ppm2 7.691 CV 1
ASSI { 180}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 46 and name HH12))
3.000 3.000 3.000 peak 180 spectrum 1 weight 0.11000E+01 volume 0.48664E-02 ppm1 0.945 ppm2 7.578 CV 1
ASSI { 181}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 35 and name HN ))
2.200 0.600 0.600 peak 181 spectrum 1 weight 0.11000E+01 volume 0.96912E-02 ppm1 1.433 ppm2 7.710 CV 1
ASSI { 182}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 39 and name HN ))
4.300 2.300 1.700 peak 182 spectrum 1 weight 0.11000E+01 volume 0.97115E-03 ppm1 1.358 ppm2 6.861 CV 1
ASSI { 183}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 43 and name HN ))
2.700 2.700 3.300 peak 183 spectrum 1 weight 0.11000E+01 volume 0.37051E-02 ppm1 1.357 ppm2 8.335 CV 1
ASSI { 185}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 24 and name HN ))
3.200 1.300 1.300 peak 185 spectrum 1 weight 0.11000E+01 volume 0.40646E-02 ppm1 0.788 ppm2 7.764 CV 1
ASSI { 186}
( segid " " and resid 32 and name HB% )
(( segid " " and resid 32 and name HN ))
2.100 0.500 0.500 peak 186 spectrum 1 weight 0.11000E+01 volume 0.12109E-01 ppm1 1.330 ppm2 8.057 CV 1
ASSI { 188}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 44 and name HN ))
6.000 5.300 0.000 peak 188 spectrum 1 weight 0.11000E+01 volume 0.21097E-03 ppm1 2.116 ppm2 8.282 CV 1
ASSI { 191}
( segid " " and resid 28 and name HB% )
(( segid " " and resid 29 and name HN ))
2.700 2.700 3.300 peak 191 spectrum 1 weight 0.11000E+01 volume 0.34307E-02 ppm1 1.286 ppm2 8.612 CV 1
ASSI { 193}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 33 and name HN ))
3.500 1.600 1.600 peak 193 spectrum 1 weight 0.11000E+01 volume 0.81919E-03 ppm1 1.103 ppm2 8.061 CV 1
ASSI { 194}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 44 and name HN ))
2.200 2.200 3.800 peak 194 spectrum 1 weight 0.11000E+01 volume 0.77532E-02 ppm1 1.098 ppm2 8.302 CV 1
ASSI { 198}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 45 and name HN ))
2.900 2.900 3.100 peak 198 spectrum 1 weight 0.11000E+01 volume 0.72251E-02 ppm1 0.812 ppm2 7.196 CV 1
ASSI { 199}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 34 and name HN ))
3.800 1.800 1.800 peak 199 spectrum 1 weight 0.11000E+01 volume 0.18181E-02 ppm1 0.892 ppm2 8.632 CV 1
ASSI { 200}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 35 and name HN ))
3.300 1.400 1.400 peak 200 spectrum 1 weight 0.11000E+01 volume 0.22957E-02 ppm1 0.892 ppm2 7.709 CV 1
ASSI { 201}
( segid " " and resid 34 and name HG2%)
( segid " " and resid 11 and name HD% )
4.500 4.500 1.500 peak 201 spectrum 1 weight 0.11000E+01 volume 0.74524E-03 ppm1 0.892 ppm2 7.012 CV 1
ASSI { 203}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 18 and name HN ))
4.000 4.000 2.000 peak 203 spectrum 1 weight 0.11000E+01 volume 0.28575E-02 ppm1 0.830 ppm2 8.820 CV 1
ASSI { 204}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 41 and name HN ))
2.500 0.800 0.800 peak 204 spectrum 1 weight 0.11000E+01 volume 0.44217E-02 ppm1 0.832 ppm2 7.931 CV 1
ASSI { 205}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 44 and name HN ))
3.300 1.400 1.400 peak 205 spectrum 1 weight 0.11000E+01 volume 0.39302E-02 ppm1 0.755 ppm2 8.251 CV 1
ASSI { 206}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 45 and name HN ))
3.300 3.300 2.700 peak 206 spectrum 1 weight 0.11000E+01 volume 0.34802E-02 ppm1 0.753 ppm2 7.224 CV 1
ASSI { 207}
( segid " " and resid 34 and name HD1%)
(( segid " " and resid 34 and name HN ))
3.800 1.800 1.800 peak 207 spectrum 1 weight 0.11000E+01 volume 0.23883E-02 ppm1 0.834 ppm2 8.631 CV 1
ASSI { 208}
( segid " " and resid 34 and name HD1%)
( segid " " and resid 11 and name HD% )
2.400 2.400 3.600 peak 208 spectrum 1 weight 0.11000E+01 volume 0.23714E-02 ppm1 0.830 ppm2 7.016 CV 1
ASSI { 209}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 24 and name HN ))
2.600 0.900 0.900 peak 209 spectrum 1 weight 0.11000E+01 volume 0.32968E-02 ppm1 0.817 ppm2 7.747 CV 1
ASSI { 210}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 18 and name HN ))
3.500 1.500 1.500 peak 210 spectrum 1 weight 0.11000E+01 volume 0.10532E-02 ppm1 0.796 ppm2 8.758 CV 1
ASSI { 216}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HA ))
3.300 1.300 1.300 peak 216 spectrum 1 weight 0.11000E+01 volume 0.16064E-02 ppm1 1.635 ppm2 4.284 CV 1
ASSI { 217}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 52 and name HA ))
2.800 1.000 1.000 peak 217 spectrum 1 weight 0.11000E+01 volume 0.22597E-02 ppm1 1.604 ppm2 4.363 CV 1
ASSI { 218}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 48 and name HA ))
2.600 0.800 0.800 peak 218 spectrum 1 weight 0.11000E+01 volume 0.46026E-02 ppm1 1.522 ppm2 4.264 CV 1
ASSI { 219}
(( segid " " and resid 15 and name HB1 ))
(( segid " " and resid 15 and name HA ))
2.200 0.600 0.600 peak 219 spectrum 1 weight 0.11000E+01 volume 0.46292E-02 ppm1 1.482 ppm2 3.856 CV 1
ASSI { 223}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 40 and name HA ))
2.500 0.800 0.800 peak 223 spectrum 1 weight 0.11000E+01 volume 0.34970E-02 ppm1 1.671 ppm2 3.531 CV 1
ASSI { 224}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 25 and name HB2 ))
2.000 0.500 0.500 peak 224 spectrum 1 weight 0.11000E+01 volume 0.60627E-02 ppm1 2.592 ppm2 3.334 CV 1
ASSI { 226}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 27 and name HA ))
3.100 1.200 1.200 peak 226 spectrum 1 weight 0.11000E+01 volume 0.40605E-02 ppm1 2.278 ppm2 3.969 CV 1
ASSI { 228}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HA ))
2.900 1.100 1.100 peak 228 spectrum 1 weight 0.11000E+01 volume 0.16914E-02 ppm1 2.442 ppm2 4.094 CV 1
ASSI { 230}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HA ))
3.200 1.300 1.300 peak 230 spectrum 1 weight 0.11000E+01 volume 0.10772E-02 ppm1 2.474 ppm2 3.879 CV 1
ASSI { 234}
(( segid " " and resid 12 and name HG1 ))
(( segid " " and resid 12 and name HA ))
2.200 0.600 0.600 peak 234 spectrum 1 weight 0.11000E+01 volume 0.71945E-02 ppm1 2.412 ppm2 3.877 CV 1
ASSI { 235}
(( segid " " and resid 2 and name HB2 ))
(( segid " " and resid 2 and name HA ))
3.300 1.300 1.300 peak 235 spectrum 1 weight 0.11000E+01 volume 0.25287E-02 ppm1 2.260 ppm2 4.416 CV 1
ASSI { 237}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 9 and name HA ))
3.000 1.100 1.100 peak 237 spectrum 1 weight 0.11000E+01 volume 0.22530E-02 ppm1 2.062 ppm2 3.876 CV 1
ASSI { 239}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HD2 ))
3.400 1.500 1.500 peak 239 spectrum 1 weight 0.11000E+01 volume 0.87917E-03 ppm1 2.238 ppm2 3.828 CV 1
ASSI { 240}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HA ))
3.300 1.300 1.300 peak 240 spectrum 1 weight 0.11000E+01 volume 0.23917E-02 ppm1 2.237 ppm2 3.910 CV 1
ASSI { 241}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 7 and name HD1 ))
4.200 2.200 1.800 peak 241 spectrum 1 weight 0.11000E+01 volume 0.11577E-02 ppm1 1.875 ppm2 3.805 CV 1
ASSI { 243}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HA ))
3.100 1.200 1.200 peak 243 spectrum 1 weight 0.11000E+01 volume 0.32628E-02 ppm1 1.328 ppm2 3.875 CV 1
ASSI { 245}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 10 and name HA ))
2.700 0.900 0.900 peak 245 spectrum 1 weight 0.11000E+01 volume 0.27709E-02 ppm1 1.047 ppm2 3.875 CV 1
ASSI { 247}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
2.800 1.000 1.000 peak 247 spectrum 1 weight 0.11000E+01 volume 0.48952E-02 ppm1 1.838 ppm2 4.016 CV 1
ASSI { 250}
(( segid " " and resid 16 and name HB1 ))
(( segid " " and resid 16 and name HA ))
2.200 0.600 0.600 peak 250 spectrum 1 weight 0.11000E+01 volume 0.69907E-02 ppm1 2.158 ppm2 4.092 CV 1
ASSI { 252}
(( segid " " and resid 45 and name HB1 ))
(( segid " " and resid 45 and name HA ))
2.500 0.800 0.800 peak 252 spectrum 1 weight 0.11000E+01 volume 0.56753E-02 ppm1 2.002 ppm2 3.879 CV 1
ASSI { 254}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 51 and name HA ))
2.700 0.900 0.900 peak 254 spectrum 1 weight 0.11000E+01 volume 0.29781E-02 ppm1 1.974 ppm2 4.320 CV 1
ASSI { 255}
(( segid " " and resid 8 and name HB1 ))
(( segid " " and resid 8 and name HA ))
2.400 0.700 0.700 peak 255 spectrum 1 weight 0.11000E+01 volume 0.76648E-02 ppm1 1.911 ppm2 3.879 CV 1
ASSI { 257}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 31 and name HA ))
2.100 0.500 0.500 peak 257 spectrum 1 weight 0.11000E+01 volume 0.10925E-01 ppm1 2.084 ppm2 3.919 CV 1
ASSI { 258}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 14 and name HA ))
2.500 0.800 0.800 peak 258 spectrum 1 weight 0.11000E+01 volume 0.36877E-02 ppm1 2.214 ppm2 4.006 CV 1
ASSI { 263}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 7 and name HD2 ))
2.400 0.700 0.700 peak 263 spectrum 1 weight 0.11000E+01 volume 0.42527E-02 ppm1 2.101 ppm2 3.797 CV 1
ASSI { 265}
(( segid " " and resid 2 and name HG1 ))
(( segid " " and resid 2 and name HD1 ))
2.300 0.700 0.700 peak 265 spectrum 1 weight 0.11000E+01 volume 0.59919E-02 ppm1 1.950 ppm2 3.515 CV 1
ASSI { 266}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 30 and name HA ))
2.200 2.200 3.800 peak 266 spectrum 1 weight 0.11000E+01 volume 0.29312E-02 ppm1 1.645 ppm2 3.860 CV 1
ASSI { 267}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 30 and name HA ))
3.400 1.500 1.500 peak 267 spectrum 1 weight 0.11000E+01 volume 0.29433E-02 ppm1 0.514 ppm2 3.868 CV 1
ASSI { 269}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HA ))
3.500 1.500 1.500 peak 269 spectrum 1 weight 0.11000E+01 volume 0.84480E-03 ppm1 1.161 ppm2 3.871 CV 1
ASSI { 270}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 15 and name HA ))
2.700 2.700 3.300 peak 270 spectrum 1 weight 0.11000E+01 volume 0.94247E-02 ppm1 0.897 ppm2 3.872 CV 1
ASSI { 272}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 15 and name HA ))
2.000 0.500 0.500 peak 272 spectrum 1 weight 0.11000E+01 volume 0.78817E-02 ppm1 0.784 ppm2 3.853 CV 1
ASSI { 273}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 30 and name HA ))
2.700 2.700 3.300 peak 273 spectrum 1 weight 0.11000E+01 volume 0.64378E-02 ppm1 0.935 ppm2 3.874 CV 1
ASSI { 275}
( segid " " and resid 52 and name HD2%)
(( segid " " and resid 52 and name HA ))
3.100 1.200 1.200 peak 275 spectrum 1 weight 0.11000E+01 volume 0.37087E-02 ppm1 0.819 ppm2 4.369 CV 1
ASSI { 276}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name HA ))
3.300 1.400 1.400 peak 276 spectrum 1 weight 0.11000E+01 volume 0.29094E-02 ppm1 0.497 ppm2 4.135 CV 1
ASSI { 277}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 30 and name HA ))
2.800 1.000 1.000 peak 277 spectrum 1 weight 0.11000E+01 volume 0.11845E-02 ppm1 0.197 ppm2 3.862 CV 1
ASSI { 278}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 33 and name HA ))
3.000 3.000 3.000 peak 278 spectrum 1 weight 0.11000E+01 volume 0.43411E-02 ppm1 0.199 ppm2 3.590 CV 1
ASSI { 279}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 48 and name HA ))
2.700 0.900 0.900 peak 279 spectrum 1 weight 0.11000E+01 volume 0.45633E-02 ppm1 0.983 ppm2 4.259 CV 1
ASSI { 280}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 47 and name HA ))
3.000 1.200 1.200 peak 280 spectrum 1 weight 0.11000E+01 volume 0.94320E-02 ppm1 0.724 ppm2 3.944 CV 1
ASSI { 282}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 9 and name HA ))
2.400 2.400 3.600 peak 282 spectrum 1 weight 0.11000E+01 volume 0.91393E-02 ppm1 0.854 ppm2 3.877 CV 1
ASSI { 284}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 36 and name HG1 ))
2.400 0.700 0.700 peak 284 spectrum 1 weight 0.11000E+01 volume 0.50720E-02 ppm1 0.945 ppm2 3.826 CV 1
ASSI { 285}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 43 and name HA ))
2.600 0.800 0.800 peak 285 spectrum 1 weight 0.11000E+01 volume 0.30217E-02 ppm1 0.945 ppm2 3.617 CV 1
ASSI { 287}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 31 and name HA ))
2.700 2.700 3.300 peak 287 spectrum 1 weight 0.11000E+01 volume 0.11813E-02 ppm1 1.431 ppm2 3.835 CV 1
ASSI { 288}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 39 and name HA ))
2.900 2.900 3.100 peak 288 spectrum 1 weight 0.11000E+01 volume 0.75719E-03 ppm1 1.358 ppm2 4.555 CV 1
ASSI { 292}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 22 and name HA1 ))
4.600 4.600 1.400 peak 292 spectrum 1 weight 0.11000E+01 volume 0.71652E-03 ppm1 0.787 ppm2 3.448 CV 1
ASSI { 300}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 36 and name HG1 ))
3.100 1.200 1.200 peak 300 spectrum 1 weight 0.11000E+01 volume 0.11856E-02 ppm1 1.099 ppm2 3.833 CV 1
ASSI { 301}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 43 and name HA ))
2.200 0.600 0.600 peak 301 spectrum 1 weight 0.11000E+01 volume 0.74429E-02 ppm1 1.098 ppm2 3.595 CV 1
ASSI { 303}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 31 and name HA ))
5.000 3.100 1.000 peak 303 spectrum 1 weight 0.11000E+01 volume 0.49940E-03 ppm1 0.892 ppm2 3.857 CV 1
ASSI { 306}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 41 and name HA ))
2.600 0.800 0.800 peak 306 spectrum 1 weight 0.11000E+01 volume 0.31115E-02 ppm1 0.754 ppm2 4.315 CV 1
ASSI { 308}
( segid " " and resid 34 and name HD1%)
(( segid " " and resid 34 and name HA ))
4.000 2.000 2.000 peak 308 spectrum 1 weight 0.11000E+01 volume 0.16797E-02 ppm1 0.834 ppm2 3.616 CV 1
ASSI { 309}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 24 and name HA ))
4.200 2.200 1.800 peak 309 spectrum 1 weight 0.11000E+01 volume 0.55409E-03 ppm1 0.815 ppm2 4.404 CV 1
ASSI { 310}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 14 and name HA ))
3.100 1.200 1.200 peak 310 spectrum 1 weight 0.11000E+01 volume 0.40911E-02 ppm1 0.795 ppm2 3.983 CV 1
ASSI { 311}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 40 and name HA ))
3.300 1.400 1.400 peak 311 spectrum 1 weight 0.11000E+01 volume 0.29703E-02 ppm1 0.797 ppm2 3.539 CV 1
ASSI { 312}
(( segid " " and resid 36 and name HB ))
( segid " " and resid 42 and name HB% )
2.700 0.900 0.900 peak 312 spectrum 1 weight 0.11000E+01 volume 0.35334E-02 ppm1 4.604 ppm2 1.359 CV 1
ASSI { 313}
(( segid " " and resid 36 and name HB ))
( segid " " and resid 36 and name HG2%)
2.400 0.700 0.700 peak 313 spectrum 1 weight 0.11000E+01 volume 0.38797E-02 ppm1 4.604 ppm2 0.944 CV 1
ASSI { 314}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HG12))
2.400 0.700 0.700 peak 314 spectrum 1 weight 0.11000E+01 volume 0.37175E-02 ppm1 3.616 ppm2 1.860 CV 1
ASSI { 315}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HG11))
3.000 1.100 1.100 peak 315 spectrum 1 weight 0.11000E+01 volume 0.32125E-02 ppm1 3.618 ppm2 1.034 CV 1
ASSI { 316}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 34 and name HG2%)
2.300 0.700 0.700 peak 316 spectrum 1 weight 0.11000E+01 volume 0.80702E-02 ppm1 3.619 ppm2 0.879 CV 1
ASSI { 319}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HG12))
2.200 0.600 0.600 peak 319 spectrum 1 weight 0.11000E+01 volume 0.30989E-02 ppm1 3.528 ppm2 1.324 CV 1
ASSI { 320}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 43 and name HB% )
2.300 0.700 0.700 peak 320 spectrum 1 weight 0.11000E+01 volume 0.45620E-02 ppm1 3.527 ppm2 1.117 CV 1
ASSI { 321}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 40 and name HG2%)
2.800 1.000 1.000 peak 321 spectrum 1 weight 0.11000E+01 volume 0.37442E-02 ppm1 3.526 ppm2 0.813 CV 1
ASSI { 322}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 33 and name HD1%)
3.200 1.300 1.300 peak 322 spectrum 1 weight 0.11000E+01 volume 0.21583E-02 ppm1 3.527 ppm2 0.207 CV 1
ASSI { 325}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 9 and name HG2%)
2.300 0.700 0.700 peak 325 spectrum 1 weight 0.11000E+01 volume 0.97927E-02 ppm1 3.883 ppm2 0.877 CV 1
ASSI { 329}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HB1 ))
2.700 0.900 0.900 peak 329 spectrum 1 weight 0.11000E+01 volume 0.22816E-02 ppm1 4.417 ppm2 1.917 CV 1
ASSI { 330}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HG11))
4.400 4.400 1.600 peak 330 spectrum 1 weight 0.11000E+01 volume 0.83664E-03 ppm1 4.415 ppm2 1.145 CV 1
ASSI { 331}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB ))
2.500 0.800 0.800 peak 331 spectrum 1 weight 0.11000E+01 volume 0.62115E-02 ppm1 4.415 ppm2 2.208 CV 1
ASSI { 332}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 24 and name HG2%)
2.300 0.700 0.700 peak 332 spectrum 1 weight 0.11000E+01 volume 0.81676E-02 ppm1 4.414 ppm2 0.797 CV 1
ASSI { 333}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HG1 ))
2.300 0.700 0.700 peak 333 spectrum 1 weight 0.11000E+01 volume 0.33796E-02 ppm1 3.967 ppm2 2.490 CV 1
ASSI { 334}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 42 and name HB% )
3.700 1.700 1.700 peak 334 spectrum 1 weight 0.11000E+01 volume 0.24901E-02 ppm1 4.505 ppm2 1.379 CV 1
ASSI { 335}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 36 and name HG2%)
2.500 0.800 0.800 peak 335 spectrum 1 weight 0.11000E+01 volume 0.61542E-02 ppm1 4.506 ppm2 0.947 CV 1
ASSI { 336}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB2 ))
2.200 0.600 0.600 peak 336 spectrum 1 weight 0.11000E+01 volume 0.68572E-02 ppm1 3.883 ppm2 2.381 CV 1
ASSI { 337}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 15 and name HD1%)
2.900 2.900 3.100 peak 337 spectrum 1 weight 0.11000E+01 volume 0.18995E-02 ppm1 3.884 ppm2 0.877 CV 1
ASSI { 338}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HG1 ))
3.400 1.400 1.400 peak 338 spectrum 1 weight 0.11000E+01 volume 0.27548E-02 ppm1 3.773 ppm2 1.578 CV 1
ASSI { 340}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB2 ))
2.600 0.800 0.800 peak 340 spectrum 1 weight 0.11000E+01 volume 0.56104E-02 ppm1 3.772 ppm2 1.843 CV 1
ASSI { 341}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB1 ))
2.200 0.600 0.600 peak 341 spectrum 1 weight 0.11000E+01 volume 0.97724E-02 ppm1 3.970 ppm2 2.012 CV 1
ASSI { 347}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HG1 ))
2.500 0.800 0.800 peak 347 spectrum 1 weight 0.11000E+01 volume 0.86054E-02 ppm1 4.100 ppm2 2.318 CV 1
ASSI { 348}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HG2 ))
2.700 0.900 0.900 peak 348 spectrum 1 weight 0.11000E+01 volume 0.10181E-01 ppm1 4.062 ppm2 2.430 CV 1
ASSI { 349}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB1 ))
2.000 0.500 0.500 peak 349 spectrum 1 weight 0.11000E+01 volume 0.16439E-01 ppm1 4.061 ppm2 2.055 CV 1
ASSI { 350}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HG1 ))
2.600 0.900 0.900 peak 350 spectrum 1 weight 0.11000E+01 volume 0.10631E-01 ppm1 4.053 ppm2 2.373 CV 1
ASSI { 355}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 34 and name HB ))
2.200 0.600 0.600 peak 355 spectrum 1 weight 0.11000E+01 volume 0.91222E-02 ppm1 3.853 ppm2 1.762 CV 1
ASSI { 357}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HB1 ))
2.200 0.600 0.600 peak 357 spectrum 1 weight 0.11000E+01 volume 0.10796E-01 ppm1 4.024 ppm2 1.850 CV 1
ASSI { 358}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HG2 ))
2.600 0.800 0.800 peak 358 spectrum 1 weight 0.11000E+01 volume 0.36152E-02 ppm1 4.021 ppm2 1.673 CV 1
ASSI { 359}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HG1 ))
3.000 1.200 1.200 peak 359 spectrum 1 weight 0.11000E+01 volume 0.30890E-02 ppm1 4.021 ppm2 1.514 CV 1
ASSI { 367}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
1.900 0.400 0.400 peak 367 spectrum 1 weight 0.11000E+01 volume 0.12377E-01 ppm1 3.858 ppm2 1.922 CV 1
ASSI { 368}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 33 and name HB2 ))
1.600 0.300 0.600 peak 368 spectrum 1 weight 0.11000E+01 volume 0.11126E-01 ppm1 3.848 ppm2 1.515 CV 1
ASSI { 370}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 47 and name HD1%)
4.000 4.000 2.000 peak 370 spectrum 1 weight 0.11000E+01 volume 0.79272E-03 ppm1 4.613 ppm2 0.802 CV 1
ASSI { 371}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HB2 ))
2.600 0.900 0.900 peak 371 spectrum 1 weight 0.11000E+01 volume 0.27105E-02 ppm1 4.355 ppm2 2.901 CV 1
ASSI { 372}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HB1 ))
2.900 1.000 1.000 peak 372 spectrum 1 weight 0.11000E+01 volume 0.32112E-02 ppm1 4.355 ppm2 2.731 CV 1
ASSI { 373}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 24 and name HD1%)
4.100 2.100 1.900 peak 373 spectrum 1 weight 0.11000E+01 volume 0.46680E-03 ppm1 4.357 ppm2 0.795 CV 1
ASSI { 374}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB2 ))
3.100 1.200 1.200 peak 374 spectrum 1 weight 0.11000E+01 volume 0.25099E-02 ppm1 3.934 ppm2 1.520 CV 1
ASSI { 375}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB1 ))
2.500 0.800 0.800 peak 375 spectrum 1 weight 0.11000E+01 volume 0.38163E-02 ppm1 3.936 ppm2 1.183 CV 1
ASSI { 377}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 47 and name HD2%)
3.400 1.400 1.400 peak 377 spectrum 1 weight 0.11000E+01 volume 0.86681E-03 ppm1 3.933 ppm2 0.244 CV 1
ASSI { 378}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HG ))
2.700 0.900 0.900 peak 378 spectrum 1 weight 0.11000E+01 volume 0.40303E-02 ppm1 3.930 ppm2 1.345 CV 1
ASSI { 381}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB1 ))
2.700 0.900 0.900 peak 381 spectrum 1 weight 0.11000E+01 volume 0.18314E-02 ppm1 3.592 ppm2 0.044 CV 1
ASSI { 382}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HG ))
2.800 1.000 1.000 peak 382 spectrum 1 weight 0.11000E+01 volume 0.11041E-02 ppm1 3.587 ppm2 1.342 CV 1
ASSI { 384}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB1 ))
2.300 0.600 0.600 peak 384 spectrum 1 weight 0.11000E+01 volume 0.72021E-02 ppm1 4.313 ppm2 2.665 CV 1
ASSI { 385}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HB ))
3.300 1.300 1.300 peak 385 spectrum 1 weight 0.11000E+01 volume 0.24926E-02 ppm1 4.313 ppm2 1.733 CV 1
ASSI { 387}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HG1 ))
3.000 1.100 1.100 peak 387 spectrum 1 weight 0.11000E+01 volume 0.76607E-02 ppm1 4.342 ppm2 2.581 CV 1
ASSI { 388}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HG2 ))
2.300 0.700 0.700 peak 388 spectrum 1 weight 0.11000E+01 volume 0.70380E-02 ppm1 4.335 ppm2 2.847 CV 1
ASSI { 389}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HB2 ))
2.700 0.900 0.900 peak 389 spectrum 1 weight 0.11000E+01 volume 0.46486E-02 ppm1 4.256 ppm2 1.834 CV 1
ASSI { 392}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB1 ))
2.500 0.800 0.800 peak 392 spectrum 1 weight 0.11000E+01 volume 0.45679E-02 ppm1 4.331 ppm2 2.342 CV 1
ASSI { 394}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB2 ))
2.700 0.900 0.900 peak 394 spectrum 1 weight 0.11000E+01 volume 0.52064E-02 ppm1 4.322 ppm2 2.124 CV 1
ASSI { 396}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HB1 ))
2.300 0.700 0.700 peak 396 spectrum 1 weight 0.11000E+01 volume 0.63878E-02 ppm1 4.261 ppm2 1.597 CV 1
ASSI { 399}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB1 ))
2.600 0.800 0.800 peak 399 spectrum 1 weight 0.11000E+01 volume 0.19245E-02 ppm1 4.061 ppm2 2.265 CV 1
ASSI { 400}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 32 and name HB% )
2.600 0.900 0.900 peak 400 spectrum 1 weight 0.11000E+01 volume 0.32890E-02 ppm1 4.060 ppm2 1.324 CV 1
ASSI { 401}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 47 and name HD1%)
2.500 2.500 3.500 peak 401 spectrum 1 weight 0.11000E+01 volume 0.41174E-02 ppm1 4.058 ppm2 0.734 CV 1
ASSI { 402}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 18 and name HD2%)
4.300 2.300 1.700 peak 402 spectrum 1 weight 0.11000E+01 volume 0.80359E-03 ppm1 4.059 ppm2 0.505 CV 1
ASSI { 403}
(( segid " " and resid 29 and name HA ))
( segid " " and resid 47 and name HD2%)
2.700 2.700 3.300 peak 403 spectrum 1 weight 0.11000E+01 volume 0.32293E-02 ppm1 4.059 ppm2 0.242 CV 1
ASSI { 404}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HB2 ))
2.700 0.900 0.900 peak 404 spectrum 1 weight 0.11000E+01 volume 0.19429E-02 ppm1 3.621 ppm2 1.847 CV 1
ASSI { 405}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 32 and name HB% )
2.400 0.700 0.700 peak 405 spectrum 1 weight 0.11000E+01 volume 0.35730E-02 ppm1 3.620 ppm2 1.343 CV 1
ASSI { 408}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB2 ))
2.700 0.900 0.900 peak 408 spectrum 1 weight 0.11000E+01 volume 0.63657E-02 ppm1 4.372 ppm2 1.604 CV 1
ASSI { 409}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 46 and name HD2 ))
3.600 1.600 1.600 peak 409 spectrum 1 weight 0.11000E+01 volume 0.98134E-03 ppm1 3.964 ppm2 2.914 CV 1
ASSI { 410}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 32 and name HB% )
2.200 0.600 0.600 peak 410 spectrum 1 weight 0.11000E+01 volume 0.91551E-02 ppm1 3.963 ppm2 1.359 CV 1
ASSI { 412}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 35 and name HB% )
2.200 0.600 0.600 peak 412 spectrum 1 weight 0.11000E+01 volume 0.14756E-01 ppm1 4.126 ppm2 1.428 CV 1
ASSI { 413}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 34 and name HG2%)
2.800 1.000 1.000 peak 413 spectrum 1 weight 0.11000E+01 volume 0.35579E-02 ppm1 4.125 ppm2 0.892 CV 1
ASSI { 414}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 31 and name HB1 ))
2.900 1.000 1.000 peak 414 spectrum 1 weight 0.11000E+01 volume 0.47577E-02 ppm1 3.986 ppm2 2.052 CV 1
ASSI { 415}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 28 and name HB% )
2.100 0.600 0.600 peak 415 spectrum 1 weight 0.11000E+01 volume 0.12528E-01 ppm1 3.986 ppm2 1.288 CV 1
ASSI { 416}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HG1 ))
3.900 1.900 1.900 peak 416 spectrum 1 weight 0.11000E+01 volume 0.86636E-03 ppm1 4.679 ppm2 2.574 CV 1
ASSI { 417}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB2 ))
2.900 1.100 1.100 peak 417 spectrum 1 weight 0.11000E+01 volume 0.30702E-02 ppm1 4.680 ppm2 2.147 CV 1
ASSI { 418}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB1 ))
2.400 0.700 0.700 peak 418 spectrum 1 weight 0.11000E+01 volume 0.46377E-02 ppm1 4.680 ppm2 1.968 CV 1
ASSI { 419}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 45 and name HB1 ))
3.300 1.300 1.300 peak 419 spectrum 1 weight 0.11000E+01 volume 0.31057E-02 ppm1 4.137 ppm2 2.015 CV 1
ASSI { 420}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB2 ))
2.800 1.000 1.000 peak 420 spectrum 1 weight 0.11000E+01 volume 0.22103E-02 ppm1 4.524 ppm2 2.819 CV 1
ASSI { 421}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB1 ))
2.700 0.900 0.900 peak 421 spectrum 1 weight 0.11000E+01 volume 0.43893E-02 ppm1 4.522 ppm2 2.597 CV 1
ASSI { 422}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HB ))
5.200 3.400 0.800 peak 422 spectrum 1 weight 0.11000E+01 volume 0.50337E-03 ppm1 4.522 ppm2 1.671 CV 1
ASSI { 423}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 40 and name HG2%)
4.700 2.800 1.300 peak 423 spectrum 1 weight 0.11000E+01 volume 0.63237E-03 ppm1 4.522 ppm2 0.838 CV 1
ASSI { 424}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB1 ))
3.700 1.800 1.800 peak 424 spectrum 1 weight 0.11000E+01 volume 0.59779E-03 ppm1 4.788 ppm2 2.594 CV 1
ASSI { 425}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 7 and name HG1 ))
1.900 0.400 0.400 peak 425 spectrum 1 weight 0.11000E+01 volume 0.19886E-01 ppm1 3.794 ppm2 2.059 CV 1
ASSI { 426}
(( segid " " and resid 2 and name HD2 ))
(( segid " " and resid 2 and name HB2 ))
3.400 1.500 1.500 peak 426 spectrum 1 weight 0.11000E+01 volume 0.99983E-03 ppm1 3.518 ppm2 2.264 CV 1
ASSI { 427}
(( segid " " and resid 2 and name HD2 ))
(( segid " " and resid 2 and name HG2 ))
2.200 0.600 0.600 peak 427 spectrum 1 weight 0.11000E+01 volume 0.85784E-02 ppm1 3.518 ppm2 1.948 CV 1
ASSI { 428}
(( segid " " and resid 38 and name HA2 ))
( segid " " and resid 33 and name HD1%)
4.500 4.500 1.500 peak 428 spectrum 1 weight 0.11000E+01 volume 0.92764E-03 ppm1 3.970 ppm2 0.209 CV 1
ASSI { 431}
(( segid " " and resid 22 and name HA2 ))
( segid " " and resid 24 and name HD1%)
3.300 3.300 2.700 peak 431 spectrum 1 weight 0.11000E+01 volume 0.99063E-03 ppm1 4.075 ppm2 0.800 CV 1
ASSI { 432}
(( segid " " and resid 22 and name HA1 ))
( segid " " and resid 24 and name HD1%)
3.900 1.900 1.900 peak 432 spectrum 1 weight 0.11000E+01 volume 0.11344E-02 ppm1 3.447 ppm2 0.797 CV 1
ASSI { 435}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HB1 ))
2.200 0.600 0.600 peak 435 spectrum 1 weight 0.11000E+01 volume 0.25465E-02 ppm1 3.460 ppm2 2.744 CV 1
ASSI { 442}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 33 and name HB2 ))
2.600 0.800 0.800 peak 442 spectrum 1 weight 0.11000E+01 volume 0.64365E-02 ppm1 0.518 ppm2 1.509 CV 1
ASSI { 443}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 33 and name HG ))
2.100 0.600 0.600 peak 443 spectrum 1 weight 0.11000E+01 volume 0.60681E-02 ppm1 0.518 ppm2 1.337 CV 1
ASSI { 444}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 29 and name HB1 ))
4.700 2.800 1.300 peak 444 spectrum 1 weight 0.11000E+01 volume 0.65853E-03 ppm1 0.499 ppm2 2.262 CV 1
ASSI { 445}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 18 and name HG ))
2.100 0.500 0.500 peak 445 spectrum 1 weight 0.11000E+01 volume 0.76165E-02 ppm1 0.499 ppm2 1.729 CV 1
ASSI { 447}
( segid " " and resid 18 and name HD2%)
( segid " " and resid 43 and name HB% )
3.400 1.500 1.500 peak 447 spectrum 1 weight 0.11000E+01 volume 0.95533E-03 ppm1 0.501 ppm2 1.120 CV 1
ASSI { 448}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 44 and name HA ))
2.500 2.500 3.500 peak 448 spectrum 1 weight 0.11000E+01 volume 0.17741E-02 ppm1 0.241 ppm2 2.968 CV 1
ASSI { 449}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 47 and name HB2 ))
3.400 1.400 1.400 peak 449 spectrum 1 weight 0.11000E+01 volume 0.33497E-02 ppm1 0.242 ppm2 1.516 CV 1
ASSI { 450}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 47 and name HG ))
2.200 0.600 0.600 peak 450 spectrum 1 weight 0.11000E+01 volume 0.70213E-02 ppm1 0.240 ppm2 1.341 CV 1
ASSI { 451}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 47 and name HB1 ))
2.300 2.300 3.700 peak 451 spectrum 1 weight 0.11000E+01 volume 0.56307E-02 ppm1 0.242 ppm2 1.182 CV 1
ASSI { 452}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name HB1 ))
2.300 2.300 3.700 peak 452 spectrum 1 weight 0.11000E+01 volume 0.57191E-02 ppm1 0.501 ppm2 1.528 CV 1
ASSI { 453}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 18 and name HG ))
2.200 0.600 0.600 peak 453 spectrum 1 weight 0.11000E+01 volume 0.53412E-02 ppm1 0.497 ppm2 1.732 CV 1
ASSI { 458}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 33 and name HG ))
2.300 0.600 0.600 peak 458 spectrum 1 weight 0.11000E+01 volume 0.48555E-02 ppm1 0.200 ppm2 1.335 CV 1
ASSI { 459}
( segid " " and resid 33 and name HD1%)
( segid " " and resid 43 and name HB% )
2.500 2.500 3.500 peak 459 spectrum 1 weight 0.11000E+01 volume 0.34127E-02 ppm1 0.199 ppm2 1.105 CV 1
ASSI { 460}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 41 and name HN ))
4.400 2.400 1.600 peak 460 spectrum 1 weight 0.11000E+01 volume 0.11161E-02 ppm1 0.757 ppm2 7.926 CV 1
ASSI { 461}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 14 and name HN ))
4.500 4.500 1.500 peak 461 spectrum 1 weight 0.11000E+01 volume 0.51094E-04 ppm1 0.795 ppm2 9.296 CV 1
ASSI { 463}
( segid " " and resid 34 and name HD1%)
(( segid " " and resid 33 and name HN ))
3.100 3.100 2.900 peak 463 spectrum 1 weight 0.11000E+01 volume 0.50842E-03 ppm1 0.836 ppm2 8.055 CV 1
ASSI { 465}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 38 and name HN ))
2.700 2.700 3.300 peak 465 spectrum 1 weight 0.11000E+01 volume 0.11494E-02 ppm1 3.522 ppm2 8.846 CV 1
ASSI { 466}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 43 and name HN ))
3.100 1.200 1.200 peak 466 spectrum 1 weight 0.11000E+01 volume 0.12244E-02 ppm1 3.522 ppm2 8.324 CV 1
ASSI { 467}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 42 and name HN ))
4.500 2.500 1.500 peak 467 spectrum 1 weight 0.11000E+01 volume 0.25659E-03 ppm1 3.531 ppm2 8.074 CV 1
ASSI { 468}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 18 and name HD1%)
4.700 2.700 1.300 peak 468 spectrum 1 weight 0.11000E+01 volume 0.35033E-03 ppm1 3.529 ppm2 0.503 CV 1
ASSI { 469}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 43 and name HN ))
6.000 6.000 0.000 peak 469 spectrum 1 weight 0.11000E+01 volume 0.10188E-03 ppm1 0.193 ppm2 8.326 CV 1
ASSI { 472}
( segid " " and resid 33 and name HD1%)
( segid " " and resid 11 and name HD% )
4.200 2.200 1.800 peak 472 spectrum 1 weight 0.11000E+01 volume 0.84057E-03 ppm1 0.200 ppm2 7.018 CV 1
ASSI { 474}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 44 and name HN ))
3.800 1.800 1.800 peak 474 spectrum 1 weight 0.11000E+01 volume 0.10196E-02 ppm1 0.490 ppm2 8.284 CV 1
ASSI { 477}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 29 and name HN ))
4.500 2.600 1.500 peak 477 spectrum 1 weight 0.11000E+01 volume 0.35371E-03 ppm1 0.728 ppm2 8.616 CV 1
ASSI { 480}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 46 and name HN ))
6.000 6.000 0.000 peak 480 spectrum 1 weight 0.11000E+01 volume 0.11783E-03 ppm1 0.724 ppm2 7.463 CV 1
ASSI { 481}
( segid " " and resid 47 and name HD1%)
( segid " " and resid 23 and name HD% )
3.300 3.300 2.700 peak 481 spectrum 1 weight 0.11000E+01 volume 0.90135E-03 ppm1 0.722 ppm2 7.208 CV 1
ASSI { 483}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 49 and name HN ))
3.200 3.200 2.800 peak 483 spectrum 1 weight 0.11000E+01 volume 0.40003E-03 ppm1 0.982 ppm2 7.825 CV 1
ASSI { 485}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 31 and name HN ))
3.100 1.200 1.200 peak 485 spectrum 1 weight 0.11000E+01 volume 0.47875E-03 ppm1 0.935 ppm2 7.890 CV 1
ASSI { 486}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 33 and name HN ))
3.100 3.100 2.900 peak 486 spectrum 1 weight 0.11000E+01 volume 0.52041E-03 ppm1 0.935 ppm2 8.064 CV 1
ASSI { 487}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 34 and name HN ))
3.100 3.100 2.900 peak 487 spectrum 1 weight 0.11000E+01 volume 0.52352E-03 ppm1 0.934 ppm2 8.629 CV 1
ASSI { 489}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 52 and name HN ))
5.300 3.500 0.700 peak 489 spectrum 1 weight 0.11000E+01 volume 0.95217E-04 ppm1 4.207 ppm2 8.314 CV 1
ASSI { 491}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 52 and name HB2 ))
5.500 3.800 0.500 peak 491 spectrum 1 weight 0.11000E+01 volume 0.54084E-04 ppm1 4.200 ppm2 1.599 CV 1
ASSI { 492}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 53 and name HA ))
4.100 2.200 1.900 peak 492 spectrum 1 weight 0.11000E+01 volume 0.36004E-03 ppm1 3.793 ppm2 4.200 CV 1
ASSI { 494}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HB2 ))
4.700 2.700 1.300 peak 494 spectrum 1 weight 0.11000E+01 volume 0.61655E-03 ppm1 4.370 ppm2 3.793 CV 1
ASSI { 496}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HN ))
3.200 1.300 1.300 peak 496 spectrum 1 weight 0.11000E+01 volume 0.12289E-02 ppm1 3.621 ppm2 7.465 CV 1
ASSI { 497}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 33 and name HN ))
4.500 2.500 1.500 peak 497 spectrum 1 weight 0.11000E+01 volume 0.57957E-03 ppm1 3.615 ppm2 8.060 CV 1
ASSI { 498}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 36 and name HN ))
5.600 3.900 0.400 peak 498 spectrum 1 weight 0.11000E+01 volume 0.87339E-04 ppm1 3.625 ppm2 7.700 CV 1
ASSI { 501}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 11 and name HD% )
5.200 5.200 0.800 peak 501 spectrum 1 weight 0.11000E+01 volume 0.21723E-03 ppm1 3.593 ppm2 7.013 CV 1
ASSI { 503}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HN ))
3.600 1.600 1.600 peak 503 spectrum 1 weight 0.11000E+01 volume 0.55545E-03 ppm1 3.593 ppm2 8.629 CV 1
ASSI { 505}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 40 and name HN ))
4.900 3.000 1.100 peak 505 spectrum 1 weight 0.11000E+01 volume 0.28281E-03 ppm1 3.593 ppm2 8.924 CV 1
ASSI { 506}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 32 and name HA ))
4.800 2.900 1.200 peak 506 spectrum 1 weight 0.11000E+01 volume 0.32430E-03 ppm1 3.621 ppm2 3.998 CV 1
ASSI { 507}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 36 and name HG1 ))
3.600 1.600 1.600 peak 507 spectrum 1 weight 0.11000E+01 volume 0.71652E-03 ppm1 3.617 ppm2 3.829 CV 1
ASSI { 508}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HD1 ))
4.000 2.000 2.000 peak 508 spectrum 1 weight 0.11000E+01 volume 0.51509E-03 ppm1 3.622 ppm2 3.083 CV 1
ASSI { 509}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HD2 ))
3.400 1.400 1.400 peak 509 spectrum 1 weight 0.11000E+01 volume 0.60830E-03 ppm1 3.622 ppm2 2.919 CV 1
ASSI { 510}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HG2 ))
4.400 2.400 1.600 peak 510 spectrum 1 weight 0.11000E+01 volume 0.87380E-03 ppm1 3.624 ppm2 1.658 CV 1
ASSI { 511}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 46 and name HG1 ))
2.900 1.100 1.100 peak 511 spectrum 1 weight 0.11000E+01 volume 0.16656E-02 ppm1 3.619 ppm2 1.494 CV 1
ASSI { 512}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 33 and name HD2%)
4.300 4.300 1.700 peak 512 spectrum 1 weight 0.11000E+01 volume 0.74172E-04 ppm1 3.620 ppm2 0.504 CV 1
ASSI { 513}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 33 and name HD1%)
4.100 2.100 1.900 peak 513 spectrum 1 weight 0.11000E+01 volume 0.93815E-03 ppm1 3.619 ppm2 0.218 CV 1
ASSI { 514}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 46 and name HA ))
4.300 2.400 1.700 peak 514 spectrum 1 weight 0.11000E+01 volume 0.98234E-03 ppm1 3.084 ppm2 4.003 CV 1
ASSI { 515}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HA ))
4.200 2.200 1.800 peak 515 spectrum 1 weight 0.11000E+01 volume 0.14221E-02 ppm1 2.917 ppm2 3.991 CV 1
ASSI { 518}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HD1 ))
1.700 0.400 0.500 peak 518 spectrum 1 weight 0.11000E+01 volume 0.12538E-01 ppm1 2.917 ppm2 3.086 CV 1
ASSI { 522}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HD21))
3.300 1.400 1.400 peak 522 spectrum 1 weight 0.11000E+01 volume 0.16557E-02 ppm1 3.333 ppm2 7.765 CV 1
ASSI { 523}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 27 and name HN ))
5.400 3.600 0.600 peak 523 spectrum 1 weight 0.11000E+01 volume 0.19625E-03 ppm1 3.332 ppm2 8.322 CV 1
ASSI { 524}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 27 and name HN ))
4.000 2.000 2.000 peak 524 spectrum 1 weight 0.11000E+01 volume 0.63305E-03 ppm1 2.592 ppm2 8.330 CV 1
ASSI { 525}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 25 and name HD22))
3.900 1.900 1.900 peak 525 spectrum 1 weight 0.11000E+01 volume 0.10804E-02 ppm1 2.593 ppm2 7.034 CV 1
ASSI { 526}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HD22))
3.800 1.800 1.800 peak 526 spectrum 1 weight 0.11000E+01 volume 0.14438E-02 ppm1 3.342 ppm2 7.036 CV 1
ASSI { 527}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 25 and name HD21))
2.700 0.900 0.900 peak 527 spectrum 1 weight 0.11000E+01 volume 0.23632E-02 ppm1 2.591 ppm2 7.770 CV 1
ASSI { 529}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 28 and name HB% )
3.600 1.600 1.600 peak 529 spectrum 1 weight 0.11000E+01 volume 0.25285E-02 ppm1 3.332 ppm2 1.285 CV 1
ASSI { 530}
(( segid " " and resid 25 and name HB1 ))
( segid " " and resid 28 and name HB% )
2.600 0.800 0.800 peak 530 spectrum 1 weight 0.11000E+01 volume 0.25211E-02 ppm1 2.594 ppm2 1.283 CV 1
ASSI { 531}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
3.300 1.400 1.400 peak 531 spectrum 1 weight 0.11000E+01 volume 0.10298E-02 ppm1 4.788 ppm2 3.326 CV 1
ASSI { 532}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 26 and name HB2 ))
4.000 2.000 2.000 peak 532 spectrum 1 weight 0.11000E+01 volume 0.12390E-02 ppm1 4.787 ppm2 1.836 CV 1
ASSI { 533}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 26 and name HB1 ))
4.900 3.000 1.100 peak 533 spectrum 1 weight 0.11000E+01 volume 0.10577E-02 ppm1 4.787 ppm2 1.736 CV 1
ASSI { 534}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB2 ))
3.100 1.200 1.200 peak 534 spectrum 1 weight 0.11000E+01 volume 0.15081E-02 ppm1 4.616 ppm2 3.454 CV 1
ASSI { 535}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB1 ))
3.100 1.200 1.200 peak 535 spectrum 1 weight 0.11000E+01 volume 0.11825E-02 ppm1 4.619 ppm2 2.732 CV 1
ASSI { 536}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HG11))
5.500 3.700 0.500 peak 536 spectrum 1 weight 0.11000E+01 volume 0.90848E-03 ppm1 4.616 ppm2 1.129 CV 1
ASSI { 537}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HN ))
2.600 2.600 3.400 peak 537 spectrum 1 weight 0.11000E+01 volume 0.17452E-02 ppm1 3.457 ppm2 7.847 CV 1
ASSI { 539}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 23 and name HD% )
2.600 0.800 0.800 peak 539 spectrum 1 weight 0.11000E+01 volume 0.24879E-02 ppm1 3.459 ppm2 7.231 CV 1
ASSI { 540}
(( segid " " and resid 23 and name HB1 ))
( segid " " and resid 23 and name HD% )
3.000 1.100 1.100 peak 540 spectrum 1 weight 0.11000E+01 volume 0.14734E-02 ppm1 2.741 ppm2 7.231 CV 1
ASSI { 541}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 29 and name HD22))
4.700 2.800 1.300 peak 541 spectrum 1 weight 0.11000E+01 volume 0.22854E-03 ppm1 3.461 ppm2 6.603 CV 1
ASSI { 543}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 29 and name HB1 ))
6.000 5.300 0.000 peak 543 spectrum 1 weight 0.11000E+01 volume 0.91957E-04 ppm1 3.464 ppm2 2.277 CV 1
ASSI { 545}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 47 and name HB2 ))
4.200 4.200 1.800 peak 545 spectrum 1 weight 0.11000E+01 volume 0.64423E-03 ppm1 3.459 ppm2 1.488 CV 1
ASSI { 546}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 47 and name HD1%)
4.600 2.700 1.400 peak 546 spectrum 1 weight 0.11000E+01 volume 0.17147E-03 ppm1 3.458 ppm2 0.774 CV 1
ASSI { 547}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 18 and name HD2%)
3.200 3.200 2.800 peak 547 spectrum 1 weight 0.11000E+01 volume 0.11094E-02 ppm1 3.459 ppm2 0.497 CV 1
ASSI { 549}
(( segid " " and resid 23 and name HB1 ))
( segid " " and resid 47 and name HD2%)
3.900 1.900 1.900 peak 549 spectrum 1 weight 0.11000E+01 volume 0.50679E-03 ppm1 2.738 ppm2 0.249 CV 1
ASSI { 550}
(( segid " " and resid 23 and name HB1 ))
( segid " " and resid 18 and name HD2%)
3.800 1.800 1.800 peak 550 spectrum 1 weight 0.11000E+01 volume 0.11198E-02 ppm1 2.744 ppm2 0.498 CV 1
ASSI { 551}
(( segid " " and resid 23 and name HB1 ))
( segid " " and resid 47 and name HD1%)
4.800 4.800 1.200 peak 551 spectrum 1 weight 0.11000E+01 volume 0.74722E-04 ppm1 2.746 ppm2 0.779 CV 1
ASSI { 552}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 18 and name HB1 ))
3.500 1.500 1.500 peak 552 spectrum 1 weight 0.11000E+01 volume 0.62836E-03 ppm1 2.744 ppm2 1.486 CV 1
ASSI { 555}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 29 and name HN ))
3.700 1.800 1.800 peak 555 spectrum 1 weight 0.11000E+01 volume 0.81450E-03 ppm1 3.985 ppm2 8.611 CV 1
ASSI { 556}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 31 and name HG2 ))
3.500 1.500 1.500 peak 556 spectrum 1 weight 0.11000E+01 volume 0.14728E-02 ppm1 3.986 ppm2 2.451 CV 1
ASSI { 557}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 47 and name HD1%)
3.900 1.900 1.900 peak 557 spectrum 1 weight 0.11000E+01 volume 0.14595E-02 ppm1 3.982 ppm2 0.741 CV 1
ASSI { 559}
( segid " " and resid 28 and name HB% )
(( segid " " and resid 25 and name HD22))
4.200 2.200 1.800 peak 559 spectrum 1 weight 0.11000E+01 volume 0.72914E-03 ppm1 1.286 ppm2 7.054 CV 1
ASSI { 562}
( segid " " and resid 28 and name HB% )
(( segid " " and resid 29 and name HB1 ))
4.500 4.500 1.500 peak 562 spectrum 1 weight 0.11000E+01 volume 0.64036E-03 ppm1 1.290 ppm2 2.276 CV 1
ASSI { 563}
( segid " " and resid 28 and name HB% )
(( segid " " and resid 27 and name HB2 ))
3.100 3.100 2.900 peak 563 spectrum 1 weight 0.11000E+01 volume 0.44719E-02 ppm1 1.290 ppm2 2.060 CV 1
ASSI { 564}
( segid " " and resid 28 and name HB% )
( segid " " and resid 47 and name HD1%)
3.100 3.100 2.900 peak 564 spectrum 1 weight 0.11000E+01 volume 0.45895E-02 ppm1 1.287 ppm2 0.725 CV 1
ASSI { 566}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 32 and name HN ))
3.500 1.500 1.500 peak 566 spectrum 1 weight 0.11000E+01 volume 0.74907E-03 ppm1 4.059 ppm2 8.055 CV 1
ASSI { 568}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 30 and name HB2 ))
5.300 3.500 0.700 peak 568 spectrum 1 weight 0.11000E+01 volume 0.34115E-03 ppm1 4.055 ppm2 1.863 CV 1
ASSI { 569}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 47 and name HB2 ))
5.300 3.600 0.700 peak 569 spectrum 1 weight 0.11000E+01 volume 0.49448E-03 ppm1 4.056 ppm2 1.530 CV 1
ASSI { 570}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HN ))
2.700 0.900 0.900 peak 570 spectrum 1 weight 0.11000E+01 volume 0.16091E-02 ppm1 2.939 ppm2 8.614 CV 1
ASSI { 571}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 30 and name HN ))
2.400 0.700 0.700 peak 571 spectrum 1 weight 0.11000E+01 volume 0.18113E-02 ppm1 2.930 ppm2 8.419 CV 1
ASSI { 574}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HD21))
3.100 1.200 1.200 peak 574 spectrum 1 weight 0.11000E+01 volume 0.34235E-03 ppm1 2.259 ppm2 7.367 CV 1
ASSI { 575}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HD21))
3.500 1.500 1.500 peak 575 spectrum 1 weight 0.11000E+01 volume 0.46188E-03 ppm1 2.940 ppm2 7.362 CV 1
ASSI { 576}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HD22))
4.700 2.700 1.300 peak 576 spectrum 1 weight 0.11000E+01 volume 0.31751E-03 ppm1 2.939 ppm2 6.659 CV 1
ASSI { 577}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HD22))
4.700 2.700 1.300 peak 577 spectrum 1 weight 0.11000E+01 volume 0.29585E-03 ppm1 2.255 ppm2 6.630 CV 1
ASSI { 578}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HA ))
3.300 1.300 1.300 peak 578 spectrum 1 weight 0.11000E+01 volume 0.12301E-02 ppm1 2.939 ppm2 4.052 CV 1
ASSI { 579}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 26 and name HA ))
2.700 0.900 0.900 peak 579 spectrum 1 weight 0.11000E+01 volume 0.11777E-02 ppm1 2.936 ppm2 3.778 CV 1
ASSI { 582}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HB2 ))
1.900 0.500 0.500 peak 582 spectrum 1 weight 0.11000E+01 volume 0.29359E-02 ppm1 2.260 ppm2 2.942 CV 1
ASSI { 584}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 30 and name HB2 ))
4.700 2.800 1.300 peak 584 spectrum 1 weight 0.11000E+01 volume 0.10766E-02 ppm1 2.937 ppm2 1.858 CV 1
ASSI { 585}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 30 and name HG ))
3.700 1.700 1.700 peak 585 spectrum 1 weight 0.11000E+01 volume 0.12686E-02 ppm1 2.936 ppm2 1.664 CV 1
ASSI { 586}
(( segid " " and resid 29 and name HB2 ))
( segid " " and resid 32 and name HB% )
5.500 5.500 0.500 peak 586 spectrum 1 weight 0.11000E+01 volume 0.12492E-03 ppm1 2.935 ppm2 1.314 CV 1
ASSI { 587}
(( segid " " and resid 29 and name HB2 ))
( segid " " and resid 47 and name HD1%)
3.900 3.900 2.100 peak 587 spectrum 1 weight 0.11000E+01 volume 0.21757E-02 ppm1 2.940 ppm2 0.794 CV 1
ASSI { 588}
(( segid " " and resid 29 and name HB2 ))
( segid " " and resid 33 and name HD2%)
4.300 4.300 1.700 peak 588 spectrum 1 weight 0.11000E+01 volume 0.17748E-02 ppm1 2.940 ppm2 0.502 CV 1
ASSI { 589}
(( segid " " and resid 29 and name HB2 ))
( segid " " and resid 47 and name HD2%)
5.400 5.400 0.600 peak 589 spectrum 1 weight 0.11000E+01 volume 0.15680E-03 ppm1 2.952 ppm2 0.244 CV 1
ASSI { 590}
(( segid " " and resid 29 and name HB1 ))
( segid " " and resid 47 and name HD2%)
5.700 4.100 0.300 peak 590 spectrum 1 weight 0.11000E+01 volume 0.12239E-03 ppm1 2.264 ppm2 0.235 CV 1
ASSI { 591}
(( segid " " and resid 29 and name HB1 ))
( segid " " and resid 33 and name HD2%)
3.900 3.900 2.100 peak 591 spectrum 1 weight 0.11000E+01 volume 0.19733E-02 ppm1 2.261 ppm2 0.503 CV 1
ASSI { 593}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 46 and name HH11))
3.600 1.600 1.600 peak 593 spectrum 1 weight 0.11000E+01 volume 0.16052E-02 ppm1 3.959 ppm2 7.421 CV 1
ASSI { 594}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 46 and name HH12))
6.000 6.000 0.000 peak 594 spectrum 1 weight 0.11000E+01 volume 0.60095E-04 ppm1 3.961 ppm2 7.542 CV 1
ASSI { 596}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HD22))
5.300 3.500 0.700 peak 596 spectrum 1 weight 0.11000E+01 volume 0.15682E-03 ppm1 4.355 ppm2 7.005 CV 1
ASSI { 598}
(( segid " " and resid 19 and name HB1 ))
(( segid " " and resid 19 and name HD22))
4.900 3.000 1.100 peak 598 spectrum 1 weight 0.11000E+01 volume 0.44169E-03 ppm1 2.736 ppm2 7.001 CV 1
ASSI { 601}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 16 and name HA ))
2.600 0.800 0.800 peak 601 spectrum 1 weight 0.11000E+01 volume 0.21514E-02 ppm1 2.888 ppm2 4.105 CV 1
ASSI { 602}
(( segid " " and resid 19 and name HB1 ))
(( segid " " and resid 16 and name HA ))
2.700 0.900 0.900 peak 602 spectrum 1 weight 0.11000E+01 volume 0.18523E-02 ppm1 2.733 ppm2 4.101 CV 1
ASSI { 603}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 16 and name HB2 ))
4.400 2.400 1.600 peak 603 spectrum 1 weight 0.11000E+01 volume 0.63427E-04 ppm1 2.889 ppm2 2.164 CV 1
ASSI { 604}
(( segid " " and resid 19 and name HB1 ))
(( segid " " and resid 16 and name HB2 ))
4.800 2.900 1.200 peak 604 spectrum 1 weight 0.11000E+01 volume 0.43055E-03 ppm1 2.735 ppm2 2.174 CV 1
ASSI { 605}
(( segid " " and resid 19 and name HB1 ))
( segid " " and resid 24 and name HD1%)
5.500 5.500 0.500 peak 605 spectrum 1 weight 0.11000E+01 volume 0.15017E-03 ppm1 2.731 ppm2 0.782 CV 1
ASSI { 606}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 24 and name HG2%)
5.700 4.100 0.300 peak 606 spectrum 1 weight 0.11000E+01 volume 0.56262E-04 ppm1 2.886 ppm2 0.774 CV 1
ASSI { 607}
(( segid " " and resid 19 and name HB1 ))
(( segid " " and resid 19 and name HB2 ))
1.800 0.400 0.400 peak 607 spectrum 1 weight 0.11000E+01 volume 0.85567E-02 ppm1 2.733 ppm2 2.892 CV 1
ASSI { 609}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 24 and name HB ))
6.000 6.000 0.000 peak 609 spectrum 1 weight 0.11000E+01 volume 0.25047E-04 ppm1 4.361 ppm2 2.217 CV 1
ASSI { 612}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 53 and name HN ))
3.500 1.500 1.500 peak 612 spectrum 1 weight 0.11000E+01 volume 0.17097E-02 ppm1 4.318 ppm2 7.944 CV 1
ASSI { 613}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HG1 ))
2.900 1.000 1.000 peak 613 spectrum 1 weight 0.11000E+01 volume 0.53191E-02 ppm1 4.319 ppm2 2.356 CV 1
ASSI { 616}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 3 and name HD2%)
3.400 1.400 1.400 peak 616 spectrum 1 weight 0.11000E+01 volume 0.18789E-02 ppm1 4.309 ppm2 0.842 CV 1
ASSI { 618}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 14 and name HE21))
2.600 0.800 0.800 peak 618 spectrum 1 weight 0.11000E+01 volume 0.15505E-02 ppm1 2.661 ppm2 7.954 CV 1
ASSI { 620}
(( segid " " and resid 14 and name HG1 ))
(( segid " " and resid 14 and name HE22))
3.800 1.800 1.800 peak 620 spectrum 1 weight 0.11000E+01 volume 0.13768E-02 ppm1 2.505 ppm2 7.356 CV 1
ASSI { 621}
(( segid " " and resid 14 and name HG1 ))
(( segid " " and resid 14 and name HE21))
2.800 1.000 1.000 peak 621 spectrum 1 weight 0.11000E+01 volume 0.33895E-02 ppm1 2.497 ppm2 7.953 CV 1
ASSI { 623}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HE21))
2.600 0.800 0.800 peak 623 spectrum 1 weight 0.11000E+01 volume 0.22135E-02 ppm1 2.462 ppm2 7.642 CV 1
ASSI { 624}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 13 and name HE21))
3.000 1.100 1.100 peak 624 spectrum 1 weight 0.11000E+01 volume 0.36841E-02 ppm1 2.347 ppm2 7.622 CV 1
ASSI { 625}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HE22))
4.200 2.200 1.800 peak 625 spectrum 1 weight 0.11000E+01 volume 0.81270E-03 ppm1 2.455 ppm2 6.890 CV 1
ASSI { 626}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 13 and name HE22))
4.700 2.800 1.300 peak 626 spectrum 1 weight 0.11000E+01 volume 0.51288E-03 ppm1 2.344 ppm2 6.887 CV 1
ASSI { 629}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 14 and name HN ))
4.300 2.300 1.700 peak 629 spectrum 1 weight 0.11000E+01 volume 0.70024E-03 ppm1 2.458 ppm2 9.295 CV 1
ASSI { 630}
(( segid " " and resid 13 and name HG1 ))
(( segid " " and resid 14 and name HN ))
5.500 3.800 0.500 peak 630 spectrum 1 weight 0.11000E+01 volume 0.37147E-03 ppm1 2.354 ppm2 9.298 CV 1
ASSI { 631}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 18 and name HN ))
3.900 1.900 1.900 peak 631 spectrum 1 weight 0.11000E+01 volume 0.51766E-03 ppm1 2.459 ppm2 8.751 CV 1
ASSI { 632}
(( segid " " and resid 17 and name HG1 ))
(( segid " " and resid 18 and name HN ))
6.000 6.000 0.000 peak 632 spectrum 1 weight 0.11000E+01 volume 0.41429E-04 ppm1 2.324 ppm2 8.752 CV 1
ASSI { 634}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 17 and name HE21))
2.700 0.900 0.900 peak 634 spectrum 1 weight 0.11000E+01 volume 0.25669E-02 ppm1 2.458 ppm2 7.281 CV 1
ASSI { 635}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 17 and name HE22))
3.300 1.400 1.400 peak 635 spectrum 1 weight 0.11000E+01 volume 0.24468E-02 ppm1 2.462 ppm2 6.866 CV 1
ASSI { 636}
(( segid " " and resid 17 and name HG1 ))
(( segid " " and resid 17 and name HE22))
3.700 1.800 1.800 peak 636 spectrum 1 weight 0.11000E+01 volume 0.14604E-02 ppm1 2.341 ppm2 6.870 CV 1
ASSI { 637}
(( segid " " and resid 12 and name HG1 ))
(( segid " " and resid 13 and name HN ))
4.100 2.100 1.900 peak 637 spectrum 1 weight 0.11000E+01 volume 0.17117E-02 ppm1 2.405 ppm2 9.044 CV 1
ASSI { 638}
(( segid " " and resid 12 and name HG1 ))
(( segid " " and resid 12 and name HE21))
2.700 0.900 0.900 peak 638 spectrum 1 weight 0.11000E+01 volume 0.28445E-02 ppm1 2.404 ppm2 7.671 CV 1
ASSI { 639}
(( segid " " and resid 12 and name HG1 ))
(( segid " " and resid 12 and name HN ))
3.600 1.600 1.600 peak 639 spectrum 1 weight 0.11000E+01 volume 0.29127E-02 ppm1 2.412 ppm2 7.385 CV 1
ASSI { 640}
(( segid " " and resid 12 and name HG1 ))
(( segid " " and resid 12 and name HE22))
3.800 1.800 1.800 peak 640 spectrum 1 weight 0.11000E+01 volume 0.17028E-02 ppm1 2.413 ppm2 6.908 CV 1
ASSI { 641}
(( segid " " and resid 12 and name HG2 ))
(( segid " " and resid 16 and name HN ))
3.400 1.400 1.400 peak 641 spectrum 1 weight 0.11000E+01 volume 0.16734E-02 ppm1 2.411 ppm2 7.874 CV 1
ASSI { 642}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 17 and name HN ))
2.400 0.700 0.700 peak 642 spectrum 1 weight 0.11000E+01 volume 0.40269E-02 ppm1 1.950 ppm2 8.293 CV 1
ASSI { 643}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 18 and name HN ))
3.900 1.900 1.900 peak 643 spectrum 1 weight 0.11000E+01 volume 0.13600E-02 ppm1 2.216 ppm2 8.753 CV 1
ASSI { 644}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 18 and name HN ))
2.500 0.800 0.800 peak 644 spectrum 1 weight 0.11000E+01 volume 0.17176E-02 ppm1 1.950 ppm2 8.753 CV 1
ASSI { 646}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HN ))
3.400 1.400 1.400 peak 646 spectrum 1 weight 0.11000E+01 volume 0.13075E-02 ppm1 4.139 ppm2 8.331 CV 1
ASSI { 648}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 45 and name HG2 ))
3.800 1.800 1.800 peak 648 spectrum 1 weight 0.11000E+01 volume 0.57294E-03 ppm1 4.137 ppm2 2.364 CV 1
ASSI { 649}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 42 and name HB% )
2.100 0.500 0.500 peak 649 spectrum 1 weight 0.11000E+01 volume 0.15213E-01 ppm1 4.144 ppm2 1.403 CV 1
ASSI { 650}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 34 and name HB ))
3.900 1.900 1.900 peak 650 spectrum 1 weight 0.11000E+01 volume 0.74623E-03 ppm1 4.126 ppm2 1.762 CV 1
ASSI { 653}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 41 and name HB2 ))
5.000 3.100 1.000 peak 653 spectrum 1 weight 0.11000E+01 volume 0.12533E-03 ppm1 4.126 ppm2 2.868 CV 1
ASSI { 654}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 46 and name HD1 ))
3.000 1.100 1.100 peak 654 spectrum 1 weight 0.11000E+01 volume 0.11444E-02 ppm1 3.964 ppm2 3.088 CV 1
ASSI { 657}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 46 and name HB2 ))
3.500 1.600 1.600 peak 657 spectrum 1 weight 0.11000E+01 volume 0.12737E-02 ppm1 3.962 ppm2 1.849 CV 1
ASSI { 659}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 43 and name HB% )
4.100 2.100 1.900 peak 659 spectrum 1 weight 0.11000E+01 volume 0.13087E-02 ppm1 3.962 ppm2 1.106 CV 1
ASSI { 661}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 47 and name HD1%)
4.300 2.300 1.700 peak 661 spectrum 1 weight 0.11000E+01 volume 0.88859E-03 ppm1 3.959 ppm2 0.733 CV 1
ASSI { 663}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 47 and name HD2%)
4.300 4.300 1.700 peak 663 spectrum 1 weight 0.11000E+01 volume 0.61853E-03 ppm1 3.967 ppm2 0.228 CV 1
ASSI { 664}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 46 and name HE ))
3.900 1.900 1.900 peak 664 spectrum 1 weight 0.11000E+01 volume 0.49584E-03 ppm1 1.433 ppm2 6.405 CV 1
ASSI { 666}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 46 and name HH22))
3.700 1.700 1.700 peak 666 spectrum 1 weight 0.11000E+01 volume 0.73586E-03 ppm1 1.429 ppm2 7.074 CV 1
ASSI { 667}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 46 and name HH21))
3.500 1.500 1.500 peak 667 spectrum 1 weight 0.11000E+01 volume 0.12395E-02 ppm1 1.433 ppm2 6.934 CV 1
ASSI { 668}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 46 and name HH11))
4.200 2.200 1.800 peak 668 spectrum 1 weight 0.11000E+01 volume 0.30605E-03 ppm1 1.433 ppm2 7.417 CV 1
ASSI { 669}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 34 and name HN ))
5.000 3.100 1.000 peak 669 spectrum 1 weight 0.11000E+01 volume 0.42881E-03 ppm1 1.434 ppm2 8.639 CV 1
ASSI { 670}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 33 and name HN ))
5.000 5.000 1.000 peak 670 spectrum 1 weight 0.11000E+01 volume 0.26904E-03 ppm1 1.433 ppm2 8.059 CV 1
ASSI { 671}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 45 and name HN ))
4.800 2.900 1.200 peak 671 spectrum 1 weight 0.11000E+01 volume 0.32805E-03 ppm1 1.357 ppm2 7.227 CV 1
ASSI { 674}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 23 and name HD% )
2.900 2.900 3.100 peak 674 spectrum 1 weight 0.11000E+01 volume 0.23855E-02 ppm1 0.826 ppm2 7.202 CV 1
ASSI { 675}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 23 and name HE% )
3.500 1.500 1.500 peak 675 spectrum 1 weight 0.11000E+01 volume 0.71571E-03 ppm1 0.830 ppm2 6.914 CV 1
ASSI { 676}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 33 and name HN ))
5.500 5.500 0.500 peak 676 spectrum 1 weight 0.11000E+01 volume 0.32294E-03 ppm1 0.893 ppm2 8.060 CV 1
ASSI { 677}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 36 and name HN ))
4.900 2.900 1.100 peak 677 spectrum 1 weight 0.11000E+01 volume 0.24553E-03 ppm1 1.101 ppm2 7.687 CV 1
ASSI { 678}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 46 and name HN ))
4.400 2.400 1.600 peak 678 spectrum 1 weight 0.11000E+01 volume 0.48907E-03 ppm1 1.098 ppm2 7.465 CV 1
ASSI { 679}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 45 and name HN ))
4.900 3.000 1.100 peak 679 spectrum 1 weight 0.11000E+01 volume 0.30055E-03 ppm1 1.099 ppm2 7.226 CV 1
ASSI { 680}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 39 and name HN ))
4.000 2.000 2.000 peak 680 spectrum 1 weight 0.11000E+01 volume 0.10982E-03 ppm1 1.098 ppm2 6.853 CV 1
ASSI { 681}
( segid " " and resid 32 and name HB% )
(( segid " " and resid 46 and name HN ))
4.100 2.100 1.900 peak 681 spectrum 1 weight 0.11000E+01 volume 0.92584E-03 ppm1 1.326 ppm2 7.467 CV 1
ASSI { 682}
( segid " " and resid 32 and name HB% )
(( segid " " and resid 47 and name HN ))
3.000 3.000 3.000 peak 682 spectrum 1 weight 0.11000E+01 volume 0.39265E-02 ppm1 1.332 ppm2 8.358 CV 1
ASSI { 683}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 18 and name HN ))
5.500 3.800 0.500 peak 683 spectrum 1 weight 0.11000E+01 volume 0.13194E-03 ppm1 2.116 ppm2 8.753 CV 1
ASSI { 684}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 23 and name HN ))
5.100 5.100 0.900 peak 684 spectrum 1 weight 0.11000E+01 volume 0.26354E-03 ppm1 2.113 ppm2 7.874 CV 1
ASSI { 687}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 46 and name HH11))
3.000 1.100 1.100 peak 687 spectrum 1 weight 0.11000E+01 volume 0.20675E-02 ppm1 0.944 ppm2 7.441 CV 1
ASSI { 691}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 16 and name HN ))
4.200 2.200 1.800 peak 691 spectrum 1 weight 0.11000E+01 volume 0.60586E-03 ppm1 0.796 ppm2 7.878 CV 1
ASSI { 692}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 33 and name HN ))
6.000 6.000 0.000 peak 692 spectrum 1 weight 0.11000E+01 volume 0.44363E-04 ppm1 0.797 ppm2 8.063 CV 1
ASSI { 693}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 29 and name HD21))
4.100 2.100 1.900 peak 693 spectrum 1 weight 0.11000E+01 volume 0.49056E-03 ppm1 0.796 ppm2 7.382 CV 1
ASSI { 694}
( segid " " and resid 15 and name HD2%)
( segid " " and resid 11 and name HD% )
4.600 2.700 1.400 peak 694 spectrum 1 weight 0.11000E+01 volume 0.38232E-03 ppm1 0.797 ppm2 7.010 CV 1
ASSI { 695}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 29 and name HD22))
5.700 4.000 0.300 peak 695 spectrum 1 weight 0.11000E+01 volume 0.39350E-03 ppm1 0.797 ppm2 6.612 CV 1
ASSI { 696}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 29 and name HN ))
6.000 5.700 0.000 peak 696 spectrum 1 weight 0.11000E+01 volume 0.23601E-04 ppm1 0.243 ppm2 8.615 CV 1
ASSI { 697}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 32 and name HN ))
5.400 5.400 0.600 peak 697 spectrum 1 weight 0.11000E+01 volume 0.67575E-04 ppm1 0.241 ppm2 8.050 CV 1
ASSI { 699}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 29 and name HD21))
4.200 4.200 1.800 peak 699 spectrum 1 weight 0.11000E+01 volume 0.82451E-04 ppm1 0.242 ppm2 7.425 CV 1
ASSI { 700}
( segid " " and resid 47 and name HD2%)
( segid " " and resid 23 and name HD% )
3.000 3.000 3.000 peak 700 spectrum 1 weight 0.11000E+01 volume 0.18582E-02 ppm1 0.241 ppm2 7.216 CV 1
ASSI { 701}
( segid " " and resid 15 and name HD1%)
( segid " " and resid 11 and name HD% )
3.800 1.800 1.800 peak 701 spectrum 1 weight 0.11000E+01 volume 0.23578E-02 ppm1 0.899 ppm2 7.016 CV 1
ASSI { 703}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 16 and name HN ))
4.500 2.500 1.500 peak 703 spectrum 1 weight 0.11000E+01 volume 0.62205E-03 ppm1 0.901 ppm2 7.872 CV 1
ASSI { 704}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 20 and name HN ))
5.900 5.900 0.100 peak 704 spectrum 1 weight 0.11000E+01 volume 0.17784E-03 ppm1 0.498 ppm2 8.310 CV 1
ASSI { 705}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 19 and name HN ))
4.000 4.000 2.000 peak 705 spectrum 1 weight 0.11000E+01 volume 0.14590E-02 ppm1 0.498 ppm2 7.909 CV 1
ASSI { 706}
( segid " " and resid 18 and name HD2%)
( segid " " and resid 23 and name HD% )
4.100 2.100 1.900 peak 706 spectrum 1 weight 0.11000E+01 volume 0.27485E-03 ppm1 0.492 ppm2 7.293 CV 1
ASSI { 711}
( segid " " and resid 33 and name HD2%)
( segid " " and resid 11 and name HD% )
3.300 1.400 1.400 peak 711 spectrum 1 weight 0.11000E+01 volume 0.91100E-03 ppm1 0.518 ppm2 7.013 CV 1
ASSI { 715}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 14 and name HB2 ))
3.900 1.900 1.900 peak 715 spectrum 1 weight 0.11000E+01 volume 0.97417E-03 ppm1 0.201 ppm2 2.082 CV 1
ASSI { 717}
( segid " " and resid 33 and name HD1%)
( segid " " and resid 33 and name HD2%)
2.200 2.200 3.800 peak 717 spectrum 1 weight 0.11000E+01 volume 0.67336E-02 ppm1 0.200 ppm2 0.513 CV 1
ASSI { 718}
( segid " " and resid 33 and name HD1%)
(( segid " " and resid 33 and name HB1 ))
3.200 1.300 1.300 peak 718 spectrum 1 weight 0.11000E+01 volume 0.36748E-02 ppm1 0.200 ppm2 0.035 CV 1
ASSI { 719}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 15 and name HA ))
5.200 3.300 0.800 peak 719 spectrum 1 weight 0.11000E+01 volume 0.74704E-04 ppm1 0.496 ppm2 3.829 CV 1
ASSI { 720}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 23 and name HB2 ))
4.800 2.900 1.200 peak 720 spectrum 1 weight 0.11000E+01 volume 0.25786E-03 ppm1 0.499 ppm2 3.488 CV 1
ASSI { 721}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 29 and name HB2 ))
4.500 2.500 1.500 peak 721 spectrum 1 weight 0.11000E+01 volume 0.81387E-03 ppm1 0.498 ppm2 2.960 CV 1
ASSI { 722}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 23 and name HB1 ))
3.700 1.700 1.700 peak 722 spectrum 1 weight 0.11000E+01 volume 0.69952E-03 ppm1 0.499 ppm2 2.744 CV 1
ASSI { 723}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 21 and name HB2 ))
5.500 5.500 0.500 peak 723 spectrum 1 weight 0.11000E+01 volume 0.22260E-03 ppm1 0.499 ppm2 2.513 CV 1
ASSI { 724}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 29 and name HB1 ))
2.800 1.000 1.000 peak 724 spectrum 1 weight 0.11000E+01 volume 0.71755E-03 ppm1 0.500 ppm2 2.299 CV 1
ASSI { 725}
( segid " " and resid 18 and name HD1%)
( segid " " and resid 21 and name HE% )
4.600 4.600 1.400 peak 725 spectrum 1 weight 0.11000E+01 volume 0.68964E-03 ppm1 0.500 ppm2 2.125 CV 1
ASSI { 726}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 33 and name HG ))
3.700 3.700 2.300 peak 726 spectrum 1 weight 0.11000E+01 volume 0.11856E-02 ppm1 0.499 ppm2 1.327 CV 1
ASSI { 727}
( segid " " and resid 18 and name HD1%)
( segid " " and resid 33 and name HD1%)
2.600 2.600 3.400 peak 727 spectrum 1 weight 0.11000E+01 volume 0.27638E-02 ppm1 0.497 ppm2 0.256 CV 1
ASSI { 728}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 29 and name HA ))
4.100 2.100 1.900 peak 728 spectrum 1 weight 0.11000E+01 volume 0.10375E-02 ppm1 0.795 ppm2 4.072 CV 1
ASSI { 729}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 11 and name HB2 ))
5.400 3.700 0.600 peak 729 spectrum 1 weight 0.11000E+01 volume 0.22741E-03 ppm1 0.795 ppm2 3.414 CV 1
ASSI { 730}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 26 and name HD1 ))
4.800 2.900 1.200 peak 730 spectrum 1 weight 0.11000E+01 volume 0.32848E-03 ppm1 0.793 ppm2 3.170 CV 1
ASSI { 731}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 29 and name HB2 ))
3.000 1.100 1.100 peak 731 spectrum 1 weight 0.11000E+01 volume 0.13814E-02 ppm1 0.795 ppm2 2.940 CV 1
ASSI { 732}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 11 and name HB1 ))
3.500 1.500 1.500 peak 732 spectrum 1 weight 0.11000E+01 volume 0.38494E-03 ppm1 0.794 ppm2 2.721 CV 1
ASSI { 733}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 12 and name HG2 ))
3.800 3.800 2.200 peak 733 spectrum 1 weight 0.11000E+01 volume 0.15701E-03 ppm1 0.795 ppm2 2.449 CV 1
ASSI { 734}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 29 and name HB1 ))
2.100 0.600 0.600 peak 734 spectrum 1 weight 0.11000E+01 volume 0.26906E-02 ppm1 0.793 ppm2 2.264 CV 1
ASSI { 735}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 15 and name HB2 ))
2.800 1.000 1.000 peak 735 spectrum 1 weight 0.11000E+01 volume 0.46752E-02 ppm1 0.795 ppm2 1.973 CV 1
ASSI { 736}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 15 and name HG ))
2.000 0.500 0.500 peak 736 spectrum 1 weight 0.11000E+01 volume 0.81906E-02 ppm1 0.795 ppm2 1.650 CV 1
ASSI { 737}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 15 and name HB1 ))
2.200 0.600 0.600 peak 737 spectrum 1 weight 0.11000E+01 volume 0.77252E-02 ppm1 0.797 ppm2 1.498 CV 1
ASSI { 738}
( segid " " and resid 15 and name HD2%)
( segid " " and resid 33 and name HD2%)
2.300 2.300 3.700 peak 738 spectrum 1 weight 0.11000E+01 volume 0.81518E-02 ppm1 0.796 ppm2 0.510 CV 1
ASSI { 739}
( segid " " and resid 15 and name HD2%)
( segid " " and resid 33 and name HD1%)
3.100 1.200 1.200 peak 739 spectrum 1 weight 0.11000E+01 volume 0.65077E-03 ppm1 0.796 ppm2 0.204 CV 1
ASSI { 740}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 11 and name HB1 ))
4.500 2.600 1.500 peak 740 spectrum 1 weight 0.11000E+01 volume 0.36138E-03 ppm1 0.938 ppm2 2.722 CV 1
ASSI { 741}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 27 and name HG1 ))
2.300 2.300 3.700 peak 741 spectrum 1 weight 0.11000E+01 volume 0.26803E-02 ppm1 0.935 ppm2 2.221 CV 1
ASSI { 742}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 30 and name HB2 ))
2.500 2.500 3.500 peak 742 spectrum 1 weight 0.11000E+01 volume 0.56690E-02 ppm1 0.935 ppm2 1.884 CV 1
ASSI { 743}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 30 and name HG ))
2.000 2.000 4.000 peak 743 spectrum 1 weight 0.11000E+01 volume 0.13037E-01 ppm1 0.935 ppm2 1.639 CV 1
ASSI { 744}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 23 and name HB2 ))
3.300 1.400 1.400 peak 744 spectrum 1 weight 0.11000E+01 volume 0.34318E-03 ppm1 0.240 ppm2 3.464 CV 1
ASSI { 745}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 18 and name HB2 ))
2.800 2.800 3.200 peak 745 spectrum 1 weight 0.11000E+01 volume 0.90748E-03 ppm1 0.242 ppm2 1.849 CV 1
ASSI { 746}
( segid " " and resid 47 and name HD2%)
( segid " " and resid 47 and name HD1%)
2.300 2.300 3.700 peak 746 spectrum 1 weight 0.11000E+01 volume 0.70808E-02 ppm1 0.241 ppm2 0.731 CV 1
ASSI { 747}
( segid " " and resid 47 and name HD2%)
( segid " " and resid 18 and name HD2%)
2.300 2.300 3.700 peak 747 spectrum 1 weight 0.11000E+01 volume 0.30917E-02 ppm1 0.242 ppm2 0.507 CV 1
ASSI { 748}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 11 and name HB2 ))
5.300 3.500 0.700 peak 748 spectrum 1 weight 0.11000E+01 volume 0.18167E-03 ppm1 0.895 ppm2 3.421 CV 1
ASSI { 749}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 26 and name HD2 ))
4.600 2.600 1.400 peak 749 spectrum 1 weight 0.11000E+01 volume 0.18576E-03 ppm1 0.898 ppm2 3.171 CV 1
ASSI { 750}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 29 and name HB2 ))
4.200 2.200 1.800 peak 750 spectrum 1 weight 0.11000E+01 volume 0.16558E-03 ppm1 0.882 ppm2 2.958 CV 1
ASSI { 751}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 11 and name HB1 ))
3.100 1.200 1.200 peak 751 spectrum 1 weight 0.11000E+01 volume 0.18164E-02 ppm1 0.897 ppm2 2.726 CV 1
ASSI { 754}
( segid " " and resid 15 and name HD1%)
(( segid " " and resid 15 and name HG ))
1.900 1.900 4.100 peak 754 spectrum 1 weight 0.11000E+01 volume 0.12476E-01 ppm1 0.916 ppm2 1.620 CV 1
ASSI { 758}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 18 and name HA ))
2.600 2.600 3.400 peak 758 spectrum 1 weight 0.11000E+01 volume 0.17050E-02 ppm1 0.495 ppm2 4.101 CV 1
ASSI { 759}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 15 and name HA ))
3.600 3.600 2.400 peak 759 spectrum 1 weight 0.11000E+01 volume 0.25566E-02 ppm1 0.503 ppm2 3.847 CV 1
ASSI { 762}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 29 and name HB2 ))
5.100 5.100 0.900 peak 762 spectrum 1 weight 0.11000E+01 volume 0.80012E-03 ppm1 0.500 ppm2 2.938 CV 1
ASSI { 764}
( segid " " and resid 18 and name HD2%)
( segid " " and resid 21 and name HE% )
3.300 3.300 2.700 peak 764 spectrum 1 weight 0.11000E+01 volume 0.11465E-02 ppm1 0.512 ppm2 2.086 CV 1
ASSI { 766}
(( segid " " and resid 10 and name HG1 ))
(( segid " " and resid 10 and name HD1 ))
2.900 1.100 1.100 peak 766 spectrum 1 weight 0.11000E+01 volume 0.20310E-02 ppm1 0.906 ppm2 2.651 CV 1
ASSI { 768}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HD1 ))
2.700 0.900 0.900 peak 768 spectrum 1 weight 0.11000E+01 volume 0.29889E-02 ppm1 1.170 ppm2 2.651 CV 1
ASSI { 770}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 44 and name HA ))
3.300 3.300 2.700 peak 770 spectrum 1 weight 0.11000E+01 volume 0.63287E-03 ppm1 0.724 ppm2 2.956 CV 1
ASSI { 771}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 29 and name HB1 ))
3.500 3.500 2.500 peak 771 spectrum 1 weight 0.11000E+01 volume 0.23255E-03 ppm1 0.727 ppm2 2.278 CV 1
ASSI { 772}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 18 and name HB2 ))
2.700 2.700 3.300 peak 772 spectrum 1 weight 0.11000E+01 volume 0.12101E-02 ppm1 0.723 ppm2 1.863 CV 1
ASSI { 773}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 47 and name HB2 ))
2.100 2.100 3.900 peak 773 spectrum 1 weight 0.11000E+01 volume 0.91533E-02 ppm1 0.724 ppm2 1.507 CV 1
ASSI { 776}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 45 and name HA ))
2.900 2.900 3.100 peak 776 spectrum 1 weight 0.11000E+01 volume 0.71372E-03 ppm1 0.982 ppm2 3.877 CV 1
ASSI { 777}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 21 and name HB1 ))
3.400 3.400 2.600 peak 777 spectrum 1 weight 0.11000E+01 volume 0.30556E-03 ppm1 0.984 ppm2 2.367 CV 1
ASSI { 778}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 48 and name HG ))
2.300 0.600 0.600 peak 778 spectrum 1 weight 0.11000E+01 volume 0.91208E-02 ppm1 0.983 ppm2 1.881 CV 1
ASSI { 779}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 48 and name HB1 ))
3.100 1.200 1.200 peak 779 spectrum 1 weight 0.11000E+01 volume 0.31633E-02 ppm1 0.982 ppm2 1.506 CV 1
ASSI { 780}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 44 and name HA ))
5.200 3.400 0.800 peak 780 spectrum 1 weight 0.11000E+01 volume 0.21983E-04 ppm1 0.983 ppm2 2.986 CV 1
ASSI { 785}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 46 and name HD2 ))
2.500 0.800 0.800 peak 785 spectrum 1 weight 0.11000E+01 volume 0.26662E-02 ppm1 0.945 ppm2 2.897 CV 1
ASSI { 786}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 39 and name HB1 ))
4.600 2.600 1.400 peak 786 spectrum 1 weight 0.11000E+01 volume 0.41719E-03 ppm1 0.943 ppm2 2.589 CV 1
ASSI { 787}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 46 and name HB2 ))
3.500 1.600 1.600 peak 787 spectrum 1 weight 0.11000E+01 volume 0.17999E-02 ppm1 0.945 ppm2 1.850 CV 1
ASSI { 788}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 46 and name HG2 ))
3.900 1.900 1.900 peak 788 spectrum 1 weight 0.11000E+01 volume 0.14559E-02 ppm1 0.945 ppm2 1.654 CV 1
ASSI { 789}
( segid " " and resid 36 and name HG2%)
( segid " " and resid 42 and name HB% )
2.200 0.600 0.600 peak 789 spectrum 1 weight 0.11000E+01 volume 0.10178E-01 ppm1 0.940 ppm2 1.411 CV 1
ASSI { 790}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 9 and name HB ))
2.300 0.700 0.700 peak 790 spectrum 1 weight 0.11000E+01 volume 0.74069E-02 ppm1 0.856 ppm2 2.069 CV 1
ASSI { 791}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 13 and name HG1 ))
3.800 3.800 2.200 peak 791 spectrum 1 weight 0.11000E+01 volume 0.78758E-03 ppm1 0.857 ppm2 2.393 CV 1
ASSI { 792}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 22 and name HA2 ))
4.100 4.100 1.900 peak 792 spectrum 1 weight 0.11000E+01 volume 0.57646E-03 ppm1 0.787 ppm2 4.076 CV 1
ASSI { 793}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 19 and name HB1 ))
6.000 4.800 0.000 peak 793 spectrum 1 weight 0.11000E+01 volume 0.61005E-04 ppm1 0.789 ppm2 2.737 CV 1
ASSI { 795}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 24 and name HG11))
2.800 2.800 3.200 peak 795 spectrum 1 weight 0.11000E+01 volume 0.25152E-02 ppm1 0.787 ppm2 1.142 CV 1
ASSI { 797}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 34 and name HB ))
2.300 0.600 0.600 peak 797 spectrum 1 weight 0.11000E+01 volume 0.83975E-02 ppm1 0.892 ppm2 1.766 CV 1
ASSI { 798}
( segid " " and resid 34 and name HG2%)
( segid " " and resid 35 and name HB% )
3.800 1.800 1.800 peak 798 spectrum 1 weight 0.11000E+01 volume 0.11201E-02 ppm1 0.891 ppm2 1.434 CV 1
ASSI { 799}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HN ))
3.100 1.200 1.200 peak 799 spectrum 1 weight 0.11000E+01 volume 0.66128E-03 ppm1 3.417 ppm2 8.200 CV 1
ASSI { 800}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 11 and name HN ))
3.800 1.800 1.800 peak 800 spectrum 1 weight 0.11000E+01 volume 0.12803E-02 ppm1 2.724 ppm2 8.186 CV 1
ASSI { 801}
(( segid " " and resid 41 and name HB1 ))
(( segid " " and resid 41 and name HD22))
3.600 1.600 1.600 peak 801 spectrum 1 weight 0.11000E+01 volume 0.35611E-02 ppm1 2.668 ppm2 6.958 CV 1
ASSI { 802}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 11 and name HD% )
2.900 1.000 1.000 peak 802 spectrum 1 weight 0.11000E+01 volume 0.17592E-02 ppm1 3.409 ppm2 7.016 CV 1
ASSI { 803}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 12 and name HA ))
5.100 3.300 0.900 peak 803 spectrum 1 weight 0.11000E+01 volume 0.17097E-03 ppm1 3.415 ppm2 3.907 CV 1
ASSI { 804}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 14 and name HB2 ))
5.500 3.800 0.500 peak 804 spectrum 1 weight 0.11000E+01 volume 0.19231E-03 ppm1 3.416 ppm2 2.080 CV 1
ASSI { 805}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 30 and name HB1 ))
4.200 2.200 1.800 peak 805 spectrum 1 weight 0.11000E+01 volume 0.58034E-03 ppm1 3.417 ppm2 1.629 CV 1
ASSI { 806}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 30 and name HD1%)
4.500 2.500 1.500 peak 806 spectrum 1 weight 0.11000E+01 volume 0.97810E-03 ppm1 3.414 ppm2 0.908 CV 1
ASSI { 807}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 33 and name HD2%)
4.500 2.500 1.500 peak 807 spectrum 1 weight 0.11000E+01 volume 0.92692E-03 ppm1 3.405 ppm2 0.527 CV 1
ASSI { 808}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 14 and name HB2 ))
5.300 3.500 0.700 peak 808 spectrum 1 weight 0.11000E+01 volume 0.15005E-03 ppm1 2.719 ppm2 2.094 CV 1
ASSI { 809}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 14 and name HB1 ))
5.900 4.400 0.100 peak 809 spectrum 1 weight 0.11000E+01 volume 0.13048E-03 ppm1 2.736 ppm2 1.633 CV 1
ASSI { 810}
(( segid " " and resid 11 and name HB1 ))
( segid " " and resid 30 and name HD1%)
4.400 2.400 1.600 peak 810 spectrum 1 weight 0.11000E+01 volume 0.94910E-03 ppm1 2.731 ppm2 0.911 CV 1
ASSI { 811}
(( segid " " and resid 11 and name HB1 ))
( segid " " and resid 33 and name HD2%)
5.000 3.100 1.000 peak 811 spectrum 1 weight 0.11000E+01 volume 0.13809E-03 ppm1 2.719 ppm2 0.529 CV 1
ASSI { 812}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 11 and name HB2 ))
2.700 0.900 0.900 peak 812 spectrum 1 weight 0.11000E+01 volume 0.88692E-03 ppm1 2.720 ppm2 3.396 CV 1
ASSI { 813}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 21 and name HN ))
6.000 6.000 0.000 peak 813 spectrum 1 weight 0.11000E+01 volume 0.41912E-04 ppm1 2.878 ppm2 7.648 CV 1
ASSI { 814}
(( segid " " and resid 19 and name HB1 ))
(( segid " " and resid 21 and name HN ))
6.000 6.000 0.000 peak 814 spectrum 1 weight 0.11000E+01 volume 0.39518E-04 ppm1 2.732 ppm2 7.645 CV 1
ASSI { 818}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 11 and name HD% )
3.400 1.500 1.500 peak 818 spectrum 1 weight 0.11000E+01 volume 0.10531E-02 ppm1 1.504 ppm2 7.019 CV 1
ASSI { 819}
(( segid " " and resid 33 and name HB1 ))
( segid " " and resid 11 and name HD% )
3.200 1.300 1.300 peak 819 spectrum 1 weight 0.11000E+01 volume 0.68906E-03 ppm1 0.042 ppm2 7.012 CV 1
ASSI { 820}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 29 and name HD22))
5.200 5.200 0.800 peak 820 spectrum 1 weight 0.11000E+01 volume 0.23955E-04 ppm1 0.238 ppm2 6.605 CV 1
ASSI { 821}
(( segid " " and resid 38 and name HA1 ))
(( segid " " and resid 40 and name HN ))
3.500 1.500 1.500 peak 821 spectrum 1 weight 0.11000E+01 volume 0.16742E-02 ppm1 2.450 ppm2 8.921 CV 1
ASSI { 823}
(( segid " " and resid 38 and name HA1 ))
(( segid " " and resid 14 and name HE21))
4.600 2.700 1.400 peak 823 spectrum 1 weight 0.11000E+01 volume 0.31062E-03 ppm1 2.451 ppm2 7.986 CV 1
ASSI { 825}
(( segid " " and resid 38 and name HA1 ))
(( segid " " and resid 14 and name HE22))
4.700 4.700 1.300 peak 825 spectrum 1 weight 0.11000E+01 volume 0.28401E-03 ppm1 2.447 ppm2 7.359 CV 1
ASSI { 826}
(( segid " " and resid 38 and name HA1 ))
( segid " " and resid 11 and name HD% )
3.500 3.500 2.500 peak 826 spectrum 1 weight 0.11000E+01 volume 0.18325E-02 ppm1 2.459 ppm2 7.019 CV 1
ASSI { 829}
(( segid " " and resid 38 and name HA1 ))
(( segid " " and resid 38 and name HA2 ))
2.100 0.600 0.600 peak 829 spectrum 1 weight 0.11000E+01 volume 0.51261E-02 ppm1 2.453 ppm2 3.973 CV 1
ASSI { 831}
(( segid " " and resid 38 and name HA1 ))
(( segid " " and resid 40 and name HG12))
6.000 6.000 0.000 peak 831 spectrum 1 weight 0.11000E+01 volume 0.19367E-03 ppm1 2.449 ppm2 1.355 CV 1
ASSI { 833}
(( segid " " and resid 38 and name HA1 ))
( segid " " and resid 40 and name HG2%)
6.000 6.000 0.000 peak 833 spectrum 1 weight 0.11000E+01 volume 0.28628E-04 ppm1 2.452 ppm2 0.812 CV 1
ASSI { 834}
(( segid " " and resid 38 and name HA1 ))
( segid " " and resid 33 and name HD2%)
5.600 5.600 0.400 peak 834 spectrum 1 weight 0.11000E+01 volume 0.32377E-03 ppm1 2.453 ppm2 0.520 CV 1
ASSI { 835}
(( segid " " and resid 38 and name HA1 ))
( segid " " and resid 33 and name HD1%)
4.800 2.800 1.200 peak 835 spectrum 1 weight 0.11000E+01 volume 0.17829E-02 ppm1 2.452 ppm2 0.208 CV 1
ASSI { 837}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 39 and name HN ))
3.400 1.500 1.500 peak 837 spectrum 1 weight 0.11000E+01 volume 0.71016E-03 ppm1 4.607 ppm2 6.851 CV 1
ASSI { 838}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 36 and name HN ))
4.100 2.100 1.900 peak 838 spectrum 1 weight 0.11000E+01 volume 0.36304E-03 ppm1 4.605 ppm2 7.689 CV 1
ASSI { 840}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 42 and name HN ))
5.700 4.100 0.300 peak 840 spectrum 1 weight 0.11000E+01 volume 0.11539E-03 ppm1 4.605 ppm2 8.076 CV 1
ASSI { 841}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 36 and name HG1 ))
2.700 0.900 0.900 peak 841 spectrum 1 weight 0.11000E+01 volume 0.14676E-02 ppm1 4.605 ppm2 3.831 CV 1
ASSI { 842}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 33 and name HA ))
6.000 4.700 0.000 peak 842 spectrum 1 weight 0.11000E+01 volume 0.78267E-04 ppm1 4.609 ppm2 3.606 CV 1
ASSI { 843}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 39 and name HB2 ))
3.900 3.900 2.100 peak 843 spectrum 1 weight 0.11000E+01 volume 0.11290E-02 ppm1 4.605 ppm2 2.812 CV 1
ASSI { 844}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 39 and name HB1 ))
2.400 0.700 0.700 peak 844 spectrum 1 weight 0.11000E+01 volume 0.10591E-02 ppm1 4.610 ppm2 2.599 CV 1
ASSI { 845}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 36 and name HN ))
3.300 3.300 2.700 peak 845 spectrum 1 weight 0.11000E+01 volume 0.81207E-03 ppm1 3.595 ppm2 7.621 CV 1
ASSI { 846}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 29 and name HD22))
5.800 5.800 0.200 peak 846 spectrum 1 weight 0.11000E+01 volume 0.15243E-03 ppm1 0.499 ppm2 6.610 CV 1
ASSI { 847}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 26 and name HE ))
5.100 5.100 0.900 peak 847 spectrum 1 weight 0.11000E+01 volume 0.26454E-04 ppm1 0.935 ppm2 6.605 CV 1
ASSI { 849}
( segid " " and resid 15 and name HD2%)
(( segid " " and resid 15 and name HN ))
2.900 2.900 3.100 peak 849 spectrum 1 weight 0.11000E+01 volume 0.16948E-02 ppm1 0.796 ppm2 8.744 CV 1
ASSI { 850}
(( segid " " and resid 34 and name HG11))
( segid " " and resid 11 and name HD% )
3.300 1.400 1.400 peak 850 spectrum 1 weight 0.11000E+01 volume 0.19466E-02 ppm1 1.048 ppm2 7.020 CV 1
ASSI { 851}
(( segid " " and resid 34 and name HG11))
(( segid " " and resid 35 and name HN ))
5.100 3.300 0.900 peak 851 spectrum 1 weight 0.11000E+01 volume 0.23970E-03 ppm1 1.032 ppm2 7.704 CV 1
ASSI { 853}
(( segid " " and resid 34 and name HG12))
( segid " " and resid 11 and name HD% )
3.500 1.500 1.500 peak 853 spectrum 1 weight 0.11000E+01 volume 0.14003E-02 ppm1 1.870 ppm2 7.006 CV 1
ASSI { 856}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 23 and name HA ))
4.800 4.800 1.200 peak 856 spectrum 1 weight 0.11000E+01 volume 0.19057E-03 ppm1 0.787 ppm2 4.596 CV 1
ASSI { 857}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 25 and name HN ))
5.100 3.300 0.900 peak 857 spectrum 1 weight 0.11000E+01 volume 0.40376E-03 ppm1 0.787 ppm2 9.065 CV 1
ASSI { 858}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB2 ))
2.900 1.100 1.100 peak 858 spectrum 1 weight 0.11000E+01 volume 0.17636E-02 ppm1 3.592 ppm2 1.493 CV 1
ASSI { 859}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 43 and name HB% )
3.300 1.300 1.300 peak 859 spectrum 1 weight 0.11000E+01 volume 0.10934E-02 ppm1 3.587 ppm2 1.095 CV 1
ASSI { 860}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 36 and name HG2%)
4.100 2.100 1.900 peak 860 spectrum 1 weight 0.11000E+01 volume 0.68437E-03 ppm1 3.585 ppm2 0.942 CV 1
ASSI { 862}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 36 and name HG1 ))
2.700 0.900 0.900 peak 862 spectrum 1 weight 0.11000E+01 volume 0.16072E-02 ppm1 3.588 ppm2 3.836 CV 1
ASSI { 863}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 32 and name HA ))
3.800 1.900 1.900 peak 863 spectrum 1 weight 0.11000E+01 volume 0.59657E-03 ppm1 3.591 ppm2 4.004 CV 1
ASSI { 864}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 38 and name HA1 ))
5.200 3.300 0.800 peak 864 spectrum 1 weight 0.11000E+01 volume 0.46247E-03 ppm1 3.593 ppm2 2.460 CV 1
ASSI { 865}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 33 and name HD1%)
2.300 0.600 0.600 peak 865 spectrum 1 weight 0.11000E+01 volume 0.43375E-02 ppm1 1.501 ppm2 0.213 CV 1
ASSI { 867}
(( segid " " and resid 33 and name HB1 ))
( segid " " and resid 33 and name HD2%)
2.600 0.800 0.800 peak 867 spectrum 1 weight 0.11000E+01 volume 0.14399E-02 ppm1 0.040 ppm2 0.520 CV 1
ASSI { 868}
(( segid " " and resid 33 and name HB1 ))
( segid " " and resid 36 and name HG2%)
6.000 6.000 0.000 peak 868 spectrum 1 weight 0.11000E+01 volume 0.40118E-04 ppm1 0.041 ppm2 0.947 CV 1
ASSI { 869}
(( segid " " and resid 33 and name HB1 ))
( segid " " and resid 43 and name HB% )
5.500 3.700 0.500 peak 869 spectrum 1 weight 0.11000E+01 volume 0.22015E-03 ppm1 0.040 ppm2 1.089 CV 1
ASSI { 870}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 33 and name HG ))
2.900 1.000 1.000 peak 870 spectrum 1 weight 0.11000E+01 volume 0.16401E-02 ppm1 0.038 ppm2 1.349 CV 1
ASSI { 872}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 38 and name HA1 ))
5.500 3.800 0.500 peak 872 spectrum 1 weight 0.11000E+01 volume 0.26566E-03 ppm1 0.045 ppm2 2.460 CV 1
ASSI { 874}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 30 and name HA ))
5.000 3.100 1.000 peak 874 spectrum 1 weight 0.11000E+01 volume 0.36506E-03 ppm1 0.036 ppm2 3.861 CV 1
ASSI { 876}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 29 and name HB2 ))
5.300 3.600 0.700 peak 876 spectrum 1 weight 0.11000E+01 volume 0.46030E-03 ppm1 1.501 ppm2 2.954 CV 1
ASSI { 877}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 38 and name HA1 ))
6.000 4.800 0.000 peak 877 spectrum 1 weight 0.11000E+01 volume 0.31990E-03 ppm1 1.491 ppm2 2.480 CV 1
ASSI { 881}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HB1 ))
1.900 0.500 0.500 peak 881 spectrum 1 weight 0.11000E+01 volume 0.35137E-02 ppm1 1.486 ppm2 0.044 CV 1
ASSI { 883}
(( segid " " and resid 33 and name HG ))
(( segid " " and resid 34 and name HN ))
5.000 3.100 1.000 peak 883 spectrum 1 weight 0.11000E+01 volume 0.27757E-03 ppm1 1.326 ppm2 8.645 CV 1
ASSI { 885}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HG2 ))
2.600 2.600 3.400 peak 885 spectrum 1 weight 0.11000E+01 volume 0.38240E-02 ppm1 1.338 ppm2 1.162 CV 1
ASSI { 892}
( segid " " and resid 33 and name HD2%)
( segid " " and resid 43 and name HB% )
4.300 2.300 1.700 peak 892 spectrum 1 weight 0.11000E+01 volume 0.77157E-03 ppm1 0.514 ppm2 1.111 CV 1
ASSI { 893}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 14 and name HB2 ))
2.500 0.800 0.800 peak 893 spectrum 1 weight 0.11000E+01 volume 0.19857E-02 ppm1 0.514 ppm2 2.085 CV 1
ASSI { 894}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 14 and name HG1 ))
4.800 2.900 1.200 peak 894 spectrum 1 weight 0.11000E+01 volume 0.36272E-03 ppm1 0.514 ppm2 2.479 CV 1
ASSI { 897}
( segid " " and resid 33 and name HD2%)
(( segid " " and resid 33 and name HA ))
3.600 1.600 1.600 peak 897 spectrum 1 weight 0.11000E+01 volume 0.14597E-02 ppm1 0.517 ppm2 3.589 CV 1
ASSI { 903}
(( segid " " and resid 18 and name HG ))
(( segid " " and resid 20 and name HN ))
4.400 2.500 1.600 peak 903 spectrum 1 weight 0.11000E+01 volume 0.52880E-03 ppm1 1.737 ppm2 8.297 CV 1
ASSI { 905}
(( segid " " and resid 18 and name HG ))
( segid " " and resid 23 and name HD% )
6.000 6.000 0.000 peak 905 spectrum 1 weight 0.11000E+01 volume 0.75358E-04 ppm1 1.720 ppm2 7.233 CV 1
ASSI { 908}
(( segid " " and resid 18 and name HG ))
( segid " " and resid 33 and name HD1%)
4.400 2.400 1.600 peak 908 spectrum 1 weight 0.11000E+01 volume 0.17942E-03 ppm1 1.746 ppm2 0.227 CV 1
ASSI { 909}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 14 and name HN ))
6.000 5.300 0.000 peak 909 spectrum 1 weight 0.11000E+01 volume 0.56063E-04 ppm1 1.981 ppm2 9.288 CV 1
ASSI { 911}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 17 and name HN ))
6.000 6.000 0.000 peak 911 spectrum 1 weight 0.11000E+01 volume 0.29191E-04 ppm1 1.983 ppm2 8.298 CV 1
ASSI { 914}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 18 and name HA ))
3.000 1.100 1.100 peak 914 spectrum 1 weight 0.11000E+01 volume 0.11233E-02 ppm1 1.872 ppm2 4.129 CV 1
ASSI { 915}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 19 and name HN ))
2.500 0.800 0.800 peak 915 spectrum 1 weight 0.11000E+01 volume 0.23314E-02 ppm1 1.872 ppm2 7.904 CV 1
ASSI { 916}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 23 and name HD% )
6.000 4.700 0.000 peak 916 spectrum 1 weight 0.11000E+01 volume 0.27253E-03 ppm1 1.871 ppm2 7.257 CV 1
ASSI { 917}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 29 and name HD22))
4.900 3.000 1.100 peak 917 spectrum 1 weight 0.11000E+01 volume 0.95118E-04 ppm1 1.871 ppm2 6.639 CV 1
ASSI { 918}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 29 and name HD22))
4.000 2.000 2.000 peak 918 spectrum 1 weight 0.11000E+01 volume 0.28829E-03 ppm1 1.486 ppm2 6.611 CV 1
ASSI { 919}
(( segid " " and resid 18 and name HB1 ))
( segid " " and resid 23 and name HD% )
4.400 2.400 1.600 peak 919 spectrum 1 weight 0.11000E+01 volume 0.59806E-03 ppm1 1.490 ppm2 7.233 CV 1
ASSI { 920}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 23 and name HN ))
3.400 1.500 1.500 peak 920 spectrum 1 weight 0.11000E+01 volume 0.17367E-02 ppm1 1.476 ppm2 7.885 CV 1
ASSI { 921}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 18 and name HN ))
3.200 1.300 1.300 peak 921 spectrum 1 weight 0.11000E+01 volume 0.33821E-02 ppm1 1.481 ppm2 8.747 CV 1
ASSI { 922}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 18 and name HN ))
2.700 0.900 0.900 peak 922 spectrum 1 weight 0.11000E+01 volume 0.13309E-02 ppm1 1.872 ppm2 8.750 CV 1
ASSI { 923}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 18 and name HA ))
2.700 0.900 0.900 peak 923 spectrum 1 weight 0.11000E+01 volume 0.90987E-03 ppm1 1.473 ppm2 4.122 CV 1
ASSI { 924}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 23 and name HB2 ))
5.600 3.900 0.400 peak 924 spectrum 1 weight 0.11000E+01 volume 0.21173E-03 ppm1 1.870 ppm2 3.459 CV 1
ASSI { 925}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 15 and name HA ))
2.600 0.800 0.800 peak 925 spectrum 1 weight 0.11000E+01 volume 0.22240E-02 ppm1 1.871 ppm2 3.855 CV 1
ASSI { 926}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 23 and name HB2 ))
3.100 1.200 1.200 peak 926 spectrum 1 weight 0.11000E+01 volume 0.33233E-03 ppm1 1.481 ppm2 3.457 CV 1
ASSI { 927}
(( segid " " and resid 18 and name HB1 ))
(( segid " " and resid 15 and name HA ))
3.300 1.300 1.300 peak 927 spectrum 1 weight 0.11000E+01 volume 0.47347E-02 ppm1 1.481 ppm2 3.856 CV 1
ASSI { 928}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 21 and name HG2 ))
6.000 6.000 0.000 peak 928 spectrum 1 weight 0.11000E+01 volume 0.85364E-04 ppm1 1.860 ppm2 2.907 CV 1
ASSI { 929}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 23 and name HB1 ))
4.900 3.000 1.100 peak 929 spectrum 1 weight 0.11000E+01 volume 0.49435E-03 ppm1 1.871 ppm2 2.737 CV 1
ASSI { 930}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 29 and name HB1 ))
3.900 1.900 1.900 peak 930 spectrum 1 weight 0.11000E+01 volume 0.25557E-03 ppm1 1.860 ppm2 2.261 CV 1
ASSI { 931}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 18 and name HB1 ))
1.800 0.400 0.400 peak 931 spectrum 1 weight 0.11000E+01 volume 0.57705E-02 ppm1 1.874 ppm2 1.497 CV 1
ASSI { 932}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 15 and name HD1%)
3.000 3.000 3.000 peak 932 spectrum 1 weight 0.11000E+01 volume 0.62669E-02 ppm1 1.877 ppm2 0.897 CV 1
ASSI { 933}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 18 and name HD2%)
3.100 1.200 1.200 peak 933 spectrum 1 weight 0.11000E+01 volume 0.33673E-02 ppm1 1.871 ppm2 0.500 CV 1
ASSI { 934}
(( segid " " and resid 18 and name HB1 ))
( segid " " and resid 18 and name HD2%)
2.300 0.600 0.600 peak 934 spectrum 1 weight 0.11000E+01 volume 0.48619E-02 ppm1 1.488 ppm2 0.502 CV 1
ASSI { 935}
(( segid " " and resid 15 and name HB1 ))
( segid " " and resid 15 and name HD1%)
2.100 0.600 0.600 peak 935 spectrum 1 weight 0.11000E+01 volume 0.70511E-02 ppm1 1.485 ppm2 0.865 CV 1
ASSI { 937}
(( segid " " and resid 15 and name HB1 ))
(( segid " " and resid 29 and name HB2 ))
5.200 3.400 0.800 peak 937 spectrum 1 weight 0.11000E+01 volume 0.70330E-04 ppm1 1.486 ppm2 2.945 CV 1
ASSI { 939}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 21 and name HN ))
3.700 1.700 1.700 peak 939 spectrum 1 weight 0.11000E+01 volume 0.47784E-03 ppm1 4.139 ppm2 7.646 CV 1
ASSI { 940}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 23 and name HD% )
3.700 1.700 1.700 peak 940 spectrum 1 weight 0.11000E+01 volume 0.12127E-02 ppm1 4.138 ppm2 7.240 CV 1
ASSI { 941}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 20 and name HN ))
3.300 1.300 1.300 peak 941 spectrum 1 weight 0.11000E+01 volume 0.15884E-02 ppm1 4.128 ppm2 8.301 CV 1
ASSI { 942}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 44 and name HD1%)
4.400 2.400 1.600 peak 942 spectrum 1 weight 0.11000E+01 volume 0.93287E-03 ppm1 4.138 ppm2 0.797 CV 1
ASSI { 944}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HG ))
2.700 0.900 0.900 peak 944 spectrum 1 weight 0.11000E+01 volume 0.16557E-02 ppm1 4.138 ppm2 1.739 CV 1
ASSI { 946}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 21 and name HB1 ))
4.000 2.000 2.000 peak 946 spectrum 1 weight 0.11000E+01 volume 0.19002E-02 ppm1 4.137 ppm2 2.311 CV 1
ASSI { 947}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 21 and name HB2 ))
2.800 1.000 1.000 peak 947 spectrum 1 weight 0.11000E+01 volume 0.11777E-02 ppm1 4.133 ppm2 2.505 CV 1
ASSI { 948}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 21 and name HG2 ))
4.100 2.100 1.900 peak 948 spectrum 1 weight 0.11000E+01 volume 0.11010E-02 ppm1 4.137 ppm2 2.859 CV 1
ASSI { 949}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 18 and name HD2%)
6.000 6.000 0.000 peak 949 spectrum 1 weight 0.11000E+01 volume 0.19136E-04 ppm1 4.615 ppm2 0.506 CV 1
ASSI { 950}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 18 and name HN ))
6.000 6.000 0.000 peak 950 spectrum 1 weight 0.11000E+01 volume 0.48718E-04 ppm1 3.469 ppm2 8.750 CV 1
ASSI { 951}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 18 and name HN ))
6.000 6.000 0.000 peak 951 spectrum 1 weight 0.11000E+01 volume 0.54106E-04 ppm1 2.736 ppm2 8.750 CV 1
ASSI { 953}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 18 and name HA ))
4.300 2.300 1.700 peak 953 spectrum 1 weight 0.11000E+01 volume 0.21117E-03 ppm1 3.457 ppm2 4.111 CV 1
ASSI { 954}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 18 and name HA ))
5.400 3.600 0.600 peak 954 spectrum 1 weight 0.11000E+01 volume 0.26557E-03 ppm1 2.741 ppm2 4.122 CV 1
ASSI { 958}
(( segid " " and resid 47 and name HB1 ))
( segid " " and resid 23 and name HD% )
3.600 3.600 2.400 peak 958 spectrum 1 weight 0.11000E+01 volume 0.83606E-03 ppm1 1.186 ppm2 7.211 CV 1
ASSI { 959}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 23 and name HZ ))
3.500 1.500 1.500 peak 959 spectrum 1 weight 0.11000E+01 volume 0.10871E-02 ppm1 1.511 ppm2 7.149 CV 1
ASSI { 964}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 46 and name HB2 ))
4.800 2.900 1.200 peak 964 spectrum 1 weight 0.11000E+01 volume 0.50941E-03 ppm1 1.184 ppm2 1.857 CV 1
ASSI { 965}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 47 and name HB2 ))
1.700 0.400 0.500 peak 965 spectrum 1 weight 0.11000E+01 volume 0.13190E-01 ppm1 1.187 ppm2 1.514 CV 1
ASSI { 966}
(( segid " " and resid 47 and name HB1 ))
( segid " " and resid 47 and name HD1%)
3.000 3.000 3.000 peak 966 spectrum 1 weight 0.11000E+01 volume 0.19214E-02 ppm1 1.185 ppm2 0.725 CV 1
ASSI { 970}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 23 and name HZ ))
5.000 3.200 1.000 peak 970 spectrum 1 weight 0.11000E+01 volume 0.26701E-03 ppm1 3.934 ppm2 7.147 CV 1
ASSI { 971}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 44 and name HA ))
6.000 5.100 0.000 peak 971 spectrum 1 weight 0.11000E+01 volume 0.10123E-03 ppm1 3.950 ppm2 2.986 CV 1
ASSI { 972}
(( segid " " and resid 47 and name HG ))
(( segid " " and resid 46 and name HN ))
4.900 3.000 1.100 peak 972 spectrum 1 weight 0.11000E+01 volume 0.35556E-03 ppm1 1.355 ppm2 7.462 CV 1
ASSI { 973}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 23 and name HD% )
5.200 3.300 0.800 peak 973 spectrum 1 weight 0.11000E+01 volume 0.25758E-03 ppm1 1.347 ppm2 7.206 CV 1
ASSI { 976}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 47 and name HD1%)
2.500 0.800 0.800 peak 976 spectrum 1 weight 0.11000E+01 volume 0.37887E-02 ppm1 1.352 ppm2 0.731 CV 1
ASSI { 980}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 29 and name HN ))
4.300 4.300 1.700 peak 980 spectrum 1 weight 0.11000E+01 volume 0.41764E-03 ppm1 4.417 ppm2 8.648 CV 1
ASSI { 981}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 26 and name HH21))
4.700 4.700 1.300 peak 981 spectrum 1 weight 0.11000E+01 volume 0.15935E-03 ppm1 4.415 ppm2 7.008 CV 1
ASSI { 983}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 26 and name HE ))
5.900 4.400 0.100 peak 983 spectrum 1 weight 0.11000E+01 volume 0.46513E-04 ppm1 4.412 ppm2 6.599 CV 1
ASSI { 984}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 23 and name HB2 ))
5.700 4.000 0.300 peak 984 spectrum 1 weight 0.11000E+01 volume 0.10691E-03 ppm1 4.420 ppm2 3.489 CV 1
ASSI { 985}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 19 and name HB2 ))
5.800 4.200 0.200 peak 985 spectrum 1 weight 0.11000E+01 volume 0.43501E-04 ppm1 4.417 ppm2 2.911 CV 1
ASSI { 986}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 19 and name HB1 ))
5.700 4.100 0.300 peak 986 spectrum 1 weight 0.11000E+01 volume 0.14785E-03 ppm1 4.414 ppm2 2.729 CV 1
ASSI { 987}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 26 and name HB2 ))
6.000 6.000 0.000 peak 987 spectrum 1 weight 0.11000E+01 volume 0.24456E-04 ppm1 4.417 ppm2 1.902 CV 1
ASSI { 988}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 24 and name HN ))
3.800 1.800 1.800 peak 988 spectrum 1 weight 0.11000E+01 volume 0.12004E-02 ppm1 2.201 ppm2 7.760 CV 1
ASSI { 990}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 24 and name HG12))
2.600 0.800 0.800 peak 990 spectrum 1 weight 0.11000E+01 volume 0.44197E-02 ppm1 2.203 ppm2 1.153 CV 1
ASSI { 991}
(( segid " " and resid 24 and name HB ))
( segid " " and resid 24 and name HG2%)
2.200 0.600 0.600 peak 991 spectrum 1 weight 0.11000E+01 volume 0.11021E-01 ppm1 2.204 ppm2 0.801 CV 1
ASSI { 995}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 25 and name HN ))
6.000 6.000 0.000 peak 995 spectrum 1 weight 0.11000E+01 volume 0.90721E-04 ppm1 1.092 ppm2 9.065 CV 1
ASSI { 996}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 24 and name HA ))
4.800 4.800 1.200 peak 996 spectrum 1 weight 0.11000E+01 volume 0.20266E-03 ppm1 1.174 ppm2 4.401 CV 1
ASSI { 998}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 24 and name HB ))
3.700 1.800 1.800 peak 998 spectrum 1 weight 0.11000E+01 volume 0.36492E-03 ppm1 1.095 ppm2 2.207 CV 1
ASSI { 1001}
(( segid " " and resid 25 and name HB1 ))
( segid " " and resid 47 and name HD1%)
5.600 3.900 0.400 peak 1001 spectrum 1 weight 0.11000E+01 volume 0.11039E-03 ppm1 2.599 ppm2 0.750 CV 1
ASSI { 1002}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 47 and name HD1%)
6.000 4.900 0.000 peak 1002 spectrum 1 weight 0.11000E+01 volume 0.59517E-04 ppm1 3.336 ppm2 0.760 CV 1
ASSI { 1003}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 28 and name HA ))
6.000 6.000 0.000 peak 1003 spectrum 1 weight 0.11000E+01 volume 0.21003E-04 ppm1 2.583 ppm2 3.973 CV 1
ASSI { 1004}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 28 and name HA ))
6.000 6.000 0.000 peak 1004 spectrum 1 weight 0.11000E+01 volume 0.84855E-04 ppm1 3.332 ppm2 3.971 CV 1
ASSI { 1005}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HD21))
3.900 1.900 1.900 peak 1005 spectrum 1 weight 0.11000E+01 volume 0.30989E-03 ppm1 4.787 ppm2 7.773 CV 1
ASSI { 1006}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HD22))
4.500 2.600 1.500 peak 1006 spectrum 1 weight 0.11000E+01 volume 0.45990E-03 ppm1 4.787 ppm2 7.041 CV 1
ASSI { 1008}
(( segid " " and resid 22 and name HA1 ))
( segid " " and resid 23 and name HD% )
5.400 5.400 0.600 peak 1008 spectrum 1 weight 0.11000E+01 volume 0.72324E-04 ppm1 3.440 ppm2 7.206 CV 1
ASSI { 1009}
(( segid " " and resid 22 and name HA1 ))
(( segid " " and resid 21 and name HA ))
4.500 2.500 1.500 peak 1009 spectrum 1 weight 0.11000E+01 volume 0.28736E-03 ppm1 3.445 ppm2 4.361 CV 1
ASSI { 1011}
(( segid " " and resid 22 and name HA2 ))
(( segid " " and resid 21 and name HA ))
4.700 2.800 1.300 peak 1011 spectrum 1 weight 0.11000E+01 volume 0.33532E-03 ppm1 4.081 ppm2 4.364 CV 1
ASSI { 1012}
(( segid " " and resid 22 and name HA2 ))
(( segid " " and resid 22 and name HA1 ))
2.100 0.500 0.500 peak 1012 spectrum 1 weight 0.11000E+01 volume 0.85058E-02 ppm1 4.069 ppm2 3.448 CV 1
ASSI { 1013}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 29 and name HN ))
3.700 1.700 1.700 peak 1013 spectrum 1 weight 0.11000E+01 volume 0.65614E-03 ppm1 3.771 ppm2 8.615 CV 1
ASSI { 1014}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 29 and name HD21))
3.200 1.300 1.300 peak 1014 spectrum 1 weight 0.11000E+01 volume 0.10606E-02 ppm1 3.771 ppm2 7.379 CV 1
ASSI { 1015}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HH11))
5.800 4.200 0.200 peak 1015 spectrum 1 weight 0.11000E+01 volume 0.12435E-03 ppm1 3.766 ppm2 7.587 CV 1
ASSI { 1016}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 29 and name HD22))
3.900 1.900 1.900 peak 1016 spectrum 1 weight 0.11000E+01 volume 0.57118E-03 ppm1 3.772 ppm2 6.613 CV 1
ASSI { 1017}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HD1 ))
2.900 1.100 1.100 peak 1017 spectrum 1 weight 0.11000E+01 volume 0.83574E-03 ppm1 3.772 ppm2 3.171 CV 1
ASSI { 1018}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 29 and name HB1 ))
3.700 1.700 1.700 peak 1018 spectrum 1 weight 0.11000E+01 volume 0.16972E-02 ppm1 3.773 ppm2 2.271 CV 1
ASSI { 1019}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 27 and name HB2 ))
4.700 2.800 1.300 peak 1019 spectrum 1 weight 0.11000E+01 volume 0.32846E-03 ppm1 3.773 ppm2 2.088 CV 1
ASSI { 1020}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 28 and name HB% )
6.000 6.000 0.000 peak 1020 spectrum 1 weight 0.11000E+01 volume 0.72720E-04 ppm1 3.771 ppm2 1.304 CV 1
ASSI { 1021}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 15 and name HD2%)
3.800 1.800 1.800 peak 1021 spectrum 1 weight 0.11000E+01 volume 0.15677E-02 ppm1 3.772 ppm2 0.809 CV 1
ASSI { 1022}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 18 and name HD1%)
5.700 5.700 0.300 peak 1022 spectrum 1 weight 0.11000E+01 volume 0.32386E-03 ppm1 3.770 ppm2 0.489 CV 1
ASSI { 1023}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB1 ))
2.400 0.700 0.700 peak 1023 spectrum 1 weight 0.11000E+01 volume 0.48637E-02 ppm1 3.771 ppm2 1.722 CV 1
ASSI { 1024}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HN ))
2.600 0.800 0.800 peak 1024 spectrum 1 weight 0.11000E+01 volume 0.29404E-02 ppm1 1.849 ppm2 8.328 CV 1
ASSI { 1025}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 27 and name HN ))
3.000 1.100 1.100 peak 1025 spectrum 1 weight 0.11000E+01 volume 0.26279E-02 ppm1 1.732 ppm2 8.313 CV 1
ASSI { 1026}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 46 and name HN ))
3.800 1.800 1.800 peak 1026 spectrum 1 weight 0.11000E+01 volume 0.20139E-02 ppm1 1.848 ppm2 7.458 CV 1
ASSI { 1027}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 29 and name HD21))
4.400 2.400 1.600 peak 1027 spectrum 1 weight 0.11000E+01 volume 0.70272E-03 ppm1 1.740 ppm2 7.416 CV 1
ASSI { 1030}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HD2 ))
3.700 1.700 1.700 peak 1030 spectrum 1 weight 0.11000E+01 volume 0.27158E-02 ppm1 1.848 ppm2 3.169 CV 1
ASSI { 1031}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 26 and name HD1 ))
2.400 0.700 0.700 peak 1031 spectrum 1 weight 0.11000E+01 volume 0.27984E-02 ppm1 1.724 ppm2 3.173 CV 1
ASSI { 1032}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HG2 ))
3.700 1.700 1.700 peak 1032 spectrum 1 weight 0.11000E+01 volume 0.12393E-02 ppm1 1.879 ppm2 2.269 CV 1
ASSI { 1033}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 27 and name HG2 ))
5.500 3.800 0.500 peak 1033 spectrum 1 weight 0.11000E+01 volume 0.11915E-03 ppm1 1.745 ppm2 2.272 CV 1
ASSI { 1034}
(( segid " " and resid 26 and name HB1 ))
( segid " " and resid 15 and name HD1%)
3.500 1.500 1.500 peak 1034 spectrum 1 weight 0.11000E+01 volume 0.12657E-02 ppm1 1.744 ppm2 0.879 CV 1
ASSI { 1035}
(( segid " " and resid 34 and name HG12))
( segid " " and resid 34 and name HD1%)
2.300 0.600 0.600 peak 1035 spectrum 1 weight 0.11000E+01 volume 0.65010E-02 ppm1 1.869 ppm2 0.856 CV 1
ASSI { 1036}
(( segid " " and resid 26 and name HG2 ))
(( segid " " and resid 26 and name HN ))
3.500 1.500 1.500 peak 1036 spectrum 1 weight 0.11000E+01 volume 0.51725E-03 ppm1 1.708 ppm2 8.415 CV 1
ASSI { 1037}
(( segid " " and resid 26 and name HG1 ))
(( segid " " and resid 26 and name HN ))
4.400 2.400 1.600 peak 1037 spectrum 1 weight 0.11000E+01 volume 0.87114E-03 ppm1 1.552 ppm2 8.424 CV 1
ASSI { 1039}
(( segid " " and resid 26 and name HG1 ))
(( segid " " and resid 27 and name HN ))
4.500 2.500 1.500 peak 1039 spectrum 1 weight 0.11000E+01 volume 0.98887E-03 ppm1 1.558 ppm2 8.326 CV 1
ASSI { 1041}
(( segid " " and resid 26 and name HG2 ))
(( segid " " and resid 26 and name HA ))
3.200 1.300 1.300 peak 1041 spectrum 1 weight 0.11000E+01 volume 0.97048E-03 ppm1 1.701 ppm2 3.772 CV 1
ASSI { 1042}
(( segid " " and resid 26 and name HG1 ))
(( segid " " and resid 26 and name HD1 ))
2.700 0.900 0.900 peak 1042 spectrum 1 weight 0.11000E+01 volume 0.34157E-02 ppm1 1.562 ppm2 3.168 CV 1
ASSI { 1046}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 27 and name HN ))
5.000 3.100 1.000 peak 1046 spectrum 1 weight 0.11000E+01 volume 0.67377E-03 ppm1 3.185 ppm2 8.325 CV 1
ASSI { 1047}
(( segid " " and resid 26 and name HD1 ))
(( segid " " and resid 27 and name HN ))
4.200 2.200 1.800 peak 1047 spectrum 1 weight 0.11000E+01 volume 0.76846E-03 ppm1 3.153 ppm2 8.320 CV 1
ASSI { 1048}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 29 and name HB1 ))
6.000 4.600 0.000 peak 1048 spectrum 1 weight 0.11000E+01 volume 0.20567E-03 ppm1 3.196 ppm2 2.257 CV 1
ASSI { 1049}
(( segid " " and resid 26 and name HD1 ))
(( segid " " and resid 29 and name HB1 ))
4.800 2.900 1.200 peak 1049 spectrum 1 weight 0.11000E+01 volume 0.35733E-03 ppm1 3.159 ppm2 2.251 CV 1
ASSI { 1050}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 26 and name HG2 ))
2.300 0.700 0.700 peak 1050 spectrum 1 weight 0.11000E+01 volume 0.10678E-01 ppm1 3.183 ppm2 1.723 CV 1
ASSI { 1051}
(( segid " " and resid 26 and name HD1 ))
( segid " " and resid 15 and name HD1%)
2.300 0.700 0.700 peak 1051 spectrum 1 weight 0.11000E+01 volume 0.22857E-02 ppm1 3.186 ppm2 0.866 CV 1
ASSI { 1053}
(( segid " " and resid 38 and name HA2 ))
(( segid " " and resid 38 and name HN ))
2.600 0.900 0.900 peak 1053 spectrum 1 weight 0.11000E+01 volume 0.22059E-02 ppm1 3.974 ppm2 8.828 CV 1
ASSI { 1054}
(( segid " " and resid 49 and name HA2 ))
(( segid " " and resid 50 and name HN ))
2.700 0.900 0.900 peak 1054 spectrum 1 weight 0.11000E+01 volume 0.57488E-02 ppm1 3.992 ppm2 7.997 CV 1
ASSI { 1056}
(( segid " " and resid 38 and name HA2 ))
(( segid " " and resid 39 and name HN ))
3.000 1.100 1.100 peak 1056 spectrum 1 weight 0.11000E+01 volume 0.28411E-02 ppm1 3.973 ppm2 6.870 CV 1
ASSI { 1057}
(( segid " " and resid 38 and name HA2 ))
(( segid " " and resid 33 and name HB1 ))
3.700 1.700 1.700 peak 1057 spectrum 1 weight 0.11000E+01 volume 0.57601E-03 ppm1 3.964 ppm2 0.045 CV 1
ASSI { 1058}
(( segid " " and resid 49 and name HA1 ))
( segid " " and resid 52 and name HD2%)
4.000 4.000 2.000 peak 1058 spectrum 1 weight 0.11000E+01 volume 0.82848E-03 ppm1 3.962 ppm2 0.870 CV 1
ASSI { 1059}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 41 and name HN ))
3.600 1.600 1.600 peak 1059 spectrum 1 weight 0.11000E+01 volume 0.10370E-02 ppm1 4.524 ppm2 7.932 CV 1
ASSI { 1061}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HA ))
4.500 2.500 1.500 peak 1061 spectrum 1 weight 0.11000E+01 volume 0.55369E-03 ppm1 4.521 ppm2 3.533 CV 1
ASSI { 1062}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 36 and name HG1 ))
4.800 2.900 1.200 peak 1062 spectrum 1 weight 0.11000E+01 volume 0.34798E-03 ppm1 4.520 ppm2 3.828 CV 1
ASSI { 1063}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 38 and name HA2 ))
4.800 2.900 1.200 peak 1063 spectrum 1 weight 0.11000E+01 volume 0.18316E-03 ppm1 4.522 ppm2 3.985 CV 1
ASSI { 1064}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 42 and name HN ))
5.200 3.400 0.800 peak 1064 spectrum 1 weight 0.11000E+01 volume 0.25433E-03 ppm1 2.820 ppm2 8.074 CV 1
ASSI { 1065}
(( segid " " and resid 39 and name HB1 ))
(( segid " " and resid 42 and name HN ))
4.000 2.000 2.000 peak 1065 spectrum 1 weight 0.11000E+01 volume 0.27160E-03 ppm1 2.595 ppm2 8.077 CV 1
ASSI { 1066}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 38 and name HN ))
5.100 3.300 0.900 peak 1066 spectrum 1 weight 0.11000E+01 volume 0.45908E-03 ppm1 2.815 ppm2 8.842 CV 1
ASSI { 1072}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 36 and name HG1 ))
5.400 3.700 0.600 peak 1072 spectrum 1 weight 0.11000E+01 volume 0.36762E-03 ppm1 2.808 ppm2 3.821 CV 1
ASSI { 1073}
(( segid " " and resid 39 and name HB1 ))
(( segid " " and resid 36 and name HG1 ))
4.800 2.900 1.200 peak 1073 spectrum 1 weight 0.11000E+01 volume 0.25511E-03 ppm1 2.599 ppm2 3.823 CV 1
ASSI { 1075}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HB1 ))
1.900 0.400 0.400 peak 1075 spectrum 1 weight 0.11000E+01 volume 0.77874E-02 ppm1 2.805 ppm2 2.591 CV 1
ASSI { 1077}
(( segid " " and resid 39 and name HB1 ))
( segid " " and resid 42 and name HB% )
2.800 2.800 3.200 peak 1077 spectrum 1 weight 0.11000E+01 volume 0.20820E-02 ppm1 2.589 ppm2 1.359 CV 1
ASSI { 1078}
(( segid " " and resid 39 and name HB2 ))
( segid " " and resid 36 and name HG2%)
5.700 4.100 0.300 peak 1078 spectrum 1 weight 0.11000E+01 volume 0.51437E-03 ppm1 2.811 ppm2 0.946 CV 1
ASSI { 1080}
(( segid " " and resid 11 and name HA ))
( segid " " and resid 11 and name HD% )
3.300 3.300 2.700 peak 1080 spectrum 1 weight 0.11000E+01 volume 0.50129E-03 ppm1 5.390 ppm2 7.022 CV 1
ASSI { 1082}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 39 and name HN ))
4.800 2.900 1.200 peak 1082 spectrum 1 weight 0.11000E+01 volume 0.10535E-03 ppm1 3.528 ppm2 6.847 CV 1
ASSI { 1083}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 17 and name HE21))
6.000 6.000 0.000 peak 1083 spectrum 1 weight 0.11000E+01 volume 0.26721E-04 ppm1 3.523 ppm2 7.242 CV 1
ASSI { 1084}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HN ))
3.400 1.400 1.400 peak 1084 spectrum 1 weight 0.11000E+01 volume 0.80300E-03 ppm1 3.527 ppm2 7.933 CV 1
ASSI { 1085}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 14 and name HG2 ))
5.600 3.900 0.400 peak 1085 spectrum 1 weight 0.11000E+01 volume 0.10038E-03 ppm1 3.532 ppm2 2.651 CV 1
ASSI { 1086}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 14 and name HG1 ))
6.000 6.000 0.000 peak 1086 spectrum 1 weight 0.11000E+01 volume 0.64671E-04 ppm1 3.532 ppm2 2.499 CV 1
ASSI { 1090}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 39 and name HN ))
5.100 3.200 0.900 peak 1090 spectrum 1 weight 0.11000E+01 volume 0.21765E-03 ppm1 1.666 ppm2 6.864 CV 1
ASSI { 1091}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 14 and name HE22))
5.400 3.600 0.600 peak 1091 spectrum 1 weight 0.11000E+01 volume 0.29228E-03 ppm1 1.666 ppm2 7.353 CV 1
ASSI { 1093}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 14 and name HA ))
5.000 3.200 1.000 peak 1093 spectrum 1 weight 0.11000E+01 volume 0.48596E-03 ppm1 1.673 ppm2 3.982 CV 1
ASSI { 1094}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 14 and name HG2 ))
2.500 0.800 0.800 peak 1094 spectrum 1 weight 0.11000E+01 volume 0.12768E-02 ppm1 1.675 ppm2 2.661 CV 1
ASSI { 1095}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 14 and name HG1 ))
3.300 1.300 1.300 peak 1095 spectrum 1 weight 0.11000E+01 volume 0.14862E-02 ppm1 1.672 ppm2 2.507 CV 1
ASSI { 1096}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 14 and name HB2 ))
4.800 2.900 1.200 peak 1096 spectrum 1 weight 0.11000E+01 volume 0.59955E-03 ppm1 1.673 ppm2 2.090 CV 1
ASSI { 1097}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 40 and name HG12))
2.900 1.100 1.100 peak 1097 spectrum 1 weight 0.11000E+01 volume 0.20035E-02 ppm1 1.672 ppm2 1.322 CV 1
ASSI { 1098}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 40 and name HG11))
2.400 0.700 0.700 peak 1098 spectrum 1 weight 0.11000E+01 volume 0.20784E-02 ppm1 1.671 ppm2 1.151 CV 1
ASSI { 1099}
(( segid " " and resid 40 and name HB ))
( segid " " and resid 18 and name HD1%)
4.700 4.700 1.300 peak 1099 spectrum 1 weight 0.11000E+01 volume 0.59720E-03 ppm1 1.672 ppm2 0.499 CV 1
ASSI { 1100}
(( segid " " and resid 40 and name HB ))
( segid " " and resid 33 and name HD1%)
3.800 1.800 1.800 peak 1100 spectrum 1 weight 0.11000E+01 volume 0.16141E-02 ppm1 1.671 ppm2 0.213 CV 1
ASSI { 1101}
(( segid " " and resid 40 and name HG12))
(( segid " " and resid 40 and name HN ))
4.800 2.900 1.200 peak 1101 spectrum 1 weight 0.11000E+01 volume 0.42079E-03 ppm1 1.314 ppm2 8.949 CV 1
ASSI { 1104}
(( segid " " and resid 40 and name HG11))
(( segid " " and resid 18 and name HN ))
4.400 2.400 1.600 peak 1104 spectrum 1 weight 0.11000E+01 volume 0.39154E-03 ppm1 1.159 ppm2 8.827 CV 1
ASSI { 1105}
(( segid " " and resid 40 and name HG12))
(( segid " " and resid 44 and name HN ))
4.300 2.300 1.700 peak 1105 spectrum 1 weight 0.11000E+01 volume 0.28578E-03 ppm1 1.309 ppm2 8.272 CV 1
ASSI { 1106}
(( segid " " and resid 40 and name HG11))
(( segid " " and resid 44 and name HN ))
5.500 3.700 0.500 peak 1106 spectrum 1 weight 0.11000E+01 volume 0.23084E-03 ppm1 1.166 ppm2 8.274 CV 1
ASSI { 1107}
(( segid " " and resid 40 and name HG11))
(( segid " " and resid 41 and name HN ))
5.200 3.300 0.800 peak 1107 spectrum 1 weight 0.11000E+01 volume 0.31984E-03 ppm1 1.161 ppm2 7.931 CV 1
ASSI { 1108}
(( segid " " and resid 40 and name HG12))
(( segid " " and resid 41 and name HN ))
4.600 2.600 1.400 peak 1108 spectrum 1 weight 0.11000E+01 volume 0.41235E-03 ppm1 1.317 ppm2 7.929 CV 1
ASSI { 1109}
(( segid " " and resid 40 and name HG12))
(( segid " " and resid 14 and name HA ))
5.100 3.200 0.900 peak 1109 spectrum 1 weight 0.11000E+01 volume 0.45994E-03 ppm1 1.308 ppm2 3.986 CV 1
ASSI { 1110}
(( segid " " and resid 40 and name HG11))
(( segid " " and resid 14 and name HA ))
4.700 2.800 1.300 peak 1110 spectrum 1 weight 0.11000E+01 volume 0.15970E-03 ppm1 1.163 ppm2 3.994 CV 1
ASSI { 1111}
(( segid " " and resid 40 and name HG11))
(( segid " " and resid 40 and name HA ))
3.400 1.400 1.400 peak 1111 spectrum 1 weight 0.11000E+01 volume 0.12837E-02 ppm1 1.164 ppm2 3.531 CV 1
ASSI { 1112}
(( segid " " and resid 40 and name HG11))
(( segid " " and resid 14 and name HG2 ))
3.800 1.800 1.800 peak 1112 spectrum 1 weight 0.11000E+01 volume 0.16427E-03 ppm1 1.165 ppm2 2.666 CV 1
ASSI { 1113}
(( segid " " and resid 40 and name HG11))
(( segid " " and resid 14 and name HG1 ))
4.000 2.000 2.000 peak 1113 spectrum 1 weight 0.11000E+01 volume 0.30162E-03 ppm1 1.162 ppm2 2.499 CV 1
ASSI { 1114}
(( segid " " and resid 40 and name HG12))
(( segid " " and resid 14 and name HG1 ))
5.200 3.400 0.800 peak 1114 spectrum 1 weight 0.11000E+01 volume 0.39489E-03 ppm1 1.305 ppm2 2.497 CV 1
ASSI { 1115}
(( segid " " and resid 40 and name HG12))
(( segid " " and resid 14 and name HG2 ))
4.200 2.200 1.800 peak 1115 spectrum 1 weight 0.11000E+01 volume 0.63098E-03 ppm1 1.305 ppm2 2.652 CV 1
ASSI { 1116}
(( segid " " and resid 40 and name HG11))
(( segid " " and resid 14 and name HB2 ))
4.500 2.500 1.500 peak 1116 spectrum 1 weight 0.11000E+01 volume 0.52000E-03 ppm1 1.154 ppm2 2.099 CV 1
ASSI { 1117}
(( segid " " and resid 40 and name HG12))
(( segid " " and resid 14 and name HB2 ))
5.300 3.500 0.700 peak 1117 spectrum 1 weight 0.11000E+01 volume 0.58900E-03 ppm1 1.305 ppm2 2.110 CV 1
ASSI { 1120}
(( segid " " and resid 40 and name HG12))
( segid " " and resid 40 and name HD1%)
2.100 0.600 0.600 peak 1120 spectrum 1 weight 0.11000E+01 volume 0.65312E-02 ppm1 1.318 ppm2 0.803 CV 1
ASSI { 1121}
(( segid " " and resid 40 and name HG11))
( segid " " and resid 40 and name HD1%)
2.000 0.500 0.500 peak 1121 spectrum 1 weight 0.11000E+01 volume 0.78352E-02 ppm1 1.172 ppm2 0.800 CV 1
ASSI { 1123}
(( segid " " and resid 40 and name HG12))
(( segid " " and resid 40 and name HG11))
1.600 0.300 0.600 peak 1123 spectrum 1 weight 0.11000E+01 volume 0.11959E-01 ppm1 1.317 ppm2 1.163 CV 1
ASSI { 1124}
(( segid " " and resid 40 and name HG11))
( segid " " and resid 18 and name HD1%)
3.500 1.500 1.500 peak 1124 spectrum 1 weight 0.11000E+01 volume 0.14388E-02 ppm1 1.163 ppm2 0.499 CV 1
ASSI { 1125}
(( segid " " and resid 40 and name HG11))
( segid " " and resid 33 and name HD1%)
3.300 1.400 1.400 peak 1125 spectrum 1 weight 0.11000E+01 volume 0.83822E-03 ppm1 1.158 ppm2 0.219 CV 1
ASSI { 1126}
(( segid " " and resid 40 and name HG12))
( segid " " and resid 33 and name HD1%)
3.200 1.300 1.300 peak 1126 spectrum 1 weight 0.11000E+01 volume 0.76576E-03 ppm1 1.312 ppm2 0.215 CV 1
ASSI { 1127}
(( segid " " and resid 40 and name HG12))
( segid " " and resid 18 and name HD1%)
3.000 3.000 3.000 peak 1127 spectrum 1 weight 0.11000E+01 volume 0.14147E-02 ppm1 1.311 ppm2 0.493 CV 1
ASSI { 1130}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 15 and name HN ))
6.000 5.800 0.000 peak 1130 spectrum 1 weight 0.11000E+01 volume 0.50210E-04 ppm1 2.655 ppm2 8.759 CV 1
ASSI { 1132}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 14 and name HB2 ))
3.300 1.300 1.300 peak 1132 spectrum 1 weight 0.11000E+01 volume 0.70385E-03 ppm1 2.669 ppm2 2.087 CV 1
ASSI { 1133}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 14 and name HB1 ))
2.600 0.800 0.800 peak 1133 spectrum 1 weight 0.11000E+01 volume 0.13975E-02 ppm1 2.658 ppm2 1.639 CV 1
ASSI { 1135}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 40 and name HD1%)
4.000 2.000 2.000 peak 1135 spectrum 1 weight 0.11000E+01 volume 0.73618E-03 ppm1 2.656 ppm2 0.809 CV 1
ASSI { 1136}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 33 and name HD2%)
5.000 3.100 1.000 peak 1136 spectrum 1 weight 0.11000E+01 volume 0.40867E-04 ppm1 2.666 ppm2 0.519 CV 1
ASSI { 1137}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 33 and name HD1%)
4.300 2.300 1.700 peak 1137 spectrum 1 weight 0.11000E+01 volume 0.62029E-03 ppm1 2.656 ppm2 0.202 CV 1
ASSI { 1138}
(( segid " " and resid 14 and name HG1 ))
( segid " " and resid 33 and name HD1%)
4.400 2.500 1.600 peak 1138 spectrum 1 weight 0.11000E+01 volume 0.99108E-03 ppm1 2.505 ppm2 0.209 CV 1
ASSI { 1140}
(( segid " " and resid 14 and name HG1 ))
( segid " " and resid 40 and name HD1%)
3.100 1.200 1.200 peak 1140 spectrum 1 weight 0.11000E+01 volume 0.29995E-02 ppm1 2.484 ppm2 0.807 CV 1
ASSI { 1142}
(( segid " " and resid 14 and name HG1 ))
(( segid " " and resid 14 and name HB1 ))
2.800 1.000 1.000 peak 1142 spectrum 1 weight 0.11000E+01 volume 0.19886E-02 ppm1 2.499 ppm2 1.637 CV 1
ASSI { 1145}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 15 and name HN ))
4.400 2.500 1.600 peak 1145 spectrum 1 weight 0.11000E+01 volume 0.19212E-03 ppm1 1.606 ppm2 8.745 CV 1
ASSI { 1152}
(( segid " " and resid 14 and name HB1 ))
( segid " " and resid 33 and name HD2%)
3.300 1.400 1.400 peak 1152 spectrum 1 weight 0.11000E+01 volume 0.41877E-03 ppm1 1.616 ppm2 0.521 CV 1
ASSI { 1153}
(( segid " " and resid 14 and name HB1 ))
( segid " " and resid 33 and name HD1%)
3.000 1.100 1.100 peak 1153 spectrum 1 weight 0.11000E+01 volume 0.76368E-03 ppm1 1.617 ppm2 0.205 CV 1
ASSI { 1154}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HB1 ))
2.000 0.500 0.500 peak 1154 spectrum 1 weight 0.11000E+01 volume 0.25492E-02 ppm1 2.082 ppm2 1.623 CV 1
ASSI { 1157}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 17 and name HE21))
3.600 1.700 1.700 peak 1157 spectrum 1 weight 0.11000E+01 volume 0.15610E-03 ppm1 3.975 ppm2 7.339 CV 1
ASSI { 1158}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 16 and name HN ))
5.700 4.100 0.300 peak 1158 spectrum 1 weight 0.11000E+01 volume 0.50747E-04 ppm1 3.975 ppm2 7.846 CV 1
ASSI { 1159}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 15 and name HN ))
3.400 1.500 1.500 peak 1159 spectrum 1 weight 0.11000E+01 volume 0.62728E-03 ppm1 3.974 ppm2 8.749 CV 1
ASSI { 1160}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 13 and name HN ))
6.000 6.000 0.000 peak 1160 spectrum 1 weight 0.11000E+01 volume 0.23703E-04 ppm1 3.975 ppm2 9.035 CV 1
ASSI { 1162}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HG2 ))
3.600 1.700 1.700 peak 1162 spectrum 1 weight 0.11000E+01 volume 0.13253E-02 ppm1 3.959 ppm2 2.677 CV 1
ASSI { 1163}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB2 ))
3.100 1.200 1.200 peak 1163 spectrum 1 weight 0.11000E+01 volume 0.12417E-02 ppm1 3.967 ppm2 2.144 CV 1
ASSI { 1164}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB1 ))
3.000 1.100 1.100 peak 1164 spectrum 1 weight 0.11000E+01 volume 0.90482E-03 ppm1 3.967 ppm2 1.638 CV 1
ASSI { 1166}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 33 and name HD2%)
4.800 2.900 1.200 peak 1166 spectrum 1 weight 0.11000E+01 volume 0.47581E-03 ppm1 3.969 ppm2 0.510 CV 1
ASSI { 1167}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 33 and name HD1%)
5.000 3.100 1.000 peak 1167 spectrum 1 weight 0.11000E+01 volume 0.30131E-03 ppm1 3.970 ppm2 0.210 CV 1
ASSI { 1168}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 40 and name HN ))
6.000 6.000 0.000 peak 1168 spectrum 1 weight 0.11000E+01 volume 0.14065E-03 ppm1 0.802 ppm2 8.973 CV 1
ASSI { 1170}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 41 and name HA ))
3.500 1.500 1.500 peak 1170 spectrum 1 weight 0.11000E+01 volume 0.93706E-03 ppm1 0.833 ppm2 4.315 CV 1
ASSI { 1172}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 39 and name HB2 ))
5.000 5.000 1.000 peak 1172 spectrum 1 weight 0.11000E+01 volume 0.43882E-03 ppm1 0.834 ppm2 2.830 CV 1
ASSI { 1173}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 14 and name HG2 ))
4.400 2.400 1.600 peak 1173 spectrum 1 weight 0.11000E+01 volume 0.58011E-03 ppm1 0.833 ppm2 2.660 CV 1
ASSI { 1174}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 14 and name HG1 ))
6.000 4.500 0.000 peak 1174 spectrum 1 weight 0.11000E+01 volume 0.83367E-04 ppm1 0.834 ppm2 2.499 CV 1
ASSI { 1175}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 14 and name HB2 ))
3.000 3.000 3.000 peak 1175 spectrum 1 weight 0.11000E+01 volume 0.55842E-03 ppm1 0.837 ppm2 2.121 CV 1
ASSI { 1176}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 40 and name HB ))
2.100 0.600 0.600 peak 1176 spectrum 1 weight 0.11000E+01 volume 0.76625E-02 ppm1 0.830 ppm2 1.673 CV 1
ASSI { 1177}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 40 and name HG12))
6.000 6.000 0.000 peak 1177 spectrum 1 weight 0.11000E+01 volume 0.40662E-05 ppm1 0.832 ppm2 1.338 CV 1
ASSI { 1178}
( segid " " and resid 40 and name HG2%)
( segid " " and resid 18 and name HD1%)
4.800 4.800 1.200 peak 1178 spectrum 1 weight 0.11000E+01 volume 0.74479E-03 ppm1 0.836 ppm2 0.498 CV 1
ASSI { 1179}
( segid " " and resid 40 and name HG2%)
( segid " " and resid 33 and name HD1%)
4.300 4.300 1.700 peak 1179 spectrum 1 weight 0.11000E+01 volume 0.10186E-02 ppm1 0.831 ppm2 0.216 CV 1
ASSI { 1181}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 42 and name HN ))
3.300 1.400 1.400 peak 1181 spectrum 1 weight 0.11000E+01 volume 0.13546E-02 ppm1 4.316 ppm2 8.102 CV 1
ASSI { 1184}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 40 and name HA ))
4.700 2.700 1.300 peak 1184 spectrum 1 weight 0.11000E+01 volume 0.17744E-03 ppm1 4.315 ppm2 3.533 CV 1
ASSI { 1185}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 40 and name HG12))
5.500 5.500 0.500 peak 1185 spectrum 1 weight 0.11000E+01 volume 0.10278E-03 ppm1 4.316 ppm2 1.354 CV 1
ASSI { 1186}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HG11))
4.100 2.100 1.900 peak 1186 spectrum 1 weight 0.11000E+01 volume 0.27337E-03 ppm1 4.313 ppm2 0.283 CV 1
ASSI { 1187}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB2 ))
2.500 0.800 0.800 peak 1187 spectrum 1 weight 0.11000E+01 volume 0.94297E-02 ppm1 4.315 ppm2 2.826 CV 1
ASSI { 1188}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HN ))
2.500 0.800 0.800 peak 1188 spectrum 1 weight 0.11000E+01 volume 0.54233E-02 ppm1 2.822 ppm2 7.931 CV 1
ASSI { 1189}
(( segid " " and resid 41 and name HB1 ))
(( segid " " and resid 41 and name HN ))
2.900 1.000 1.000 peak 1189 spectrum 1 weight 0.11000E+01 volume 0.60870E-02 ppm1 2.671 ppm2 7.930 CV 1
ASSI { 1195}
(( segid " " and resid 41 and name HB2 ))
( segid " " and resid 42 and name HB% )
4.800 2.800 1.200 peak 1195 spectrum 1 weight 0.11000E+01 volume 0.25856E-03 ppm1 2.827 ppm2 1.362 CV 1
ASSI { 1199}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 47 and name HD1%)
5.500 3.700 0.500 peak 1199 spectrum 1 weight 0.11000E+01 volume 0.13975E-03 ppm1 3.623 ppm2 0.764 CV 1
ASSI { 1200}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 40 and name HN ))
5.700 4.100 0.300 peak 1200 spectrum 1 weight 0.11000E+01 volume 0.14296E-03 ppm1 1.098 ppm2 8.925 CV 1
ASSI { 1201}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 38 and name HN ))
3.800 3.800 2.200 peak 1201 spectrum 1 weight 0.11000E+01 volume 0.15729E-03 ppm1 1.094 ppm2 8.822 CV 1
ASSI { 1203}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 44 and name HA ))
4.200 2.200 1.800 peak 1203 spectrum 1 weight 0.11000E+01 volume 0.33798E-03 ppm1 1.096 ppm2 2.954 CV 1
ASSI { 1204}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 46 and name HB1 ))
5.400 5.400 0.600 peak 1204 spectrum 1 weight 0.11000E+01 volume 0.50107E-03 ppm1 1.097 ppm2 1.841 CV 1
ASSI { 1205}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 40 and name HB ))
4.100 2.100 1.900 peak 1205 spectrum 1 weight 0.11000E+01 volume 0.13003E-02 ppm1 1.098 ppm2 1.680 CV 1
ASSI { 1206}
( segid " " and resid 43 and name HB% )
(( segid " " and resid 33 and name HB2 ))
4.000 2.000 2.000 peak 1206 spectrum 1 weight 0.11000E+01 volume 0.67233E-03 ppm1 1.097 ppm2 1.540 CV 1
ASSI { 1207}
(( segid " " and resid 24 and name HG11))
( segid " " and resid 24 and name HG2%)
4.600 4.600 1.400 peak 1207 spectrum 1 weight 0.11000E+01 volume 0.15862E-03 ppm1 1.095 ppm2 0.767 CV 1
ASSI { 1211}
( segid " " and resid 43 and name HB% )
( segid " " and resid 32 and name HB% )
2.100 0.600 0.600 peak 1211 spectrum 1 weight 0.11000E+01 volume 0.10303E-01 ppm1 1.098 ppm2 1.330 CV 1
ASSI { 1212}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 36 and name HA ))
5.700 4.000 0.300 peak 1212 spectrum 1 weight 0.11000E+01 volume 0.73325E-04 ppm1 1.433 ppm2 4.514 CV 1
ASSI { 1213}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 33 and name HA ))
4.500 4.500 1.500 peak 1213 spectrum 1 weight 0.11000E+01 volume 0.40113E-03 ppm1 1.433 ppm2 3.592 CV 1
ASSI { 1214}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 32 and name HA ))
2.800 1.000 1.000 peak 1214 spectrum 1 weight 0.11000E+01 volume 0.33111E-02 ppm1 1.433 ppm2 3.962 CV 1
ASSI { 1215}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 46 and name HD1 ))
2.900 1.100 1.100 peak 1215 spectrum 1 weight 0.11000E+01 volume 0.21859E-02 ppm1 1.433 ppm2 3.088 CV 1
ASSI { 1216}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 46 and name HD2 ))
3.200 1.200 1.200 peak 1216 spectrum 1 weight 0.11000E+01 volume 0.13345E-02 ppm1 1.433 ppm2 2.913 CV 1
ASSI { 1218}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 31 and name HE22))
5.500 3.800 0.500 peak 1218 spectrum 1 weight 0.11000E+01 volume 0.19419E-03 ppm1 3.987 ppm2 6.890 CV 1
ASSI { 1219}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 34 and name HN ))
4.400 2.400 1.600 peak 1219 spectrum 1 weight 0.11000E+01 volume 0.23148E-03 ppm1 3.954 ppm2 8.624 CV 1
ASSI { 1222}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HA ))
4.700 2.700 1.300 peak 1222 spectrum 1 weight 0.11000E+01 volume 0.20280E-03 ppm1 4.125 ppm2 3.594 CV 1
ASSI { 1223}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 46 and name HD1 ))
6.000 5.700 0.000 peak 1223 spectrum 1 weight 0.11000E+01 volume 0.89120E-04 ppm1 4.125 ppm2 3.083 CV 1
ASSI { 1224}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 41 and name HB1 ))
5.200 5.200 0.800 peak 1224 spectrum 1 weight 0.11000E+01 volume 0.16874E-03 ppm1 4.122 ppm2 2.637 CV 1
ASSI { 1226}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 39 and name HN ))
4.500 4.500 1.500 peak 1226 spectrum 1 weight 0.11000E+01 volume 0.46756E-03 ppm1 4.503 ppm2 6.833 CV 1
ASSI { 1227}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 46 and name HH12))
3.300 3.300 2.700 peak 1227 spectrum 1 weight 0.11000E+01 volume 0.19891E-02 ppm1 4.503 ppm2 7.562 CV 1
ASSI { 1228}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 39 and name HB1 ))
5.100 3.200 0.900 peak 1228 spectrum 1 weight 0.11000E+01 volume 0.44498E-03 ppm1 4.508 ppm2 2.580 CV 1
ASSI { 1229}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 39 and name HB2 ))
4.700 2.800 1.300 peak 1229 spectrum 1 weight 0.11000E+01 volume 0.83033E-03 ppm1 4.505 ppm2 2.818 CV 1
ASSI { 1230}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 33 and name HA ))
4.800 4.800 1.200 peak 1230 spectrum 1 weight 0.11000E+01 volume 0.43561E-03 ppm1 4.507 ppm2 3.592 CV 1
ASSI { 1231}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HG1 ))
3.500 1.500 1.500 peak 1231 spectrum 1 weight 0.11000E+01 volume 0.16880E-02 ppm1 4.508 ppm2 3.828 CV 1
ASSI { 1232}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 35 and name HA ))
3.800 1.800 1.800 peak 1232 spectrum 1 weight 0.11000E+01 volume 0.68617E-03 ppm1 4.517 ppm2 4.170 CV 1
ASSI { 1236}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 46 and name HE ))
6.000 4.500 0.000 peak 1236 spectrum 1 weight 0.11000E+01 volume 0.43745E-04 ppm1 0.941 ppm2 6.398 CV 1
ASSI { 1237}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 42 and name HA ))
4.200 2.200 1.800 peak 1237 spectrum 1 weight 0.11000E+01 volume 0.10389E-02 ppm1 0.946 ppm2 4.130 CV 1
ASSI { 1238}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 32 and name HA ))
3.400 1.500 1.500 peak 1238 spectrum 1 weight 0.11000E+01 volume 0.15942E-02 ppm1 0.945 ppm2 4.011 CV 1
ASSI { 1239}
( segid " " and resid 36 and name HG2%)
( segid " " and resid 33 and name HD1%)
5.600 5.600 0.400 peak 1239 spectrum 1 weight 0.11000E+01 volume 0.16698E-03 ppm1 0.945 ppm2 0.209 CV 1
ASSI { 1242}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 40 and name HN ))
6.000 6.000 0.000 peak 1242 spectrum 1 weight 0.11000E+01 volume 0.62759E-04 ppm1 1.355 ppm2 8.918 CV 1
ASSI { 1244}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 39 and name HB2 ))
3.600 1.700 1.700 peak 1244 spectrum 1 weight 0.11000E+01 volume 0.43859E-02 ppm1 1.358 ppm2 2.821 CV 1
ASSI { 1247}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 41 and name HA ))
6.000 6.000 0.000 peak 1247 spectrum 1 weight 0.11000E+01 volume 0.20649E-04 ppm1 1.359 ppm2 4.321 CV 1
ASSI { 1248}
( segid " " and resid 32 and name HB% )
(( segid " " and resid 46 and name HD1 ))
3.300 1.400 1.400 peak 1248 spectrum 1 weight 0.11000E+01 volume 0.12052E-02 ppm1 1.331 ppm2 3.082 CV 1
ASSI { 1249}
( segid " " and resid 32 and name HB% )
(( segid " " and resid 46 and name HD2 ))
3.000 3.000 3.000 peak 1249 spectrum 1 weight 0.11000E+01 volume 0.29442E-02 ppm1 1.330 ppm2 2.913 CV 1
ASSI { 1250}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 45 and name HG2 ))
5.000 3.100 1.000 peak 1250 spectrum 1 weight 0.11000E+01 volume 0.34024E-03 ppm1 1.358 ppm2 2.364 CV 1
ASSI { 1252}
( segid " " and resid 32 and name HB% )
(( segid " " and resid 46 and name HG2 ))
5.200 5.200 0.800 peak 1252 spectrum 1 weight 0.11000E+01 volume 0.42162E-03 ppm1 1.330 ppm2 1.630 CV 1
ASSI { 1254}
( segid " " and resid 32 and name HB% )
( segid " " and resid 47 and name HD1%)
2.700 2.700 3.300 peak 1254 spectrum 1 weight 0.11000E+01 volume 0.44823E-02 ppm1 1.328 ppm2 0.725 CV 1
ASSI { 1255}
( segid " " and resid 32 and name HB% )
( segid " " and resid 18 and name HD1%)
3.500 3.500 2.500 peak 1255 spectrum 1 weight 0.11000E+01 volume 0.86492E-03 ppm1 1.327 ppm2 0.496 CV 1
ASSI { 1256}
( segid " " and resid 32 and name HB% )
( segid " " and resid 47 and name HD2%)
2.800 2.800 3.200 peak 1256 spectrum 1 weight 0.11000E+01 volume 0.27215E-02 ppm1 1.328 ppm2 0.232 CV 1
ASSI { 1258}
( segid " " and resid 32 and name HB% )
(( segid " " and resid 33 and name HB1 ))
5.700 5.700 0.300 peak 1258 spectrum 1 weight 0.11000E+01 volume 0.21144E-03 ppm1 1.332 ppm2 0.037 CV 1
ASSI { 1259}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 34 and name HB ))
4.400 2.400 1.600 peak 1259 spectrum 1 weight 0.11000E+01 volume 0.44052E-03 ppm1 1.434 ppm2 1.821 CV 1
ASSI { 1260}
( segid " " and resid 35 and name HB% )
( segid " " and resid 36 and name HG2%)
2.600 2.600 3.400 peak 1260 spectrum 1 weight 0.11000E+01 volume 0.47437E-02 ppm1 1.433 ppm2 0.925 CV 1
ASSI { 1261}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 33 and name HN ))
5.300 5.300 0.700 peak 1261 spectrum 1 weight 0.11000E+01 volume 0.20839E-03 ppm1 3.613 ppm2 8.062 CV 1
ASSI { 1262}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 38 and name HN ))
6.000 6.000 0.000 peak 1262 spectrum 1 weight 0.11000E+01 volume 0.48483E-04 ppm1 3.613 ppm2 8.919 CV 1
ASSI { 1264}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HN ))
3.100 1.200 1.200 peak 1264 spectrum 1 weight 0.11000E+01 volume 0.18078E-02 ppm1 2.972 ppm2 7.213 CV 1
ASSI { 1265}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HN ))
2.600 0.900 0.900 peak 1265 spectrum 1 weight 0.11000E+01 volume 0.28297E-02 ppm1 2.972 ppm2 8.262 CV 1
ASSI { 1266}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 41 and name HA ))
6.000 6.000 0.000 peak 1266 spectrum 1 weight 0.11000E+01 volume 0.25135E-04 ppm1 2.973 ppm2 4.306 CV 1
ASSI { 1267}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 45 and name HA ))
4.000 2.000 2.000 peak 1267 spectrum 1 weight 0.11000E+01 volume 0.53186E-03 ppm1 2.971 ppm2 3.915 CV 1
ASSI { 1268}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB ))
3.100 1.200 1.200 peak 1268 spectrum 1 weight 0.11000E+01 volume 0.16015E-02 ppm1 2.971 ppm2 1.730 CV 1
ASSI { 1269}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 47 and name HB2 ))
2.400 0.700 0.700 peak 1269 spectrum 1 weight 0.11000E+01 volume 0.46075E-02 ppm1 2.972 ppm2 1.539 CV 1
ASSI { 1270}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 47 and name HG ))
3.200 1.300 1.300 peak 1270 spectrum 1 weight 0.11000E+01 volume 0.14053E-02 ppm1 2.972 ppm2 1.347 CV 1
ASSI { 1271}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 47 and name HB1 ))
4.200 2.200 1.800 peak 1271 spectrum 1 weight 0.11000E+01 volume 0.15273E-02 ppm1 2.971 ppm2 1.171 CV 1
ASSI { 1273}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 18 and name HD2%)
3.500 1.500 1.500 peak 1273 spectrum 1 weight 0.11000E+01 volume 0.83849E-03 ppm1 2.968 ppm2 0.511 CV 1
ASSI { 1274}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HG11))
2.500 0.800 0.800 peak 1274 spectrum 1 weight 0.11000E+01 volume 0.59558E-02 ppm1 2.973 ppm2 0.260 CV 1
ASSI { 1277}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB ))
2.800 1.000 1.000 peak 1277 spectrum 1 weight 0.11000E+01 volume 0.29197E-02 ppm1 3.613 ppm2 1.768 CV 1
ASSI { 1278}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 35 and name HB% )
5.000 5.000 1.000 peak 1278 spectrum 1 weight 0.11000E+01 volume 0.31422E-03 ppm1 3.615 ppm2 1.451 CV 1
ASSI { 1279}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 33 and name HB1 ))
4.700 2.800 1.300 peak 1279 spectrum 1 weight 0.11000E+01 volume 0.14321E-03 ppm1 3.619 ppm2 0.041 CV 1
ASSI { 1282}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 44 and name HG12))
2.400 0.700 0.700 peak 1282 spectrum 1 weight 0.11000E+01 volume 0.78118E-02 ppm1 1.730 ppm2 1.544 CV 1
ASSI { 1283}
(( segid " " and resid 44 and name HB ))
( segid " " and resid 44 and name HG2%)
2.000 0.500 0.500 peak 1283 spectrum 1 weight 0.11000E+01 volume 0.18130E-01 ppm1 1.726 ppm2 0.802 CV 1
ASSI { 1284}
(( segid " " and resid 34 and name HB ))
(( segid " " and resid 32 and name HN ))
4.400 2.500 1.600 peak 1284 spectrum 1 weight 0.11000E+01 volume 0.46017E-03 ppm1 1.753 ppm2 8.056 CV 1
ASSI { 1285}
(( segid " " and resid 34 and name HB ))
( segid " " and resid 11 and name HD% )
5.100 3.200 0.900 peak 1285 spectrum 1 weight 0.11000E+01 volume 0.42463E-03 ppm1 1.754 ppm2 7.025 CV 1
ASSI { 1289}
(( segid " " and resid 34 and name HB ))
(( segid " " and resid 31 and name HB2 ))
4.000 2.000 2.000 peak 1289 spectrum 1 weight 0.11000E+01 volume 0.10672E-02 ppm1 1.747 ppm2 2.053 CV 1
ASSI { 1292}
(( segid " " and resid 34 and name HG12))
(( segid " " and resid 35 and name HN ))
5.100 3.300 0.900 peak 1292 spectrum 1 weight 0.11000E+01 volume 0.32469E-03 ppm1 1.878 ppm2 7.707 CV 1
ASSI { 1294}
(( segid " " and resid 34 and name HG12))
(( segid " " and resid 32 and name HN ))
5.700 4.100 0.300 peak 1294 spectrum 1 weight 0.11000E+01 volume 0.20600E-03 ppm1 1.884 ppm2 8.059 CV 1
ASSI { 1297}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 9 and name HB ))
4.700 2.700 1.300 peak 1297 spectrum 1 weight 0.11000E+01 volume 0.57754E-03 ppm1 1.049 ppm2 2.053 CV 1
ASSI { 1298}
(( segid " " and resid 34 and name HG11))
(( segid " " and resid 34 and name HG12))
1.900 0.500 0.500 peak 1298 spectrum 1 weight 0.11000E+01 volume 0.37414E-02 ppm1 1.046 ppm2 1.876 CV 1
ASSI { 1301}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 41 and name HA ))
5.500 5.500 0.500 peak 1301 spectrum 1 weight 0.11000E+01 volume 0.21946E-03 ppm1 1.567 ppm2 4.311 CV 1
ASSI { 1303}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 44 and name HA ))
3.300 1.400 1.400 peak 1303 spectrum 1 weight 0.11000E+01 volume 0.92588E-03 ppm1 1.558 ppm2 2.974 CV 1
ASSI { 1305}
(( segid " " and resid 44 and name HG11))
(( segid " " and resid 44 and name HB ))
2.900 2.900 3.100 peak 1305 spectrum 1 weight 0.11000E+01 volume 0.14833E-02 ppm1 0.290 ppm2 1.720 CV 1
ASSI { 1306}
(( segid " " and resid 44 and name HG11))
(( segid " " and resid 44 and name HG12))
2.100 0.500 0.500 peak 1306 spectrum 1 weight 0.11000E+01 volume 0.28560E-02 ppm1 0.286 ppm2 1.556 CV 1
ASSI { 1307}
(( segid " " and resid 44 and name HG11))
(( segid " " and resid 40 and name HG11))
3.500 1.500 1.500 peak 1307 spectrum 1 weight 0.11000E+01 volume 0.24396E-03 ppm1 0.285 ppm2 1.168 CV 1
ASSI { 1308}
(( segid " " and resid 44 and name HG11))
( segid " " and resid 18 and name HD1%)
4.000 2.000 2.000 peak 1308 spectrum 1 weight 0.11000E+01 volume 0.88512E-03 ppm1 0.288 ppm2 0.495 CV 1
ASSI { 1310}
(( segid " " and resid 44 and name HG12))
( segid " " and resid 18 and name HD2%)
2.600 2.600 3.400 peak 1310 spectrum 1 weight 0.11000E+01 volume 0.14571E-02 ppm1 1.549 ppm2 0.498 CV 1
ASSI { 1312}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 40 and name HG11))
3.100 3.100 2.900 peak 1312 spectrum 1 weight 0.11000E+01 volume 0.49223E-03 ppm1 1.550 ppm2 1.163 CV 1
ASSI { 1313}
(( segid " " and resid 44 and name HG12))
(( segid " " and resid 40 and name HA ))
6.000 6.000 0.000 peak 1313 spectrum 1 weight 0.11000E+01 volume 0.62083E-04 ppm1 1.558 ppm2 3.503 CV 1
ASSI { 1316}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 41 and name HA ))
5.000 3.100 1.000 peak 1316 spectrum 1 weight 0.11000E+01 volume 0.80377E-03 ppm1 0.812 ppm2 4.308 CV 1
ASSI { 1318}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 44 and name HA ))
2.800 1.000 1.000 peak 1318 spectrum 1 weight 0.11000E+01 volume 0.22956E-02 ppm1 0.812 ppm2 2.972 CV 1
ASSI { 1319}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 18 and name HB2 ))
2.400 2.400 3.600 peak 1319 spectrum 1 weight 0.11000E+01 volume 0.21027E-02 ppm1 0.813 ppm2 1.901 CV 1
ASSI { 1322}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 18 and name HD1%)
6.000 6.000 0.000 peak 1322 spectrum 1 weight 0.11000E+01 volume 0.32442E-05 ppm1 0.813 ppm2 0.498 CV 1
ASSI { 1323}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 44 and name HG11))
2.600 2.600 3.400 peak 1323 spectrum 1 weight 0.11000E+01 volume 0.28430E-02 ppm1 0.809 ppm2 0.263 CV 1
ASSI { 1325}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 44 and name HA ))
4.200 2.200 1.800 peak 1325 spectrum 1 weight 0.11000E+01 volume 0.10526E-02 ppm1 0.754 ppm2 2.970 CV 1
ASSI { 1326}
( segid " " and resid 44 and name HD1%)
( segid " " and resid 21 and name HE% )
2.200 0.600 0.600 peak 1326 spectrum 1 weight 0.11000E+01 volume 0.11297E-01 ppm1 0.750 ppm2 2.138 CV 1
ASSI { 1327}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 44 and name HB ))
2.100 2.100 3.900 peak 1327 spectrum 1 weight 0.11000E+01 volume 0.14853E-01 ppm1 0.756 ppm2 1.722 CV 1
ASSI { 1328}
( segid " " and resid 44 and name HD1%)
(( segid " " and resid 44 and name HG12))
2.000 0.500 0.500 peak 1328 spectrum 1 weight 0.11000E+01 volume 0.13117E-01 ppm1 0.755 ppm2 1.566 CV 1
ASSI { 1330}
( segid " " and resid 34 and name HG2%)
(( segid " " and resid 31 and name HG2 ))
5.500 5.500 0.500 peak 1330 spectrum 1 weight 0.11000E+01 volume 0.14868E-03 ppm1 0.895 ppm2 2.461 CV 1
ASSI { 1331}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 14 and name HN ))
3.900 1.900 1.900 peak 1331 spectrum 1 weight 0.11000E+01 volume 0.55996E-03 ppm1 4.060 ppm2 9.297 CV 1
ASSI { 1332}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HE22))
4.800 2.900 1.200 peak 1332 spectrum 1 weight 0.11000E+01 volume 0.18621E-03 ppm1 4.061 ppm2 6.910 CV 1
ASSI { 1334}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 47 and name HN ))
3.500 1.500 1.500 peak 1334 spectrum 1 weight 0.11000E+01 volume 0.14074E-02 ppm1 3.874 ppm2 8.372 CV 1
ASSI { 1335}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 42 and name HA ))
4.600 2.600 1.400 peak 1335 spectrum 1 weight 0.11000E+01 volume 0.76977E-03 ppm1 3.880 ppm2 4.195 CV 1
ASSI { 1336}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HG2 ))
2.800 1.000 1.000 peak 1336 spectrum 1 weight 0.11000E+01 volume 0.36539E-02 ppm1 3.882 ppm2 2.362 CV 1
ASSI { 1337}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 48 and name HB2 ))
2.900 1.000 1.000 peak 1337 spectrum 1 weight 0.11000E+01 volume 0.18677E-02 ppm1 3.876 ppm2 1.812 CV 1
ASSI { 1338}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 48 and name HB1 ))
4.400 2.400 1.600 peak 1338 spectrum 1 weight 0.11000E+01 volume 0.44878E-03 ppm1 3.875 ppm2 1.503 CV 1
ASSI { 1339}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 48 and name HD1%)
4.300 4.300 1.700 peak 1339 spectrum 1 weight 0.11000E+01 volume 0.65325E-03 ppm1 3.880 ppm2 0.849 CV 1
ASSI { 1341}
(( segid " " and resid 45 and name HB2 ))
( segid " " and resid 42 and name HB% )
3.900 3.900 2.100 peak 1341 spectrum 1 weight 0.11000E+01 volume 0.10239E-02 ppm1 2.008 ppm2 1.357 CV 1
ASSI { 1343}
(( segid " " and resid 45 and name HG1 ))
(( segid " " and resid 44 and name HN ))
4.500 2.500 1.500 peak 1343 spectrum 1 weight 0.11000E+01 volume 0.49759E-03 ppm1 2.164 ppm2 8.278 CV 1
ASSI { 1344}
(( segid " " and resid 45 and name HG1 ))
(( segid " " and resid 45 and name HA ))
3.000 1.100 1.100 peak 1344 spectrum 1 weight 0.11000E+01 volume 0.41415E-02 ppm1 2.164 ppm2 3.872 CV 1
ASSI { 1345}
(( segid " " and resid 45 and name HG1 ))
(( segid " " and resid 42 and name HA ))
3.300 1.400 1.400 peak 1345 spectrum 1 weight 0.11000E+01 volume 0.11951E-02 ppm1 2.163 ppm2 4.134 CV 1
ASSI { 1347}
(( segid " " and resid 45 and name HG1 ))
( segid " " and resid 42 and name HB% )
5.300 5.300 0.700 peak 1347 spectrum 1 weight 0.11000E+01 volume 0.17746E-03 ppm1 2.161 ppm2 1.361 CV 1
ASSI { 1349}
(( segid " " and resid 45 and name HG2 ))
( segid " " and resid 44 and name HD1%)
3.100 3.100 2.900 peak 1349 spectrum 1 weight 0.11000E+01 volume 0.50296E-03 ppm1 2.359 ppm2 0.813 CV 1
ASSI { 1352}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 46 and name HD1 ))
2.500 0.800 0.800 peak 1352 spectrum 1 weight 0.11000E+01 volume 0.34574E-02 ppm1 1.837 ppm2 3.122 CV 1
ASSI { 1353}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 47 and name HD2%)
5.200 3.400 0.800 peak 1353 spectrum 1 weight 0.11000E+01 volume 0.15569E-03 ppm1 1.847 ppm2 0.253 CV 1
ASSI { 1354}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 32 and name HB% )
2.600 0.900 0.900 peak 1354 spectrum 1 weight 0.11000E+01 volume 0.23048E-02 ppm1 1.846 ppm2 1.340 CV 1
ASSI { 1355}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 46 and name HG1 ))
2.600 0.800 0.800 peak 1355 spectrum 1 weight 0.11000E+01 volume 0.96173E-02 ppm1 1.841 ppm2 1.520 CV 1
ASSI { 1356}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HG2 ))
2.000 2.000 4.000 peak 1356 spectrum 1 weight 0.11000E+01 volume 0.34277E-01 ppm1 1.850 ppm2 1.672 CV 1
ASSI { 1357}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 47 and name HN ))
2.800 1.000 1.000 peak 1357 spectrum 1 weight 0.11000E+01 volume 0.36908E-02 ppm1 4.029 ppm2 8.343 CV 1
ASSI { 1361}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 49 and name HN ))
3.200 1.300 1.300 peak 1361 spectrum 1 weight 0.11000E+01 volume 0.13688E-02 ppm1 4.023 ppm2 7.834 CV 1
ASSI { 1362}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 50 and name HN ))
4.200 2.200 1.800 peak 1362 spectrum 1 weight 0.11000E+01 volume 0.30294E-03 ppm1 4.021 ppm2 8.003 CV 1
ASSI { 1366}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 32 and name HB% )
5.100 5.100 0.900 peak 1366 spectrum 1 weight 0.11000E+01 volume 0.49728E-03 ppm1 4.024 ppm2 1.362 CV 1
ASSI { 1371}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 46 and name HD2 ))
3.100 1.200 1.200 peak 1371 spectrum 1 weight 0.11000E+01 volume 0.19185E-02 ppm1 1.644 ppm2 2.913 CV 1
ASSI { 1374}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 46 and name HH11))
3.100 1.200 1.200 peak 1374 spectrum 1 weight 0.11000E+01 volume 0.11012E-02 ppm1 3.086 ppm2 7.422 CV 1
ASSI { 1375}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 46 and name HH12))
3.700 1.700 1.700 peak 1375 spectrum 1 weight 0.11000E+01 volume 0.32599E-02 ppm1 3.085 ppm2 7.552 CV 1
ASSI { 1376}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HH12))
4.300 2.300 1.700 peak 1376 spectrum 1 weight 0.11000E+01 volume 0.11421E-02 ppm1 2.915 ppm2 7.553 CV 1
ASSI { 1377}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 32 and name HN ))
4.900 3.000 1.100 peak 1377 spectrum 1 weight 0.11000E+01 volume 0.32533E-04 ppm1 2.910 ppm2 8.058 CV 1
ASSI { 1378}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HB2 ))
3.000 1.100 1.100 peak 1378 spectrum 1 weight 0.11000E+01 volume 0.19695E-02 ppm1 2.918 ppm2 1.847 CV 1
ASSI { 1380}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 46 and name HG2 ))
2.300 0.700 0.700 peak 1380 spectrum 1 weight 0.11000E+01 volume 0.70759E-02 ppm1 3.089 ppm2 1.656 CV 1
ASSI { 1382}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HG1 ))
2.300 0.700 0.700 peak 1382 spectrum 1 weight 0.11000E+01 volume 0.47866E-02 ppm1 2.919 ppm2 1.472 CV 1
ASSI { 1383}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 46 and name HG1 ))
2.700 0.900 0.900 peak 1383 spectrum 1 weight 0.11000E+01 volume 0.44157E-02 ppm1 3.084 ppm2 1.477 CV 1
ASSI { 1384}
(( segid " " and resid 46 and name HD1 ))
( segid " " and resid 36 and name HG2%)
3.300 1.400 1.400 peak 1384 spectrum 1 weight 0.11000E+01 volume 0.25695E-02 ppm1 3.089 ppm2 0.946 CV 1
ASSI { 1386}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 51 and name HG2 ))
5.000 3.100 1.000 peak 1386 spectrum 1 weight 0.11000E+01 volume 0.38305E-03 ppm1 4.413 ppm2 2.349 CV 1
ASSI { 1387}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 51 and name HB2 ))
5.000 3.100 1.000 peak 1387 spectrum 1 weight 0.11000E+01 volume 0.53678E-03 ppm1 4.411 ppm2 2.178 CV 1
ASSI { 1388}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 51 and name HB1 ))
4.300 2.400 1.700 peak 1388 spectrum 1 weight 0.11000E+01 volume 0.12000E-02 ppm1 4.412 ppm2 1.973 CV 1
ASSI { 1389}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 52 and name HB1 ))
5.000 3.200 1.000 peak 1389 spectrum 1 weight 0.11000E+01 volume 0.26625E-03 ppm1 4.415 ppm2 1.627 CV 1
ASSI { 1390}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 52 and name HD1%)
3.900 3.900 2.100 peak 1390 spectrum 1 weight 0.11000E+01 volume 0.65321E-03 ppm1 4.415 ppm2 0.888 CV 1
ASSI { 1391}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 52 and name HN ))
3.400 1.400 1.400 peak 1391 spectrum 1 weight 0.11000E+01 volume 0.14548E-02 ppm1 3.884 ppm2 8.293 CV 1
ASSI { 1392}
(( segid " " and resid 50 and name HB1 ))
(( segid " " and resid 51 and name HN ))
4.200 2.200 1.800 peak 1392 spectrum 1 weight 0.11000E+01 volume 0.97043E-03 ppm1 3.833 ppm2 8.293 CV 1
ASSI { 1394}
(( segid " " and resid 50 and name HB1 ))
(( segid " " and resid 50 and name HA ))
2.500 0.800 0.800 peak 1394 spectrum 1 weight 0.11000E+01 volume 0.44364E-02 ppm1 3.839 ppm2 4.412 CV 1
ASSI { 1395}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 52 and name HB1 ))
5.700 4.100 0.300 peak 1395 spectrum 1 weight 0.11000E+01 volume 0.17124E-03 ppm1 3.889 ppm2 1.624 CV 1
ASSI { 1396}
(( segid " " and resid 50 and name HB1 ))
(( segid " " and resid 52 and name HB1 ))
5.700 4.100 0.300 peak 1396 spectrum 1 weight 0.11000E+01 volume 0.10454E-03 ppm1 3.845 ppm2 1.619 CV 1
ASSI { 1397}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HN ))
3.600 1.700 1.700 peak 1397 spectrum 1 weight 0.11000E+01 volume 0.68671E-03 ppm1 3.930 ppm2 9.215 CV 1
ASSI { 1398}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 10 and name HN ))
4.800 2.900 1.200 peak 1398 spectrum 1 weight 0.11000E+01 volume 0.11970E-03 ppm1 3.940 ppm2 8.150 CV 1
ASSI { 1399}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 11 and name HD% )
3.800 1.800 1.800 peak 1399 spectrum 1 weight 0.11000E+01 volume 0.45823E-03 ppm1 3.929 ppm2 7.018 CV 1
ASSI { 1400}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB1 ))
3.000 1.100 1.100 peak 1400 spectrum 1 weight 0.11000E+01 volume 0.14445E-02 ppm1 3.931 ppm2 1.891 CV 1
ASSI { 1401}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 10 and name HB2 ))
4.600 2.700 1.400 peak 1401 spectrum 1 weight 0.11000E+01 volume 0.12315E-03 ppm1 3.919 ppm2 1.327 CV 1
ASSI { 1402}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 10 and name HB1 ))
4.700 2.700 1.300 peak 1402 spectrum 1 weight 0.11000E+01 volume 0.61547E-03 ppm1 3.934 ppm2 1.073 CV 1
ASSI { 1405}
(( segid " " and resid 49 and name HA2 ))
(( segid " " and resid 51 and name HN ))
4.500 2.500 1.500 peak 1405 spectrum 1 weight 0.11000E+01 volume 0.34680E-03 ppm1 4.013 ppm2 8.349 CV 1
ASSI { 1406}
(( segid " " and resid 49 and name HA1 ))
(( segid " " and resid 51 and name HN ))
4.000 2.000 2.000 peak 1406 spectrum 1 weight 0.11000E+01 volume 0.78830E-03 ppm1 3.922 ppm2 8.364 CV 1
ASSI { 1407}
(( segid " " and resid 49 and name HA2 ))
(( segid " " and resid 48 and name HB2 ))
4.400 2.400 1.600 peak 1407 spectrum 1 weight 0.11000E+01 volume 0.58909E-03 ppm1 3.992 ppm2 1.835 CV 1
ASSI { 1408}
(( segid " " and resid 49 and name HA1 ))
(( segid " " and resid 48 and name HB2 ))
4.200 2.200 1.800 peak 1408 spectrum 1 weight 0.11000E+01 volume 0.90726E-03 ppm1 3.912 ppm2 1.841 CV 1
ASSI { 1409}
(( segid " " and resid 49 and name HA1 ))
(( segid " " and resid 48 and name HB1 ))
3.800 1.800 1.800 peak 1409 spectrum 1 weight 0.11000E+01 volume 0.11051E-02 ppm1 3.911 ppm2 1.565 CV 1
ASSI { 1410}
(( segid " " and resid 49 and name HA2 ))
(( segid " " and resid 48 and name HB1 ))
3.600 1.600 1.600 peak 1410 spectrum 1 weight 0.11000E+01 volume 0.10599E-02 ppm1 4.008 ppm2 1.530 CV 1
ASSI { 1411}
(( segid " " and resid 49 and name HA2 ))
( segid " " and resid 48 and name HD1%)
2.800 2.800 3.200 peak 1411 spectrum 1 weight 0.11000E+01 volume 0.88940E-03 ppm1 3.993 ppm2 0.864 CV 1
ASSI { 1412}
(( segid " " and resid 49 and name HA1 ))
( segid " " and resid 48 and name HD1%)
2.500 2.500 3.500 peak 1412 spectrum 1 weight 0.11000E+01 volume 0.16736E-02 ppm1 3.909 ppm2 0.876 CV 1
ASSI { 1413}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 23 and name HZ ))
6.000 4.800 0.000 peak 1413 spectrum 1 weight 0.11000E+01 volume 0.59103E-04 ppm1 1.808 ppm2 7.148 CV 1
ASSI { 1415}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 35 and name HN ))
4.400 2.500 1.600 peak 1415 spectrum 1 weight 0.11000E+01 volume 0.64536E-03 ppm1 1.503 ppm2 7.714 CV 1
ASSI { 1419}
(( segid " " and resid 48 and name HB2 ))
( segid " " and resid 48 and name HD1%)
2.800 1.000 1.000 peak 1419 spectrum 1 weight 0.11000E+01 volume 0.55779E-02 ppm1 1.809 ppm2 0.900 CV 1
ASSI { 1420}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 52 and name HD2%)
2.500 2.500 3.500 peak 1420 spectrum 1 weight 0.11000E+01 volume 0.97900E-02 ppm1 1.625 ppm2 0.867 CV 1
ASSI { 1421}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 48 and name HB2 ))
2.100 0.500 0.500 peak 1421 spectrum 1 weight 0.11000E+01 volume 0.55143E-02 ppm1 1.498 ppm2 1.827 CV 1
ASSI { 1422}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 51 and name HG1 ))
4.000 2.000 2.000 peak 1422 spectrum 1 weight 0.11000E+01 volume 0.48506E-03 ppm1 4.254 ppm2 2.360 CV 1
ASSI { 1423}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 47 and name HA ))
4.200 2.200 1.800 peak 1423 spectrum 1 weight 0.11000E+01 volume 0.38696E-03 ppm1 4.255 ppm2 3.923 CV 1
ASSI { 1424}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HN ))
2.900 1.000 1.000 peak 1424 spectrum 1 weight 0.11000E+01 volume 0.24702E-02 ppm1 4.244 ppm2 8.378 CV 1
ASSI { 1425}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 49 and name HN ))
3.200 1.300 1.300 peak 1425 spectrum 1 weight 0.11000E+01 volume 0.17324E-02 ppm1 4.252 ppm2 7.827 CV 1
ASSI { 1427}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 23 and name HZ ))
3.400 1.500 1.500 peak 1427 spectrum 1 weight 0.11000E+01 volume 0.10134E-02 ppm1 4.256 ppm2 7.142 CV 1
ASSI { 1428}
(( segid " " and resid 48 and name HG ))
(( segid " " and resid 48 and name HN ))
3.500 1.600 1.600 peak 1428 spectrum 1 weight 0.11000E+01 volume 0.20405E-02 ppm1 1.897 ppm2 8.388 CV 1
ASSI { 1429}
(( segid " " and resid 48 and name HG ))
(( segid " " and resid 23 and name HZ ))
3.700 1.700 1.700 peak 1429 spectrum 1 weight 0.11000E+01 volume 0.14270E-02 ppm1 1.897 ppm2 7.141 CV 1
ASSI { 1430}
(( segid " " and resid 48 and name HG ))
(( segid " " and resid 48 and name HA ))
3.900 1.900 1.900 peak 1430 spectrum 1 weight 0.11000E+01 volume 0.67061E-03 ppm1 1.893 ppm2 4.252 CV 1
ASSI { 1431}
(( segid " " and resid 48 and name HG ))
(( segid " " and resid 45 and name HA ))
2.700 2.700 3.300 peak 1431 spectrum 1 weight 0.11000E+01 volume 0.10390E-02 ppm1 1.908 ppm2 3.888 CV 1
ASSI { 1432}
(( segid " " and resid 48 and name HG ))
(( segid " " and resid 48 and name HB1 ))
4.500 2.600 1.500 peak 1432 spectrum 1 weight 0.11000E+01 volume 0.15079E-03 ppm1 1.895 ppm2 1.498 CV 1
ASSI { 1434}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 48 and name HA ))
4.000 2.000 2.000 peak 1434 spectrum 1 weight 0.11000E+01 volume 0.41118E-03 ppm1 0.872 ppm2 4.261 CV 1
ASSI { 1435}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 48 and name HG ))
2.300 0.600 0.600 peak 1435 spectrum 1 weight 0.11000E+01 volume 0.95366E-02 ppm1 0.877 ppm2 1.887 CV 1
ASSI { 1436}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 48 and name HB1 ))
2.700 0.900 0.900 peak 1436 spectrum 1 weight 0.11000E+01 volume 0.42313E-02 ppm1 0.867 ppm2 1.506 CV 1
ASSI { 1438}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 44 and name HG11))
6.000 6.000 0.000 peak 1438 spectrum 1 weight 0.11000E+01 volume 0.36132E-05 ppm1 0.978 ppm2 0.263 CV 1
ASSI { 1439}
( segid " " and resid 48 and name HD2%)
( segid " " and resid 21 and name HE% )
3.700 3.700 2.300 peak 1439 spectrum 1 weight 0.11000E+01 volume 0.17145E-03 ppm1 0.985 ppm2 2.097 CV 1
ASSI { 1441}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 29 and name HB1 ))
6.000 4.900 0.000 peak 1441 spectrum 1 weight 0.11000E+01 volume 0.13750E-03 ppm1 1.595 ppm2 2.272 CV 1
ASSI { 1443}
(( segid " " and resid 30 and name HG ))
(( segid " " and resid 31 and name HN ))
3.200 1.300 1.300 peak 1443 spectrum 1 weight 0.11000E+01 volume 0.14817E-02 ppm1 1.653 ppm2 7.885 CV 1
ASSI { 1444}
(( segid " " and resid 52 and name HG ))
(( segid " " and resid 52 and name HA ))
3.200 1.300 1.300 peak 1444 spectrum 1 weight 0.11000E+01 volume 0.19904E-02 ppm1 1.605 ppm2 4.361 CV 1
ASSI { 1446}
( segid " " and resid 52 and name HD2%)
(( segid " " and resid 53 and name HN ))
3.800 3.800 2.200 peak 1446 spectrum 1 weight 0.11000E+01 volume 0.14501E-03 ppm1 0.819 ppm2 7.976 CV 1
ASSI { 1450}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 31 and name HN ))
3.600 1.700 1.700 peak 1450 spectrum 1 weight 0.11000E+01 volume 0.36333E-03 ppm1 0.920 ppm2 7.885 CV 1
ASSI { 1452}
( segid " " and resid 52 and name HD1%)
(( segid " " and resid 52 and name HA ))
4.100 2.100 1.900 peak 1452 spectrum 1 weight 0.11000E+01 volume 0.60370E-03 ppm1 0.883 ppm2 4.380 CV 1
ASSI { 1453}
( segid " " and resid 3 and name HD1%)
(( segid " " and resid 3 and name HA ))
4.400 2.400 1.600 peak 1453 spectrum 1 weight 0.11000E+01 volume 0.65578E-03 ppm1 0.883 ppm2 4.291 CV 1
ASSI { 1455}
( segid " " and resid 21 and name HE% )
( segid " " and resid 23 and name HD% )
3.300 3.300 2.700 peak 1455 spectrum 1 weight 0.11000E+01 volume 0.20069E-02 ppm1 2.118 ppm2 7.263 CV 1
ASSI { 1456}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 40 and name HG11))
6.000 6.000 0.000 peak 1456 spectrum 1 weight 0.11000E+01 volume 0.55905E-04 ppm1 2.115 ppm2 1.129 CV 1
ASSI { 1459}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 44 and name HG11))
4.500 2.500 1.500 peak 1459 spectrum 1 weight 0.11000E+01 volume 0.77257E-03 ppm1 2.115 ppm2 0.287 CV 1
ASSI { 1460}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 21 and name HB2 ))
3.800 1.800 1.800 peak 1460 spectrum 1 weight 0.11000E+01 volume 0.99383E-03 ppm1 2.115 ppm2 2.521 CV 1
ASSI { 1461}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 21 and name HG2 ))
3.400 1.400 1.400 peak 1461 spectrum 1 weight 0.11000E+01 volume 0.13383E-02 ppm1 2.116 ppm2 2.860 CV 1
ASSI { 1463}
( segid " " and resid 21 and name HE% )
(( segid " " and resid 18 and name HA ))
3.800 1.800 1.800 peak 1463 spectrum 1 weight 0.11000E+01 volume 0.11005E-02 ppm1 2.116 ppm2 4.130 CV 1
ASSI { 1465}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 20 and name HN ))
4.900 3.100 1.100 peak 1465 spectrum 1 weight 0.11000E+01 volume 0.28502E-03 ppm1 2.860 ppm2 8.311 CV 1
ASSI { 1466}
(( segid " " and resid 21 and name HG1 ))
(( segid " " and resid 20 and name HN ))
6.000 5.600 0.000 peak 1466 spectrum 1 weight 0.11000E+01 volume 0.42262E-04 ppm1 2.576 ppm2 8.297 CV 1
ASSI { 1467}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 23 and name HN ))
6.000 6.000 0.000 peak 1467 spectrum 1 weight 0.11000E+01 volume 0.10625E-03 ppm1 2.850 ppm2 7.846 CV 1
ASSI { 1471}
(( segid " " and resid 21 and name HG2 ))
( segid " " and resid 23 and name HD% )
5.200 5.200 0.800 peak 1471 spectrum 1 weight 0.11000E+01 volume 0.45940E-03 ppm1 2.849 ppm2 7.210 CV 1
ASSI { 1472}
(( segid " " and resid 21 and name HG1 ))
( segid " " and resid 23 and name HD% )
4.900 4.900 1.100 peak 1472 spectrum 1 weight 0.11000E+01 volume 0.29889E-03 ppm1 2.577 ppm2 7.206 CV 1
ASSI { 1475}
(( segid " " and resid 21 and name HG1 ))
(( segid " " and resid 20 and name HB2 ))
5.400 3.700 0.600 peak 1475 spectrum 1 weight 0.11000E+01 volume 0.31834E-03 ppm1 2.575 ppm2 4.129 CV 1
ASSI { 1477}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 21 and name HG1 ))
1.700 0.300 0.500 peak 1477 spectrum 1 weight 0.11000E+01 volume 0.11945E-01 ppm1 2.853 ppm2 2.562 CV 1
ASSI { 1479}
(( segid " " and resid 21 and name HG2 ))
(( segid " " and resid 21 and name HB1 ))
2.700 0.900 0.900 peak 1479 spectrum 1 weight 0.11000E+01 volume 0.45701E-02 ppm1 2.846 ppm2 2.321 CV 1
ASSI { 1481}
(( segid " " and resid 21 and name HG1 ))
(( segid " " and resid 21 and name HB1 ))
2.700 0.900 0.900 peak 1481 spectrum 1 weight 0.11000E+01 volume 0.49565E-02 ppm1 2.578 ppm2 2.341 CV 1
ASSI { 1482}
(( segid " " and resid 21 and name HG2 ))
( segid " " and resid 44 and name HD1%)
6.000 6.000 0.000 peak 1482 spectrum 1 weight 0.11000E+01 volume 0.55865E-04 ppm1 2.851 ppm2 0.774 CV 1
ASSI { 1483}
(( segid " " and resid 21 and name HG2 ))
( segid " " and resid 18 and name HD2%)
6.000 5.300 0.000 peak 1483 spectrum 1 weight 0.11000E+01 volume 0.17618E-03 ppm1 2.855 ppm2 0.498 CV 1
ASSI { 1484}
(( segid " " and resid 21 and name HG1 ))
( segid " " and resid 18 and name HD1%)
6.000 6.000 0.000 peak 1484 spectrum 1 weight 0.11000E+01 volume 0.13360E-04 ppm1 2.571 ppm2 0.493 CV 1
ASSI { 1485}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HN ))
3.000 1.100 1.100 peak 1485 spectrum 1 weight 0.11000E+01 volume 0.10373E-02 ppm1 2.502 ppm2 7.647 CV 1
ASSI { 1488}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 23 and name HD% )
3.200 3.200 2.800 peak 1488 spectrum 1 weight 0.11000E+01 volume 0.74984E-03 ppm1 2.501 ppm2 7.206 CV 1
ASSI { 1489}
(( segid " " and resid 21 and name HB1 ))
( segid " " and resid 23 and name HD% )
3.600 3.600 2.400 peak 1489 spectrum 1 weight 0.11000E+01 volume 0.93034E-03 ppm1 2.314 ppm2 7.203 CV 1
ASSI { 1490}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HA ))
4.000 2.000 2.000 peak 1490 spectrum 1 weight 0.11000E+01 volume 0.62841E-03 ppm1 2.495 ppm2 4.346 CV 1
ASSI { 1492}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 20 and name HB2 ))
5.000 3.200 1.000 peak 1492 spectrum 1 weight 0.11000E+01 volume 0.58692E-03 ppm1 2.486 ppm2 4.128 CV 1
ASSI { 1495}
(( segid " " and resid 21 and name HB1 ))
( segid " " and resid 18 and name HD1%)
5.600 5.600 0.400 peak 1495 spectrum 1 weight 0.11000E+01 volume 0.38029E-03 ppm1 2.308 ppm2 0.497 CV 1
ASSI { 1499}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HE% )
4.100 2.100 1.900 peak 1499 spectrum 1 weight 0.11000E+01 volume 0.99284E-03 ppm1 4.353 ppm2 2.114 CV 1
ASSI { 1500}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 23 and name HN ))
4.600 2.600 1.400 peak 1500 spectrum 1 weight 0.11000E+01 volume 0.62633E-03 ppm1 4.210 ppm2 7.884 CV 1
ASSI { 1502}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 19 and name HD22))
3.900 1.900 1.900 peak 1502 spectrum 1 weight 0.11000E+01 volume 0.13194E-03 ppm1 4.211 ppm2 7.005 CV 1
ASSI { 1503}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 19 and name HB2 ))
5.000 3.100 1.000 peak 1503 spectrum 1 weight 0.11000E+01 volume 0.38521E-03 ppm1 4.203 ppm2 2.890 CV 1
ASSI { 1504}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 19 and name HB1 ))
4.500 2.500 1.500 peak 1504 spectrum 1 weight 0.11000E+01 volume 0.21993E-03 ppm1 4.204 ppm2 2.732 CV 1
ASSI { 1505}
(( segid " " and resid 20 and name HB1 ))
(( segid " " and resid 19 and name HD21))
4.600 2.600 1.400 peak 1505 spectrum 1 weight 0.11000E+01 volume 0.38030E-03 ppm1 4.041 ppm2 7.917 CV 1
ASSI { 1506}
(( segid " " and resid 20 and name HB1 ))
(( segid " " and resid 21 and name HN ))
3.300 1.300 1.300 peak 1506 spectrum 1 weight 0.11000E+01 volume 0.10739E-02 ppm1 4.041 ppm2 7.646 CV 1
ASSI { 1507}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 17 and name HB1 ))
5.500 5.500 0.500 peak 1507 spectrum 1 weight 0.11000E+01 volume 0.20459E-03 ppm1 2.888 ppm2 1.902 CV 1
ASSI { 1508}
(( segid " " and resid 19 and name HB1 ))
(( segid " " and resid 17 and name HB1 ))
5.500 5.500 0.500 peak 1508 spectrum 1 weight 0.11000E+01 volume 0.17660E-03 ppm1 2.730 ppm2 1.901 CV 1
ASSI { 1509}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 15 and name HB1 ))
4.700 2.700 1.300 peak 1509 spectrum 1 weight 0.11000E+01 volume 0.15353E-03 ppm1 2.889 ppm2 1.483 CV 1
ASSI { 1513}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 29 and name HN ))
6.000 5.000 0.000 peak 1513 spectrum 1 weight 0.11000E+01 volume 0.36654E-04 ppm1 3.964 ppm2 8.616 CV 1
ASSI { 1514}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 31 and name HN ))
4.500 2.500 1.500 peak 1514 spectrum 1 weight 0.11000E+01 volume 0.36616E-03 ppm1 3.968 ppm2 7.897 CV 1
ASSI { 1515}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HN ))
3.900 1.900 1.900 peak 1515 spectrum 1 weight 0.11000E+01 volume 0.61731E-03 ppm1 3.969 ppm2 7.605 CV 1
ASSI { 1516}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 30 and name HN ))
3.700 1.700 1.700 peak 1516 spectrum 1 weight 0.11000E+01 volume 0.12664E-02 ppm1 3.973 ppm2 8.440 CV 1
ASSI { 1519}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 30 and name HD1%)
2.600 2.600 3.400 peak 1519 spectrum 1 weight 0.11000E+01 volume 0.32906E-02 ppm1 3.969 ppm2 0.886 CV 1
ASSI { 1520}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 51 and name HE21))
3.100 1.200 1.200 peak 1520 spectrum 1 weight 0.11000E+01 volume 0.18600E-02 ppm1 1.967 ppm2 7.600 CV 1
ASSI { 1521}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 28 and name HN ))
3.100 1.200 1.200 peak 1521 spectrum 1 weight 0.11000E+01 volume 0.71909E-03 ppm1 2.082 ppm2 7.599 CV 1
ASSI { 1525}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 28 and name HN ))
3.900 1.900 1.900 peak 1525 spectrum 1 weight 0.11000E+01 volume 0.16467E-02 ppm1 2.278 ppm2 7.615 CV 1
ASSI { 1526}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 29 and name HN ))
5.900 4.400 0.100 peak 1526 spectrum 1 weight 0.11000E+01 volume 0.15300E-03 ppm1 2.275 ppm2 8.605 CV 1
ASSI { 1528}
(( segid " " and resid 37 and name HA2 ))
(( segid " " and resid 38 and name HN ))
3.100 3.100 2.900 peak 1528 spectrum 1 weight 0.11000E+01 volume 0.11709E-02 ppm1 3.986 ppm2 8.823 CV 1
ASSI { 1529}
(( segid " " and resid 37 and name HA2 ))
(( segid " " and resid 39 and name HN ))
4.100 2.100 1.900 peak 1529 spectrum 1 weight 0.11000E+01 volume 0.93783E-03 ppm1 3.980 ppm2 6.872 CV 1
ASSI { 1530}
(( segid " " and resid 37 and name HA1 ))
( segid " " and resid 34 and name HG2%)
2.700 2.700 3.300 peak 1530 spectrum 1 weight 0.11000E+01 volume 0.10586E-02 ppm1 3.987 ppm2 0.855 CV 1
ASSI { 1531}
(( segid " " and resid 37 and name HA2 ))
(( segid " " and resid 10 and name HB1 ))
4.400 4.400 1.600 peak 1531 spectrum 1 weight 0.11000E+01 volume 0.32210E-03 ppm1 3.973 ppm2 1.089 CV 1
ASSI { 1533}
(( segid " " and resid 37 and name HA1 ))
(( segid " " and resid 36 and name HA ))
5.200 3.400 0.800 peak 1533 spectrum 1 weight 0.11000E+01 volume 0.11519E-03 ppm1 3.997 ppm2 4.518 CV 1
ASSI { 1534}
(( segid " " and resid 37 and name HA1 ))
(( segid " " and resid 34 and name HA ))
5.300 3.500 0.700 peak 1534 spectrum 1 weight 0.11000E+01 volume 0.37776E-03 ppm1 3.995 ppm2 3.624 CV 1
ASSI { 1535}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 8 and name HN ))
5.100 3.300 0.900 peak 1535 spectrum 1 weight 0.11000E+01 volume 0.15536E-03 ppm1 0.897 ppm2 9.237 CV 1
ASSI { 1537}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 10 and name HN ))
4.200 2.200 1.800 peak 1537 spectrum 1 weight 0.11000E+01 volume 0.11857E-02 ppm1 0.893 ppm2 8.114 CV 1
ASSI { 1538}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 9 and name HN ))
3.000 1.100 1.100 peak 1538 spectrum 1 weight 0.11000E+01 volume 0.18133E-02 ppm1 0.889 ppm2 7.521 CV 1
ASSI { 1540}
( segid " " and resid 9 and name HG2%)
(( segid " " and resid 10 and name HD1 ))
5.800 5.800 0.200 peak 1540 spectrum 1 weight 0.11000E+01 volume 0.14363E-03 ppm1 0.853 ppm2 2.673 CV 1
ASSI { 1541}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 13 and name HE22))
4.800 4.800 1.200 peak 1541 spectrum 1 weight 0.11000E+01 volume 0.24526E-03 ppm1 0.859 ppm2 6.904 CV 1
ASSI { 1542}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 9 and name HN ))
3.700 1.700 1.700 peak 1542 spectrum 1 weight 0.11000E+01 volume 0.21647E-02 ppm1 0.858 ppm2 7.558 CV 1
ASSI { 1544}
( segid " " and resid 9 and name HG1%)
(( segid " " and resid 6 and name HN ))
4.000 4.000 2.000 peak 1544 spectrum 1 weight 0.11000E+01 volume 0.11318E-03 ppm1 0.860 ppm2 8.506 CV 1
ASSI { 1546}
(( segid " " and resid 12 and name HG2 ))
( segid " " and resid 15 and name HD1%)
3.400 3.400 2.600 peak 1546 spectrum 1 weight 0.11000E+01 volume 0.28770E-02 ppm1 2.402 ppm2 0.863 CV 1
ASSI { 1547}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 6 and name HN ))
3.300 3.300 2.700 peak 1547 spectrum 1 weight 0.11000E+01 volume 0.34281E-03 ppm1 2.080 ppm2 8.494 CV 1
ASSI { 1548}
(( segid " " and resid 9 and name HB ))
(( segid " " and resid 8 and name HN ))
6.000 6.000 0.000 peak 1548 spectrum 1 weight 0.11000E+01 volume 0.40472E-04 ppm1 2.076 ppm2 9.217 CV 1
ASSI { 1549}
(( segid " " and resid 9 and name HB ))
( segid " " and resid 9 and name HG2%)
2.000 0.500 0.500 peak 1549 spectrum 1 weight 0.11000E+01 volume 0.15645E-01 ppm1 2.063 ppm2 0.886 CV 1
ASSI { 1550}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 15 and name HN ))
4.000 4.000 2.000 peak 1550 spectrum 1 weight 0.11000E+01 volume 0.44495E-03 ppm1 3.883 ppm2 8.743 CV 1
ASSI { 1553}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 16 and name HN ))
6.000 6.000 0.000 peak 1553 spectrum 1 weight 0.11000E+01 volume 0.29402E-04 ppm1 3.885 ppm2 7.847 CV 1
ASSI { 1554}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 14 and name HN ))
5.500 3.800 0.500 peak 1554 spectrum 1 weight 0.11000E+01 volume 0.85017E-04 ppm1 3.888 ppm2 9.299 CV 1
ASSI { 1555}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB1 ))
2.800 1.000 1.000 peak 1555 spectrum 1 weight 0.11000E+01 volume 0.30697E-02 ppm1 3.885 ppm2 2.088 CV 1
ASSI { 1556}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 15 and name HG ))
3.200 1.200 1.200 peak 1556 spectrum 1 weight 0.11000E+01 volume 0.57466E-03 ppm1 3.884 ppm2 1.651 CV 1
ASSI { 1557}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 15 and name HB1 ))
4.500 2.500 1.500 peak 1557 spectrum 1 weight 0.11000E+01 volume 0.73726E-03 ppm1 3.887 ppm2 1.489 CV 1
ASSI { 1558}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 33 and name HD2%)
6.000 6.000 0.000 peak 1558 spectrum 1 weight 0.11000E+01 volume 0.35891E-04 ppm1 3.885 ppm2 0.509 CV 1
ASSI { 1559}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HN ))
2.700 0.900 0.900 peak 1559 spectrum 1 weight 0.11000E+01 volume 0.18283E-02 ppm1 2.365 ppm2 7.386 CV 1
ASSI { 1560}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HE21))
4.400 2.400 1.600 peak 1560 spectrum 1 weight 0.11000E+01 volume 0.22113E-03 ppm1 2.360 ppm2 7.653 CV 1
ASSI { 1561}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 10 and name HN ))
6.000 4.600 0.000 peak 1561 spectrum 1 weight 0.11000E+01 volume 0.67580E-04 ppm1 2.362 ppm2 8.167 CV 1
ASSI { 1563}
(( segid " " and resid 12 and name HB1 ))
(( segid " " and resid 13 and name HN ))
2.600 0.800 0.800 peak 1563 spectrum 1 weight 0.11000E+01 volume 0.23706E-02 ppm1 2.092 ppm2 9.043 CV 1
ASSI { 1564}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HB1 ))
1.700 0.400 0.500 peak 1564 spectrum 1 weight 0.11000E+01 volume 0.11381E-01 ppm1 2.368 ppm2 2.087 CV 1
ASSI { 1565}
(( segid " " and resid 12 and name HB2 ))
( segid " " and resid 15 and name HD1%)
3.500 1.500 1.500 peak 1565 spectrum 1 weight 0.11000E+01 volume 0.13925E-02 ppm1 2.367 ppm2 0.881 CV 1
ASSI { 1569}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HH11))
3.800 1.800 1.800 peak 1569 spectrum 1 weight 0.11000E+01 volume 0.10093E-02 ppm1 3.865 ppm2 7.020 CV 1
ASSI { 1570}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HE21))
3.400 1.500 1.500 peak 1570 spectrum 1 weight 0.11000E+01 volume 0.70709E-03 ppm1 3.851 ppm2 7.695 CV 1
ASSI { 1572}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HN ))
2.600 0.800 0.800 peak 1572 spectrum 1 weight 0.11000E+01 volume 0.46400E-02 ppm1 3.850 ppm2 8.073 CV 1
ASSI { 1574}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HE22))
4.900 3.000 1.100 peak 1574 spectrum 1 weight 0.11000E+01 volume 0.34945E-03 ppm1 3.852 ppm2 6.913 CV 1
ASSI { 1575}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 32 and name HB% )
3.300 3.300 2.700 peak 1575 spectrum 1 weight 0.11000E+01 volume 0.30940E-02 ppm1 3.861 ppm2 1.341 CV 1
ASSI { 1576}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 34 and name HG11))
2.300 0.700 0.700 peak 1576 spectrum 1 weight 0.11000E+01 volume 0.24890E-02 ppm1 3.862 ppm2 1.075 CV 1
ASSI { 1577}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 34 and name HD1%)
2.200 0.600 0.600 peak 1577 spectrum 1 weight 0.11000E+01 volume 0.11693E-01 ppm1 3.861 ppm2 0.856 CV 1
ASSI { 1578}
(( segid " " and resid 31 and name HG1 ))
(( segid " " and resid 31 and name HA ))
3.000 1.100 1.100 peak 1578 spectrum 1 weight 0.11000E+01 volume 0.25359E-02 ppm1 2.365 ppm2 3.873 CV 1
ASSI { 1579}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HG2 ))
1.700 1.700 4.300 peak 1579 spectrum 1 weight 0.11000E+01 volume 0.32395E-01 ppm1 2.050 ppm2 2.435 CV 1
ASSI { 1580}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 32 and name HB% )
3.500 3.500 2.500 peak 1580 spectrum 1 weight 0.11000E+01 volume 0.16367E-02 ppm1 2.047 ppm2 1.315 CV 1
ASSI { 1582}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HN ))
2.600 0.900 0.900 peak 1582 spectrum 1 weight 0.11000E+01 volume 0.26050E-02 ppm1 3.850 ppm2 7.884 CV 1
ASSI { 1584}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HN ))
3.400 1.500 1.500 peak 1584 spectrum 1 weight 0.11000E+01 volume 0.75588E-03 ppm1 3.885 ppm2 9.238 CV 1
ASSI { 1586}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 12 and name HN ))
3.600 3.600 2.400 peak 1586 spectrum 1 weight 0.11000E+01 volume 0.10340E-02 ppm1 3.871 ppm2 7.452 CV 1
ASSI { 1587}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HN ))
3.400 1.400 1.400 peak 1587 spectrum 1 weight 0.11000E+01 volume 0.87592E-03 ppm1 3.879 ppm2 7.522 CV 1
ASSI { 1588}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 11 and name HD% )
3.800 1.800 1.800 peak 1588 spectrum 1 weight 0.11000E+01 volume 0.86952E-03 ppm1 3.865 ppm2 7.016 CV 1
ASSI { 1589}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HD1 ))
3.700 1.700 1.700 peak 1589 spectrum 1 weight 0.11000E+01 volume 0.82767E-03 ppm1 3.865 ppm2 2.676 CV 1
ASSI { 1590}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 13 and name HG1 ))
3.300 1.400 1.400 peak 1590 spectrum 1 weight 0.11000E+01 volume 0.24556E-02 ppm1 3.867 ppm2 2.393 CV 1
ASSI { 1591}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HG1 ))
2.600 0.800 0.800 peak 1591 spectrum 1 weight 0.11000E+01 volume 0.52970E-02 ppm1 3.881 ppm2 2.169 CV 1
ASSI { 1592}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 33 and name HG ))
3.100 1.200 1.200 peak 1592 spectrum 1 weight 0.11000E+01 volume 0.74366E-02 ppm1 3.863 ppm2 1.340 CV 1
ASSI { 1596}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HH11))
5.300 3.500 0.700 peak 1596 spectrum 1 weight 0.11000E+01 volume 0.44095E-03 ppm1 1.322 ppm2 7.044 CV 1
ASSI { 1597}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HD2 ))
3.600 1.700 1.700 peak 1597 spectrum 1 weight 0.11000E+01 volume 0.16441E-02 ppm1 1.328 ppm2 2.786 CV 1
ASSI { 1598}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HD1 ))
3.600 1.600 1.600 peak 1598 spectrum 1 weight 0.11000E+01 volume 0.15464E-02 ppm1 1.330 ppm2 2.652 CV 1
ASSI { 1599}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 10 and name HD1 ))
3.100 1.200 1.200 peak 1599 spectrum 1 weight 0.11000E+01 volume 0.15189E-02 ppm1 1.054 ppm2 2.650 CV 1
ASSI { 1600}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 10 and name HD2 ))
3.000 1.100 1.100 peak 1600 spectrum 1 weight 0.11000E+01 volume 0.18132E-02 ppm1 1.054 ppm2 2.780 CV 1
ASSI { 1601}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 9 and name HB ))
5.100 3.300 0.900 peak 1601 spectrum 1 weight 0.11000E+01 volume 0.21169E-03 ppm1 1.330 ppm2 2.056 CV 1
ASSI { 1602}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HB1 ))
2.000 0.500 0.500 peak 1602 spectrum 1 weight 0.11000E+01 volume 0.51969E-02 ppm1 1.325 ppm2 1.051 CV 1
ASSI { 1603}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HG1 ))
2.700 0.900 0.900 peak 1603 spectrum 1 weight 0.11000E+01 volume 0.19674E-02 ppm1 1.329 ppm2 0.917 CV 1
ASSI { 1605}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HN ))
2.800 1.000 1.000 peak 1605 spectrum 1 weight 0.11000E+01 volume 0.14899E-02 ppm1 1.173 ppm2 8.135 CV 1
ASSI { 1606}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HH11))
4.200 2.200 1.800 peak 1606 spectrum 1 weight 0.11000E+01 volume 0.89184E-03 ppm1 1.171 ppm2 7.044 CV 1
ASSI { 1609}
(( segid " " and resid 10 and name HG1 ))
(( segid " " and resid 10 and name HH11))
3.800 1.800 1.800 peak 1609 spectrum 1 weight 0.11000E+01 volume 0.19425E-02 ppm1 0.905 ppm2 7.046 CV 1
ASSI { 1610}
(( segid " " and resid 10 and name HD2 ))
(( segid " " and resid 10 and name HG1 ))
2.700 0.900 0.900 peak 1610 spectrum 1 weight 0.11000E+01 volume 0.31400E-02 ppm1 2.788 ppm2 0.908 CV 1
ASSI { 1611}
(( segid " " and resid 10 and name HD2 ))
(( segid " " and resid 10 and name HG2 ))
2.500 0.800 0.800 peak 1611 spectrum 1 weight 0.11000E+01 volume 0.46075E-02 ppm1 2.788 ppm2 1.160 CV 1
ASSI { 1617}
(( segid " " and resid 10 and name HD2 ))
(( segid " " and resid 10 and name HA ))
3.700 3.700 2.300 peak 1617 spectrum 1 weight 0.11000E+01 volume 0.76391E-03 ppm1 2.791 ppm2 3.845 CV 1
ASSI { 1619}
(( segid " " and resid 10 and name HD1 ))
(( segid " " and resid 10 and name HH21))
4.300 4.300 1.700 peak 1619 spectrum 1 weight 0.11000E+01 volume 0.83267E-03 ppm1 2.645 ppm2 6.560 CV 1
ASSI { 1620}
(( segid " " and resid 10 and name HD2 ))
(( segid " " and resid 10 and name HH21))
4.100 2.100 1.900 peak 1620 spectrum 1 weight 0.11000E+01 volume 0.12565E-02 ppm1 2.788 ppm2 6.559 CV 1
ASSI { 1624}
(( segid " " and resid 10 and name HD2 ))
(( segid " " and resid 10 and name HN ))
5.000 3.100 1.000 peak 1624 spectrum 1 weight 0.11000E+01 volume 0.24071E-03 ppm1 2.792 ppm2 8.126 CV 1
ASSI { 1626}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 8 and name HA ))
5.500 3.800 0.500 peak 1626 spectrum 1 weight 0.11000E+01 volume 0.25963E-03 ppm1 2.738 ppm2 3.902 CV 1
ASSI { 1627}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 31 and name HN ))
3.100 1.200 1.200 peak 1627 spectrum 1 weight 0.11000E+01 volume 0.22585E-02 ppm1 1.868 ppm2 7.895 CV 1
ASSI { 1629}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 34 and name HN ))
4.100 4.100 1.900 peak 1629 spectrum 1 weight 0.11000E+01 volume 0.94193E-03 ppm1 1.612 ppm2 8.624 CV 1
ASSI { 1632}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 29 and name HB2 ))
5.400 5.400 0.600 peak 1632 spectrum 1 weight 0.11000E+01 volume 0.17349E-03 ppm1 1.599 ppm2 2.942 CV 1
ASSI { 1635}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 29 and name HB1 ))
5.900 4.300 0.100 peak 1635 spectrum 1 weight 0.11000E+01 volume 0.49899E-03 ppm1 1.870 ppm2 2.265 CV 1
ASSI { 1636}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 30 and name HB2 ))
1.900 1.900 4.100 peak 1636 spectrum 1 weight 0.11000E+01 volume 0.38815E-02 ppm1 1.599 ppm2 1.873 CV 1
ASSI { 1638}
(( segid " " and resid 30 and name HB1 ))
( segid " " and resid 30 and name HD1%)
2.600 2.600 3.400 peak 1638 spectrum 1 weight 0.11000E+01 volume 0.10069E-01 ppm1 1.599 ppm2 0.930 CV 1
ASSI { 1639}
(( segid " " and resid 30 and name HG ))
(( segid " " and resid 29 and name HD21))
4.400 4.400 1.600 peak 1639 spectrum 1 weight 0.11000E+01 volume 0.58647E-04 ppm1 1.648 ppm2 7.433 CV 1
ASSI { 1640}
(( segid " " and resid 15 and name HG ))
( segid " " and resid 11 and name HD% )
4.500 2.500 1.500 peak 1640 spectrum 1 weight 0.11000E+01 volume 0.51536E-03 ppm1 1.637 ppm2 7.016 CV 1
ASSI { 1641}
(( segid " " and resid 30 and name HG ))
(( segid " " and resid 30 and name HB2 ))
2.600 0.800 0.800 peak 1641 spectrum 1 weight 0.11000E+01 volume 0.45624E-02 ppm1 1.659 ppm2 1.915 CV 1
ASSI { 1642}
(( segid " " and resid 30 and name HG ))
( segid " " and resid 30 and name HD1%)
2.000 0.500 0.500 peak 1642 spectrum 1 weight 0.11000E+01 volume 0.12068E-01 ppm1 1.657 ppm2 0.888 CV 1
ASSI { 1643}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 11 and name HB2 ))
5.000 5.000 1.000 peak 1643 spectrum 1 weight 0.11000E+01 volume 0.21904E-03 ppm1 0.935 ppm2 3.415 CV 1
ASSI { 1645}
( segid " " and resid 30 and name HD2%)
( segid " " and resid 33 and name HD2%)
2.600 2.600 3.400 peak 1645 spectrum 1 weight 0.11000E+01 volume 0.16117E-02 ppm1 0.934 ppm2 0.508 CV 1
ASSI { 1646}
( segid " " and resid 30 and name HD2%)
(( segid " " and resid 33 and name HB1 ))
3.500 3.500 2.500 peak 1646 spectrum 1 weight 0.11000E+01 volume 0.23419E-03 ppm1 0.935 ppm2 0.053 CV 1
ASSI { 1647}
(( segid " " and resid 10 and name HG1 ))
(( segid " " and resid 8 and name HN ))
5.700 4.100 0.300 peak 1647 spectrum 1 weight 0.11000E+01 volume 0.17061E-03 ppm1 0.921 ppm2 9.229 CV 1
ASSI { 1648}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 13 and name HA ))
4.600 2.600 1.400 peak 1648 spectrum 1 weight 0.11000E+01 volume 0.25871E-03 ppm1 1.974 ppm2 4.082 CV 1
ASSI { 1649}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HA ))
3.100 1.200 1.200 peak 1649 spectrum 1 weight 0.11000E+01 volume 0.15734E-02 ppm1 1.987 ppm2 3.861 CV 1
ASSI { 1650}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 12 and name HG2 ))
3.600 1.600 1.600 peak 1650 spectrum 1 weight 0.11000E+01 volume 0.83114E-03 ppm1 1.985 ppm2 2.403 CV 1
ASSI { 1651}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HG ))
2.700 0.900 0.900 peak 1651 spectrum 1 weight 0.11000E+01 volume 0.13239E-02 ppm1 1.982 ppm2 1.657 CV 1
ASSI { 1652}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HB1 ))
2.000 0.500 0.500 peak 1652 spectrum 1 weight 0.11000E+01 volume 0.38177E-02 ppm1 1.984 ppm2 1.491 CV 1
ASSI { 1653}
(( segid " " and resid 15 and name HB2 ))
( segid " " and resid 15 and name HD1%)
2.700 0.900 0.900 peak 1653 spectrum 1 weight 0.11000E+01 volume 0.33153E-02 ppm1 1.983 ppm2 0.881 CV 1
ASSI { 1654}
(( segid " " and resid 15 and name HB2 ))
( segid " " and resid 33 and name HD2%)
4.700 4.700 1.300 peak 1654 spectrum 1 weight 0.11000E+01 volume 0.46161E-03 ppm1 1.977 ppm2 0.516 CV 1
ASSI { 1658}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 18 and name HN ))
3.300 1.400 1.400 peak 1658 spectrum 1 weight 0.11000E+01 volume 0.14760E-02 ppm1 4.040 ppm2 8.750 CV 1
ASSI { 1659}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 21 and name HN ))
4.400 2.400 1.600 peak 1659 spectrum 1 weight 0.11000E+01 volume 0.37884E-03 ppm1 4.039 ppm2 7.641 CV 1
ASSI { 1660}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 15 and name HN ))
3.400 1.400 1.400 peak 1660 spectrum 1 weight 0.11000E+01 volume 0.87871E-03 ppm1 2.137 ppm2 8.743 CV 1
ASSI { 1662}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 17 and name HN ))
5.100 3.200 0.900 peak 1662 spectrum 1 weight 0.11000E+01 volume 0.61249E-03 ppm1 2.440 ppm2 8.297 CV 1
ASSI { 1663}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 18 and name HN ))
5.800 5.800 0.200 peak 1663 spectrum 1 weight 0.11000E+01 volume 0.22030E-03 ppm1 2.443 ppm2 8.748 CV 1
ASSI { 1664}
(( segid " " and resid 16 and name HG1 ))
(( segid " " and resid 15 and name HN ))
5.500 3.800 0.500 peak 1664 spectrum 1 weight 0.11000E+01 volume 0.14739E-03 ppm1 2.317 ppm2 8.744 CV 1
ASSI { 1665}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 13 and name HE22))
4.600 2.600 1.400 peak 1665 spectrum 1 weight 0.11000E+01 volume 0.48930E-04 ppm1 2.445 ppm2 6.928 CV 1
ASSI { 1666}
(( segid " " and resid 16 and name HG1 ))
(( segid " " and resid 13 and name HE22))
5.200 3.300 0.800 peak 1666 spectrum 1 weight 0.11000E+01 volume 0.84873E-04 ppm1 2.312 ppm2 6.923 CV 1
ASSI { 1667}
(( segid " " and resid 8 and name HG2 ))
(( segid " " and resid 10 and name HN ))
5.400 3.600 0.600 peak 1667 spectrum 1 weight 0.11000E+01 volume 0.21859E-03 ppm1 2.182 ppm2 8.111 CV 1
ASSI { 1668}
(( segid " " and resid 8 and name HG2 ))
(( segid " " and resid 9 and name HN ))
4.100 2.200 1.900 peak 1668 spectrum 1 weight 0.11000E+01 volume 0.82496E-03 ppm1 2.183 ppm2 7.552 CV 1
ASSI { 1671}
(( segid " " and resid 8 and name HG1 ))
(( segid " " and resid 8 and name HB1 ))
2.400 0.700 0.700 peak 1671 spectrum 1 weight 0.11000E+01 volume 0.18932E-01 ppm1 2.184 ppm2 1.916 CV 1
ASSI { 1672}
(( segid " " and resid 8 and name HG2 ))
( segid " " and resid 30 and name HD1%)
2.800 2.800 3.200 peak 1672 spectrum 1 weight 0.11000E+01 volume 0.86906E-02 ppm1 2.179 ppm2 0.902 CV 1
ASSI { 1673}
(( segid " " and resid 8 and name HG2 ))
(( segid " " and resid 26 and name HD1 ))
5.800 4.200 0.200 peak 1673 spectrum 1 weight 0.11000E+01 volume 0.72012E-04 ppm1 2.183 ppm2 3.180 CV 1
ASSI { 1674}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 8 and name HN ))
4.100 2.100 1.900 peak 1674 spectrum 1 weight 0.11000E+01 volume 0.91943E-03 ppm1 1.874 ppm2 9.231 CV 1
ASSI { 1675}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 8 and name HN ))
3.600 1.600 1.600 peak 1675 spectrum 1 weight 0.11000E+01 volume 0.48050E-03 ppm1 2.235 ppm2 9.222 CV 1
ASSI { 1677}
(( segid " " and resid 2 and name HB1 ))
(( segid " " and resid 3 and name HN ))
4.000 2.000 2.000 peak 1677 spectrum 1 weight 0.11000E+01 volume 0.50246E-03 ppm1 1.886 ppm2 8.642 CV 1
ASSI { 1678}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 10 and name HN ))
4.900 4.900 1.100 peak 1678 spectrum 1 weight 0.11000E+01 volume 0.32788E-03 ppm1 1.884 ppm2 8.105 CV 1
ASSI { 1679}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 10 and name HN ))
6.000 5.800 0.000 peak 1679 spectrum 1 weight 0.11000E+01 volume 0.42014E-04 ppm1 2.238 ppm2 8.135 CV 1
ASSI { 1680}
(( segid " " and resid 7 and name HB2 ))
( segid " " and resid 11 and name HD% )
3.000 1.200 1.200 peak 1680 spectrum 1 weight 0.11000E+01 volume 0.16774E-02 ppm1 2.238 ppm2 7.018 CV 1
ASSI { 1681}
(( segid " " and resid 7 and name HB1 ))
( segid " " and resid 11 and name HD% )
3.400 1.500 1.500 peak 1681 spectrum 1 weight 0.11000E+01 volume 0.80485E-03 ppm1 1.879 ppm2 7.024 CV 1
ASSI { 1682}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HN ))
3.300 1.300 1.300 peak 1682 spectrum 1 weight 0.11000E+01 volume 0.12058E-02 ppm1 2.161 ppm2 8.490 CV 1
ASSI { 1685}
(( segid " " and resid 2 and name HB1 ))
(( segid " " and resid 2 and name HD1 ))
4.500 2.500 1.500 peak 1685 spectrum 1 weight 0.11000E+01 volume 0.82578E-03 ppm1 1.876 ppm2 3.512 CV 1
ASSI { 1688}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 7 and name HD1 ))
5.000 3.100 1.000 peak 1688 spectrum 1 weight 0.11000E+01 volume 0.27805E-03 ppm1 2.656 ppm2 3.786 CV 1
ASSI { 1690}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 6 and name HA ))
5.000 3.200 1.000 peak 1690 spectrum 1 weight 0.11000E+01 volume 0.12853E-03 ppm1 2.657 ppm2 4.683 CV 1
ASSI { 1692}
(( segid " " and resid 6 and name HG2 ))
( segid " " and resid 9 and name HG2%)
4.600 2.700 1.400 peak 1692 spectrum 1 weight 0.11000E+01 volume 0.47158E-03 ppm1 2.651 ppm2 0.887 CV 1
ASSI { 1693}
(( segid " " and resid 6 and name HG1 ))
( segid " " and resid 9 and name HG2%)
4.800 2.800 1.200 peak 1693 spectrum 1 weight 0.11000E+01 volume 0.60004E-03 ppm1 2.549 ppm2 0.886 CV 1
ASSI { 1695}
(( segid " " and resid 6 and name HG1 ))
(( segid " " and resid 6 and name HB1 ))
3.200 1.300 1.300 peak 1695 spectrum 1 weight 0.11000E+01 volume 0.24244E-02 ppm1 2.545 ppm2 1.967 CV 1
ASSI { 1696}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 6 and name HB2 ))
3.100 1.200 1.200 peak 1696 spectrum 1 weight 0.11000E+01 volume 0.27041E-02 ppm1 2.652 ppm2 2.150 CV 1
ASSI { 1697}
(( segid " " and resid 6 and name HG1 ))
(( segid " " and resid 6 and name HB2 ))
2.500 0.800 0.800 peak 1697 spectrum 1 weight 0.11000E+01 volume 0.42174E-02 ppm1 2.549 ppm2 2.140 CV 1
ASSI { 1698}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 8 and name HN ))
3.300 1.400 1.400 peak 1698 spectrum 1 weight 0.11000E+01 volume 0.67905E-03 ppm1 3.793 ppm2 9.217 CV 1
ASSI { 1699}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 6 and name HN ))
3.000 1.100 1.100 peak 1699 spectrum 1 weight 0.11000E+01 volume 0.12450E-02 ppm1 3.789 ppm2 8.501 CV 1
ASSI { 1700}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 5 and name HN ))
6.000 5.500 0.000 peak 1700 spectrum 1 weight 0.11000E+01 volume 0.37509E-04 ppm1 3.785 ppm2 8.098 CV 1
ASSI { 1701}
(( segid " " and resid 7 and name HD2 ))
( segid " " and resid 11 and name HD% )
5.800 4.300 0.200 peak 1701 spectrum 1 weight 0.11000E+01 volume 0.81910E-04 ppm1 3.787 ppm2 7.015 CV 1
ASSI { 1702}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 6 and name HA ))
3.300 1.300 1.300 peak 1702 spectrum 1 weight 0.11000E+01 volume 0.12214E-02 ppm1 3.798 ppm2 4.683 CV 1
ASSI { 1703}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 5 and name HA ))
3.900 1.900 1.900 peak 1703 spectrum 1 weight 0.11000E+01 volume 0.32463E-03 ppm1 3.804 ppm2 4.366 CV 1
ASSI { 1704}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 6 and name HG1 ))
3.900 1.900 1.900 peak 1704 spectrum 1 weight 0.11000E+01 volume 0.99032E-03 ppm1 3.797 ppm2 2.552 CV 1
ASSI { 1705}
(( segid " " and resid 7 and name HD2 ))
( segid " " and resid 9 and name HG2%)
3.300 3.300 2.700 peak 1705 spectrum 1 weight 0.11000E+01 volume 0.26683E-02 ppm1 3.797 ppm2 0.889 CV 1
ASSI { 1707}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 31 and name HE22))
4.400 2.400 1.600 peak 1707 spectrum 1 weight 0.11000E+01 volume 0.11189E-02 ppm1 2.051 ppm2 6.888 CV 1
ASSI { 1709}
(( segid " " and resid 2 and name HB2 ))
(( segid " " and resid 2 and name HB1 ))
1.700 0.300 0.500 peak 1709 spectrum 1 weight 0.11000E+01 volume 0.23131E-01 ppm1 2.259 ppm2 1.900 CV 1
ASSI { 1710}
(( segid " " and resid 2 and name HB1 ))
( segid " " and resid 3 and name HD1%)
3.500 3.500 2.500 peak 1710 spectrum 1 weight 0.11000E+01 volume 0.25405E-02 ppm1 1.878 ppm2 0.890 CV 1
ASSI { 1711}
(( segid " " and resid 2 and name HB2 ))
( segid " " and resid 3 and name HD1%)
3.400 3.400 2.600 peak 1711 spectrum 1 weight 0.11000E+01 volume 0.31080E-02 ppm1 2.246 ppm2 0.891 CV 1
ASSI { 1713}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 9 and name HN ))
3.000 1.200 1.200 peak 1713 spectrum 1 weight 0.11000E+01 volume 0.41494E-02 ppm1 1.923 ppm2 7.558 CV 1
ASSI { 1714}
(( segid " " and resid 8 and name HB2 ))
( segid " " and resid 9 and name HG2%)
2.800 2.800 3.200 peak 1714 spectrum 1 weight 0.11000E+01 volume 0.63400E-02 ppm1 1.923 ppm2 0.916 CV 1
ASSI { 1715}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HN ))
3.400 1.400 1.400 peak 1715 spectrum 1 weight 0.11000E+01 volume 0.87998E-03 ppm1 3.883 ppm2 7.535 CV 1
ASSI { 1719}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 10 and name HN ))
3.700 1.700 1.700 peak 1719 spectrum 1 weight 0.11000E+01 volume 0.76233E-03 ppm1 3.889 ppm2 8.137 CV 1
ASSI { 1721}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 8 and name HN ))
5.100 3.300 0.900 peak 1721 spectrum 1 weight 0.11000E+01 volume 0.21723E-03 ppm1 2.094 ppm2 9.245 CV 1
ASSI { 1722}
(( segid " " and resid 7 and name HG1 ))
(( segid " " and resid 8 and name HN ))
4.700 2.700 1.300 peak 1722 spectrum 1 weight 0.11000E+01 volume 0.52740E-03 ppm1 2.009 ppm2 9.224 CV 1
ASSI { 1723}
(( segid " " and resid 2 and name HD2 ))
(( segid " " and resid 3 and name HN ))
3.600 3.600 2.400 peak 1723 spectrum 1 weight 0.11000E+01 volume 0.20069E-03 ppm1 3.519 ppm2 8.623 CV 1
ASSI { 1724}
(( segid " " and resid 2 and name HD1 ))
(( segid " " and resid 2 and name HA ))
4.400 2.400 1.600 peak 1724 spectrum 1 weight 0.11000E+01 volume 0.31089E-03 ppm1 3.514 ppm2 4.408 CV 1
ASSI { 1725}
(( segid " " and resid 2 and name HD2 ))
(( segid " " and resid 1 and name HA2 ))
2.600 0.800 0.800 peak 1725 spectrum 1 weight 0.11000E+01 volume 0.70696E-02 ppm1 3.518 ppm2 3.940 CV 1
ASSI { 1728}
(( segid " " and resid 2 and name HG2 ))
(( segid " " and resid 3 and name HN ))
3.500 1.600 1.600 peak 1728 spectrum 1 weight 0.11000E+01 volume 0.22584E-03 ppm1 1.954 ppm2 8.649 CV 1
ASSI { 1729}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HD1 ))
2.300 0.600 0.600 peak 1729 spectrum 1 weight 0.11000E+01 volume 0.88498E-02 ppm1 4.681 ppm2 3.791 CV 1
ASSI { 1730}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 9 and name HG2%)
4.900 3.000 1.100 peak 1730 spectrum 1 weight 0.11000E+01 volume 0.13116E-03 ppm1 4.681 ppm2 0.883 CV 1
ASSI { 1731}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 8 and name HN ))
4.700 2.800 1.300 peak 1731 spectrum 1 weight 0.11000E+01 volume 0.29388E-03 ppm1 2.166 ppm2 9.211 CV 1
ASSI { 1732}
(( segid " " and resid 6 and name HB1 ))
(( segid " " and resid 8 and name HN ))
6.000 6.000 0.000 peak 1732 spectrum 1 weight 0.11000E+01 volume 0.28854E-04 ppm1 1.962 ppm2 9.223 CV 1
ASSI { 1736}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 7 and name HD1 ))
3.500 1.500 1.500 peak 1736 spectrum 1 weight 0.11000E+01 volume 0.19475E-02 ppm1 2.167 ppm2 3.805 CV 1
ASSI { 1737}
(( segid " " and resid 6 and name HB1 ))
(( segid " " and resid 7 and name HD1 ))
4.400 2.400 1.600 peak 1737 spectrum 1 weight 0.11000E+01 volume 0.67174E-03 ppm1 1.957 ppm2 3.792 CV 1
ASSI { 1739}
(( segid " " and resid 6 and name HB1 ))
(( segid " " and resid 6 and name HG2 ))
2.500 0.800 0.800 peak 1739 spectrum 1 weight 0.11000E+01 volume 0.40740E-02 ppm1 1.957 ppm2 2.661 CV 1
ASSI { 1740}
(( segid " " and resid 6 and name HB1 ))
(( segid " " and resid 6 and name HB2 ))
2.100 0.500 0.500 peak 1740 spectrum 1 weight 0.11000E+01 volume 0.46021E-02 ppm1 1.953 ppm2 2.168 CV 1
ASSI { 1742}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 6 and name HA ))
6.000 4.700 0.000 peak 1742 spectrum 1 weight 0.11000E+01 volume 0.14178E-03 ppm1 2.064 ppm2 4.681 CV 1
ASSI { 1743}
( segid " " and resid 6 and name HE% )
( segid " " and resid 9 and name HG2%)
3.200 1.300 1.300 peak 1743 spectrum 1 weight 0.11000E+01 volume 0.31645E-02 ppm1 2.065 ppm2 0.887 CV 1
ASSI { 1744}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 6 and name HG2 ))
5.300 3.500 0.700 peak 1744 spectrum 1 weight 0.11000E+01 volume 0.13228E-03 ppm1 2.063 ppm2 2.676 CV 1
ASSI { 1745}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 6 and name HG1 ))
5.200 3.400 0.800 peak 1745 spectrum 1 weight 0.11000E+01 volume 0.89148E-04 ppm1 2.064 ppm2 2.599 CV 1
ASSI { 1746}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 3 and name HA ))
3.700 3.700 2.300 peak 1746 spectrum 1 weight 0.11000E+01 volume 0.18235E-03 ppm1 2.065 ppm2 4.227 CV 1
ASSI { 1751}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 8 and name HN ))
6.000 6.000 0.000 peak 1751 spectrum 1 weight 0.11000E+01 volume 0.73406E-04 ppm1 2.065 ppm2 9.241 CV 1
ASSI { 1753}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 6 and name HN ))
5.000 3.200 1.000 peak 1753 spectrum 1 weight 0.11000E+01 volume 0.20978E-03 ppm1 2.064 ppm2 8.509 CV 1
ASSI { 1754}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 5 and name HN ))
6.000 6.000 0.000 peak 1754 spectrum 1 weight 0.11000E+01 volume 0.27758E-04 ppm1 2.065 ppm2 8.087 CV 1
ASSI { 1756}
( segid " " and resid 6 and name HE% )
(( segid " " and resid 10 and name HH11))
5.700 4.100 0.300 peak 1756 spectrum 1 weight 0.11000E+01 volume 0.59369E-04 ppm1 2.065 ppm2 7.017 CV 1
ASSI { 1758}
(( segid " " and resid 5 and name HB1 ))
(( segid " " and resid 5 and name HA ))
2.300 0.700 0.700 peak 1758 spectrum 1 weight 0.11000E+01 volume 0.87001E-02 ppm1 3.781 ppm2 4.371 CV 1
ASSI { 1759}
(( segid " " and resid 5 and name HB2 ))
(( segid " " and resid 6 and name HG2 ))
4.300 2.300 1.700 peak 1759 spectrum 1 weight 0.11000E+01 volume 0.30837E-03 ppm1 3.784 ppm2 2.646 CV 1
ASSI { 1760}
(( segid " " and resid 5 and name HB1 ))
(( segid " " and resid 7 and name HG2 ))
3.300 3.300 2.700 peak 1760 spectrum 1 weight 0.11000E+01 volume 0.31129E-02 ppm1 3.781 ppm2 2.082 CV 1
ASSI { 1762}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 21 and name HG1 ))
5.000 3.100 1.000 peak 1762 spectrum 1 weight 0.11000E+01 volume 0.32666E-03 ppm1 4.376 ppm2 2.631 CV 1
ASSI { 1763}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HB1 ))
4.200 2.200 1.800 peak 1763 spectrum 1 weight 0.11000E+01 volume 0.93210E-03 ppm1 4.372 ppm2 1.950 CV 1
ASSI { 1764}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 3 and name HD2%)
3.200 3.200 2.800 peak 1764 spectrum 1 weight 0.11000E+01 volume 0.41340E-03 ppm1 4.367 ppm2 0.875 CV 1
ASSI { 1766}
(( segid " " and resid 4 and name HA1 ))
(( segid " " and resid 7 and name HG1 ))
3.500 3.500 2.500 peak 1766 spectrum 1 weight 0.11000E+01 volume 0.12137E-02 ppm1 3.879 ppm2 2.070 CV 1
ASSI { 1767}
(( segid " " and resid 4 and name HA1 ))
(( segid " " and resid 6 and name HB1 ))
4.000 2.000 2.000 peak 1767 spectrum 1 weight 0.11000E+01 volume 0.11110E-02 ppm1 3.878 ppm2 1.951 CV 1
ASSI { 1768}
(( segid " " and resid 4 and name HA2 ))
(( segid " " and resid 3 and name HB2 ))
3.700 1.700 1.700 peak 1768 spectrum 1 weight 0.11000E+01 volume 0.10662E-02 ppm1 3.876 ppm2 1.608 CV 1
ASSI { 1770}
(( segid " " and resid 4 and name HA2 ))
( segid " " and resid 3 and name HD1%)
2.300 2.300 3.700 peak 1770 spectrum 1 weight 0.11000E+01 volume 0.31877E-02 ppm1 3.879 ppm2 0.865 CV 1
ASSI { 1772}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 6 and name HG1 ))
4.100 2.100 1.900 peak 1772 spectrum 1 weight 0.11000E+01 volume 0.44608E-03 ppm1 4.256 ppm2 2.586 CV 1
ASSI { 1773}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 2 and name HB1 ))
2.700 2.700 3.300 peak 1773 spectrum 1 weight 0.11000E+01 volume 0.11620E-02 ppm1 4.260 ppm2 1.913 CV 1
ASSI { 1777}
(( segid " " and resid 3 and name HG ))
( segid " " and resid 3 and name HD2%)
2.100 0.500 0.500 peak 1777 spectrum 1 weight 0.11000E+01 volume 0.16346E-01 ppm1 1.627 ppm2 0.828 CV 1
ASSI { 1779}
( segid " " and resid 3 and name HD1%)
(( segid " " and resid 4 and name HN ))
3.200 3.200 2.800 peak 1779 spectrum 1 weight 0.11000E+01 volume 0.38555E-03 ppm1 0.884 ppm2 8.425 CV 1
ASSI { 1783}
( segid " " and resid 3 and name HD2%)
(( segid " " and resid 3 and name HN ))
4.600 2.700 1.400 peak 1783 spectrum 1 weight 0.11000E+01 volume 0.34693E-03 ppm1 0.838 ppm2 8.648 CV 1
ASSI { 1784}
( segid " " and resid 3 and name HD2%)
(( segid " " and resid 4 and name HN ))
4.200 4.200 1.800 peak 1784 spectrum 1 weight 0.11000E+01 volume 0.87402E-04 ppm1 0.839 ppm2 8.510 CV 1
ASSI { 1786}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 22 and name HA1 ))
6.000 4.500 0.000 peak 1786 spectrum 1 weight 0.11000E+01 volume 0.11438E-03 ppm1 4.349 ppm2 3.454 CV 1
ASSI { 1787}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 17 and name HA ))
2.500 0.800 0.800 peak 1787 spectrum 1 weight 0.11000E+01 volume 0.87154E-02 ppm1 1.953 ppm2 4.029 CV 1
ASSI { 1788}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 40 and name HD1%)
3.400 1.500 1.500 peak 1788 spectrum 1 weight 0.11000E+01 volume 0.31433E-02 ppm1 2.214 ppm2 0.801 CV 1
ASSI { 1789}
(( segid " " and resid 17 and name HB1 ))
( segid " " and resid 40 and name HD1%)
2.300 0.700 0.700 peak 1789 spectrum 1 weight 0.11000E+01 volume 0.52744E-02 ppm1 1.945 ppm2 0.801 CV 1
ASSI { 1790}
(( segid " " and resid 17 and name HB1 ))
( segid " " and resid 18 and name HD2%)
4.600 2.700 1.400 peak 1790 spectrum 1 weight 0.11000E+01 volume 0.38619E-03 ppm1 1.950 ppm2 0.504 CV 1
ASSI { 1791}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 18 and name HD2%)
5.500 5.500 0.500 peak 1791 spectrum 1 weight 0.11000E+01 volume 0.39353E-03 ppm1 2.221 ppm2 0.501 CV 1
ASSI { 1792}
(( segid " " and resid 11 and name HB2 ))
( segid " " and resid 33 and name HD1%)
6.000 6.000 0.000 peak 1792 spectrum 1 weight 0.11000E+01 volume 0.29549E-04 ppm1 3.407 ppm2 0.196 CV 1
ASSI { 1}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
2.300 0.700 0.700 peak 1 spectrum 1 weight 0.11000E+01 volume 0.63977E-02 ppm1 8.924 ppm2 4.554 CV 1
ASSI { 1}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 41 and name HA ))
6.000 4.500 0.000 peak 1 spectrum 1 weight 0.11000E+01 volume 0.10630E-03 ppm1 8.925 ppm2 4.359 CV 1
ASSI { 2}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 38 and name HA2 ))
4.700 2.700 1.300 peak 2 spectrum 1 weight 0.11000E+01 volume 0.13075E-03 ppm1 8.924 ppm2 4.014 CV 1
ASSI { 4}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HA ))
2.900 1.100 1.100 peak 4 spectrum 1 weight 0.11000E+01 volume 0.14557E-02 ppm1 8.924 ppm2 3.560 CV 1
ASSI { 5}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HB2 ))
4.500 2.500 1.500 peak 5 spectrum 1 weight 0.11000E+01 volume 0.83416E-03 ppm1 8.924 ppm2 2.855 CV 1
ASSI { 6}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HB1 ))
3.600 1.600 1.600 peak 6 spectrum 1 weight 0.11000E+01 volume 0.14569E-02 ppm1 8.924 ppm2 2.639 CV 1
ASSI { 7}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HB ))
2.400 0.700 0.700 peak 7 spectrum 1 weight 0.11000E+01 volume 0.30950E-02 ppm1 8.924 ppm2 1.707 CV 1
ASSI { 9}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HG11))
4.500 2.500 1.500 peak 9 spectrum 1 weight 0.11000E+01 volume 0.63165E-03 ppm1 8.924 ppm2 1.179 CV 1
ASSI { 10}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 40 and name HG2%)
3.000 1.100 1.100 peak 10 spectrum 1 weight 0.11000E+01 volume 0.31330E-02 ppm1 8.924 ppm2 0.860 CV 1
ASSI { 11}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 33 and name HD2%)
6.000 5.000 0.000 peak 11 spectrum 1 weight 0.11000E+01 volume 0.35485E-04 ppm1 8.924 ppm2 0.536 CV 1
ASSI { 12}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 33 and name HD1%)
5.100 3.300 0.900 peak 12 spectrum 1 weight 0.11000E+01 volume 0.30678E-03 ppm1 8.924 ppm2 0.238 CV 1
ASSI { 13}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HA ))
2.700 0.900 0.900 peak 13 spectrum 1 weight 0.11000E+01 volume 0.28716E-02 ppm1 8.407 ppm2 4.808 CV 1
ASSI { 14}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 27 and name HA ))
6.000 6.000 0.000 peak 14 spectrum 1 weight 0.11000E+01 volume 0.78456E-04 ppm1 8.405 ppm2 3.998 CV 1
ASSI { 15}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HA ))
3.200 1.300 1.300 peak 15 spectrum 1 weight 0.11000E+01 volume 0.96457E-03 ppm1 8.408 ppm2 3.809 CV 1
ASSI { 16}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB2 ))
5.000 3.100 1.000 peak 16 spectrum 1 weight 0.11000E+01 volume 0.34282E-03 ppm1 8.406 ppm2 3.368 CV 1
ASSI { 17}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HD1 ))
4.700 2.800 1.300 peak 17 spectrum 1 weight 0.11000E+01 volume 0.44846E-03 ppm1 8.408 ppm2 3.205 CV 1
ASSI { 18}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB1 ))
4.500 2.500 1.500 peak 18 spectrum 1 weight 0.11000E+01 volume 0.42799E-03 ppm1 8.410 ppm2 2.630 CV 1
ASSI { 19}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 27 and name HG1 ))
6.000 6.000 0.000 peak 19 spectrum 1 weight 0.11000E+01 volume 0.89436E-05 ppm1 8.406 ppm2 2.299 CV 1
ASSI { 20}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
2.600 0.800 0.800 peak 20 spectrum 1 weight 0.11000E+01 volume 0.24374E-02 ppm1 8.408 ppm2 1.884 CV 1
ASSI { 21}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB1 ))
3.500 1.500 1.500 peak 21 spectrum 1 weight 0.11000E+01 volume 0.33932E-02 ppm1 8.408 ppm2 1.765 CV 1
ASSI { 23}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 28 and name HB% )
6.000 6.000 0.000 peak 23 spectrum 1 weight 0.11000E+01 volume 0.31017E-04 ppm1 8.404 ppm2 1.311 CV 1
ASSI { 24}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 15 and name HD2%)
6.000 6.000 0.000 peak 24 spectrum 1 weight 0.11000E+01 volume 0.13869E-03 ppm1 8.406 ppm2 0.850 CV 1
ASSI { 25}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HA ))
3.000 1.200 1.200 peak 25 spectrum 1 weight 0.11000E+01 volume 0.16762E-02 ppm1 9.097 ppm2 4.811 CV 1
ASSI { 26}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 23 and name HA ))
4.300 2.300 1.700 peak 26 spectrum 1 weight 0.11000E+01 volume 0.65411E-03 ppm1 9.100 ppm2 4.649 CV 1
ASSI { 27}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HB2 ))
2.700 0.900 0.900 peak 27 spectrum 1 weight 0.11000E+01 volume 0.25577E-02 ppm1 9.099 ppm2 3.368 CV 1
ASSI { 28}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 28 and name HB% )
4.300 2.300 1.700 peak 28 spectrum 1 weight 0.11000E+01 volume 0.96958E-03 ppm1 9.101 ppm2 1.308 CV 1
ASSI { 29}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HA ))
3.500 1.500 1.500 peak 29 spectrum 1 weight 0.11000E+01 volume 0.87254E-03 ppm1 9.098 ppm2 4.447 CV 1
ASSI { 31}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HA ))
6.000 5.000 0.000 peak 31 spectrum 1 weight 0.11000E+01 volume 0.28832E-04 ppm1 9.095 ppm2 3.816 CV 1
ASSI { 32}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HB1 ))
3.000 1.200 1.200 peak 32 spectrum 1 weight 0.11000E+01 volume 0.24271E-02 ppm1 9.099 ppm2 2.630 CV 1
ASSI { 33}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HB ))
4.500 2.500 1.500 peak 33 spectrum 1 weight 0.11000E+01 volume 0.36299E-03 ppm1 9.098 ppm2 2.243 CV 1
ASSI { 34}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HB2 ))
6.000 6.000 0.000 peak 34 spectrum 1 weight 0.11000E+01 volume 0.51969E-04 ppm1 9.096 ppm2 1.896 CV 1
ASSI { 35}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HG2 ))
6.000 5.700 0.000 peak 35 spectrum 1 weight 0.11000E+01 volume 0.27525E-04 ppm1 9.094 ppm2 1.768 CV 1
ASSI { 36}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HG12))
3.600 1.600 1.600 peak 36 spectrum 1 weight 0.11000E+01 volume 0.16257E-02 ppm1 9.098 ppm2 1.181 CV 1
ASSI { 37}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 24 and name HD1%)
4.800 2.800 1.200 peak 37 spectrum 1 weight 0.11000E+01 volume 0.10066E-02 ppm1 9.098 ppm2 0.837 CV 1
ASSI { 38}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 36 and name HB ))
4.000 2.000 2.000 peak 38 spectrum 1 weight 0.11000E+01 volume 0.47203E-03 ppm1 8.368 ppm2 4.636 CV 1
ASSI { 40}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 36 and name HG1 ))
3.300 1.400 1.400 peak 40 spectrum 1 weight 0.11000E+01 volume 0.10340E-02 ppm1 8.369 ppm2 3.866 CV 1
ASSI { 41}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
2.600 0.800 0.800 peak 41 spectrum 1 weight 0.11000E+01 volume 0.30890E-02 ppm1 8.369 ppm2 3.641 CV 1
ASSI { 42}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 41 and name HB2 ))
4.800 2.900 1.200 peak 42 spectrum 1 weight 0.11000E+01 volume 0.42284E-03 ppm1 8.369 ppm2 2.859 CV 1
ASSI { 43}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 41 and name HB1 ))
5.700 4.100 0.300 peak 43 spectrum 1 weight 0.11000E+01 volume 0.22993E-03 ppm1 8.368 ppm2 2.662 CV 1
ASSI { 44}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 45 and name HB1 ))
6.000 6.000 0.000 peak 44 spectrum 1 weight 0.11000E+01 volume 0.19315E-04 ppm1 8.368 ppm2 2.043 CV 1
ASSI { 45}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HB ))
4.500 2.600 1.500 peak 45 spectrum 1 weight 0.11000E+01 volume 0.59824E-03 ppm1 8.370 ppm2 1.753 CV 1
ASSI { 46}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HG12))
5.700 4.100 0.300 peak 46 spectrum 1 weight 0.11000E+01 volume 0.24051E-03 ppm1 8.365 ppm2 1.585 CV 1
ASSI { 47}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 33 and name HG ))
3.300 1.300 1.300 peak 47 spectrum 1 weight 0.11000E+01 volume 0.26799E-02 ppm1 8.369 ppm2 1.391 CV 1
ASSI { 48}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 43 and name HB% )
2.300 2.300 3.700 peak 48 spectrum 1 weight 0.11000E+01 volume 0.57213E-02 ppm1 8.370 ppm2 1.133 CV 1
ASSI { 50}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 52 and name HD2%)
3.600 1.600 1.600 peak 50 spectrum 1 weight 0.11000E+01 volume 0.88088E-03 ppm1 8.369 ppm2 0.842 CV 1
ASSI { 51}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 18 and name HD2%)
5.200 5.200 0.800 peak 51 spectrum 1 weight 0.11000E+01 volume 0.27816E-03 ppm1 8.370 ppm2 0.537 CV 1
ASSI { 53}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HA ))
2.600 0.800 0.800 peak 53 spectrum 1 weight 0.11000E+01 volume 0.54282E-02 ppm1 8.319 ppm2 4.365 CV 1
ASSI { 54}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HG2 ))
4.800 2.900 1.200 peak 54 spectrum 1 weight 0.11000E+01 volume 0.40376E-03 ppm1 8.318 ppm2 2.384 CV 1
ASSI { 55}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB2 ))
4.900 3.000 1.100 peak 55 spectrum 1 weight 0.11000E+01 volume 0.40829E-03 ppm1 8.319 ppm2 2.159 CV 1
ASSI { 56}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB1 ))
5.000 3.100 1.000 peak 56 spectrum 1 weight 0.11000E+01 volume 0.47690E-03 ppm1 8.319 ppm2 2.010 CV 1
ASSI { 57}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HG ))
2.700 0.900 0.900 peak 57 spectrum 1 weight 0.11000E+01 volume 0.44758E-02 ppm1 8.319 ppm2 1.646 CV 1
ASSI { 58}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 52 and name HD1%)
3.700 1.700 1.700 peak 58 spectrum 1 weight 0.11000E+01 volume 0.81049E-03 ppm1 8.320 ppm2 0.882 CV 1
ASSI { 59}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 36 and name HG1 ))
4.200 2.200 1.800 peak 59 spectrum 1 weight 0.11000E+01 volume 0.68053E-03 ppm1 8.118 ppm2 3.865 CV 1
ASSI { 64}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HB2 ))
3.900 3.900 2.100 peak 64 spectrum 1 weight 0.11000E+01 volume 0.48321E-03 ppm1 8.716 ppm2 1.670 CV 1
ASSI { 66}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HA ))
5.100 3.300 0.900 peak 66 spectrum 1 weight 0.11000E+01 volume 0.20208E-03 ppm1 8.369 ppm2 2.994 CV 1
ASSI { 69}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HA ))
4.600 2.600 1.400 peak 69 spectrum 1 weight 0.11000E+01 volume 0.56257E-03 ppm1 8.115 ppm2 3.606 CV 1
ASSI { 70}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB2 ))
2.600 0.900 0.900 peak 70 spectrum 1 weight 0.11000E+01 volume 0.28335E-02 ppm1 8.115 ppm2 2.859 CV 1
ASSI { 71}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB1 ))
3.300 1.300 1.300 peak 71 spectrum 1 weight 0.11000E+01 volume 0.46544E-02 ppm1 8.112 ppm2 2.710 CV 1
ASSI { 73}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 40 and name HB ))
4.900 3.100 1.100 peak 73 spectrum 1 weight 0.11000E+01 volume 0.29287E-03 ppm1 8.114 ppm2 1.724 CV 1
ASSI { 74}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 42 and name HB% )
2.400 0.700 0.700 peak 74 spectrum 1 weight 0.11000E+01 volume 0.57678E-02 ppm1 8.115 ppm2 1.419 CV 1
ASSI { 75}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 43 and name HB% )
4.300 2.300 1.700 peak 75 spectrum 1 weight 0.11000E+01 volume 0.83200E-03 ppm1 8.115 ppm2 1.135 CV 1
ASSI { 76}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 36 and name HG2%)
4.600 2.600 1.400 peak 76 spectrum 1 weight 0.11000E+01 volume 0.57989E-03 ppm1 8.114 ppm2 0.981 CV 1
ASSI { 77}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 40 and name HG2%)
4.400 2.400 1.600 peak 77 spectrum 1 weight 0.11000E+01 volume 0.77049E-03 ppm1 8.115 ppm2 0.856 CV 1
ASSI { 78}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 44 and name HG11))
5.600 3.900 0.400 peak 78 spectrum 1 weight 0.11000E+01 volume 0.86803E-04 ppm1 8.113 ppm2 0.267 CV 1
ASSI { 79}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 29 and name HB2 ))
5.600 4.000 0.400 peak 79 spectrum 1 weight 0.11000E+01 volume 0.80670E-04 ppm1 7.638 ppm2 2.981 CV 1
ASSI { 80}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 25 and name HA ))
5.200 3.400 0.800 peak 80 spectrum 1 weight 0.11000E+01 volume 0.14910E-03 ppm1 7.635 ppm2 4.811 CV 1
ASSI { 81}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA ))
2.600 0.900 0.900 peak 81 spectrum 1 weight 0.11000E+01 volume 0.37722E-02 ppm1 7.638 ppm2 4.012 CV 1
ASSI { 82}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 26 and name HA ))
3.500 1.500 1.500 peak 82 spectrum 1 weight 0.11000E+01 volume 0.96737E-03 ppm1 7.637 ppm2 3.830 CV 1
ASSI { 83}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 25 and name HB2 ))
4.600 2.600 1.400 peak 83 spectrum 1 weight 0.11000E+01 volume 0.58110E-03 ppm1 7.637 ppm2 3.370 CV 1
ASSI { 84}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 25 and name HB1 ))
4.000 2.000 2.000 peak 84 spectrum 1 weight 0.11000E+01 volume 0.28976E-03 ppm1 7.635 ppm2 2.630 CV 1
ASSI { 87}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HB1 ))
3.300 1.400 1.400 peak 87 spectrum 1 weight 0.11000E+01 volume 0.38173E-02 ppm1 7.638 ppm2 2.012 CV 1
ASSI { 88}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 26 and name HB1 ))
4.600 2.600 1.400 peak 88 spectrum 1 weight 0.11000E+01 volume 0.31653E-03 ppm1 7.638 ppm2 1.753 CV 1
ASSI { 89}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 28 and name HB% )
2.400 0.700 0.700 peak 89 spectrum 1 weight 0.11000E+01 volume 0.60054E-02 ppm1 7.637 ppm2 1.320 CV 1
ASSI { 90}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 30 and name HD1%)
5.800 5.800 0.200 peak 90 spectrum 1 weight 0.11000E+01 volume 0.71945E-04 ppm1 7.637 ppm2 0.952 CV 1
ASSI { 91}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 47 and name HD1%)
5.000 3.200 1.000 peak 91 spectrum 1 weight 0.11000E+01 volume 0.34055E-03 ppm1 7.635 ppm2 0.764 CV 1
ASSI { 96}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HA ))
2.900 1.100 1.100 peak 96 spectrum 1 weight 0.11000E+01 volume 0.21127E-02 ppm1 8.670 ppm2 4.298 CV 1
ASSI { 97}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 4 and name HA2 ))
4.400 2.500 1.600 peak 97 spectrum 1 weight 0.11000E+01 volume 0.31994E-03 ppm1 8.669 ppm2 3.939 CV 1
ASSI { 99}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 2 and name HB2 ))
3.900 1.900 1.900 peak 99 spectrum 1 weight 0.11000E+01 volume 0.77460E-03 ppm1 8.669 ppm2 2.297 CV 1
ASSI { 100}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HG ))
2.400 0.700 0.700 peak 100 spectrum 1 weight 0.11000E+01 volume 0.72986E-02 ppm1 8.667 ppm2 1.654 CV 1
ASSI { 101}
(( segid " " and resid 3 and name HN ))
( segid " " and resid 3 and name HD1%)
3.700 1.700 1.700 peak 101 spectrum 1 weight 0.11000E+01 volume 0.93440E-03 ppm1 8.669 ppm2 0.899 CV 1
ASSI { 104}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HB2 ))
3.100 1.200 1.200 peak 104 spectrum 1 weight 0.11000E+01 volume 0.37742E-02 ppm1 8.526 ppm2 3.822 CV 1
ASSI { 105}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HG2 ))
3.100 1.200 1.200 peak 105 spectrum 1 weight 0.11000E+01 volume 0.31446E-02 ppm1 8.526 ppm2 2.666 CV 1
ASSI { 106}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HG1 ))
2.800 1.000 1.000 peak 106 spectrum 1 weight 0.11000E+01 volume 0.27206E-02 ppm1 8.526 ppm2 2.593 CV 1
ASSI { 108}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB1 ))
2.800 1.000 1.000 peak 108 spectrum 1 weight 0.11000E+01 volume 0.54124E-02 ppm1 8.526 ppm2 1.997 CV 1
ASSI { 109}
(( segid " " and resid 6 and name HN ))
( segid " " and resid 9 and name HG2%)
4.200 2.200 1.800 peak 109 spectrum 1 weight 0.11000E+01 volume 0.10374E-02 ppm1 8.525 ppm2 0.916 CV 1
ASSI { 111}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 18 and name HD2%)
4.600 2.600 1.400 peak 111 spectrum 1 weight 0.11000E+01 volume 0.48776E-03 ppm1 7.894 ppm2 0.534 CV 1
ASSI { 112}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 47 and name HD2%)
5.600 5.600 0.400 peak 112 spectrum 1 weight 0.11000E+01 volume 0.22656E-03 ppm1 7.887 ppm2 0.264 CV 1
ASSI { 113}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HA ))
3.000 1.100 1.100 peak 113 spectrum 1 weight 0.11000E+01 volume 0.14878E-02 ppm1 7.894 ppm2 4.649 CV 1
ASSI { 114}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 21 and name HA ))
3.700 1.700 1.700 peak 114 spectrum 1 weight 0.11000E+01 volume 0.20137E-02 ppm1 7.892 ppm2 4.391 CV 1
ASSI { 115}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA2 ))
3.300 1.400 1.400 peak 115 spectrum 1 weight 0.11000E+01 volume 0.19913E-02 ppm1 7.893 ppm2 4.111 CV 1
ASSI { 116}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA1 ))
2.900 1.100 1.100 peak 116 spectrum 1 weight 0.11000E+01 volume 0.32304E-02 ppm1 7.894 ppm2 3.491 CV 1
ASSI { 117}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HB1 ))
3.400 1.400 1.400 peak 117 spectrum 1 weight 0.11000E+01 volume 0.32098E-02 ppm1 7.893 ppm2 2.777 CV 1
ASSI { 118}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 21 and name HG1 ))
4.600 2.600 1.400 peak 118 spectrum 1 weight 0.11000E+01 volume 0.53529E-03 ppm1 7.894 ppm2 2.556 CV 1
ASSI { 119}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 21 and name HB1 ))
4.700 2.800 1.300 peak 119 spectrum 1 weight 0.11000E+01 volume 0.49692E-03 ppm1 7.891 ppm2 2.353 CV 1
ASSI { 120}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 18 and name HB2 ))
5.400 3.600 0.600 peak 120 spectrum 1 weight 0.11000E+01 volume 0.33598E-03 ppm1 7.893 ppm2 1.911 CV 1
ASSI { 122}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HG12))
6.000 5.200 0.000 peak 122 spectrum 1 weight 0.11000E+01 volume 0.78921E-04 ppm1 7.890 ppm2 1.195 CV 1
ASSI { 123}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 24 and name HG2%)
3.900 3.900 2.100 peak 123 spectrum 1 weight 0.11000E+01 volume 0.73604E-03 ppm1 7.895 ppm2 0.812 CV 1
ASSI { 124}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HA ))
5.200 3.400 0.800 peak 124 spectrum 1 weight 0.11000E+01 volume 0.24586E-03 ppm1 8.389 ppm2 4.288 CV 1
ASSI { 128}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB2 ))
2.300 0.700 0.700 peak 128 spectrum 1 weight 0.11000E+01 volume 0.51676E-02 ppm1 8.389 ppm2 1.556 CV 1
ASSI { 129}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HG ))
2.300 0.600 0.600 peak 129 spectrum 1 weight 0.11000E+01 volume 0.48240E-02 ppm1 8.387 ppm2 1.389 CV 1
ASSI { 130}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB1 ))
3.300 1.300 1.300 peak 130 spectrum 1 weight 0.11000E+01 volume 0.35862E-02 ppm1 8.389 ppm2 1.227 CV 1
ASSI { 132}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 47 and name HD2%)
3.800 1.800 1.800 peak 132 spectrum 1 weight 0.11000E+01 volume 0.17572E-02 ppm1 8.389 ppm2 0.277 CV 1
ASSI { 133}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 43 and name HA ))
4.600 2.700 1.400 peak 133 spectrum 1 weight 0.11000E+01 volume 0.25714E-03 ppm1 8.388 ppm2 3.656 CV 1
ASSI { 134}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 18 and name HD1%)
6.000 6.000 0.000 peak 134 spectrum 1 weight 0.11000E+01 volume 0.68793E-04 ppm1 8.388 ppm2 0.535 CV 1
ASSI { 136}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HD1 ))
5.200 3.400 0.800 peak 136 spectrum 1 weight 0.11000E+01 volume 0.15655E-03 ppm1 8.157 ppm2 2.699 CV 1
ASSI { 141}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HG1 ))
3.300 1.400 1.400 peak 141 spectrum 1 weight 0.11000E+01 volume 0.22660E-02 ppm1 8.156 ppm2 0.917 CV 1
ASSI { 142}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 48 and name HD2%)
4.500 2.600 1.500 peak 142 spectrum 1 weight 0.11000E+01 volume 0.44612E-03 ppm1 8.390 ppm2 0.992 CV 1
ASSI { 144}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 30 and name HB1 ))
4.500 2.600 1.500 peak 144 spectrum 1 weight 0.11000E+01 volume 0.46824E-03 ppm1 8.080 ppm2 1.663 CV 1
ASSI { 145}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 43 and name HB% )
4.700 2.800 1.300 peak 145 spectrum 1 weight 0.11000E+01 volume 0.49949E-03 ppm1 8.082 ppm2 1.131 CV 1
ASSI { 146}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 15 and name HD1%)
2.900 2.900 3.100 peak 146 spectrum 1 weight 0.11000E+01 volume 0.80418E-03 ppm1 8.080 ppm2 0.931 CV 1
ASSI { 147}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 33 and name HD2%)
5.700 5.700 0.300 peak 147 spectrum 1 weight 0.11000E+01 volume 0.29122E-03 ppm1 8.082 ppm2 0.545 CV 1
ASSI { 148}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 32 and name HA ))
2.600 0.800 0.800 peak 148 spectrum 1 weight 0.11000E+01 volume 0.43161E-02 ppm1 8.081 ppm2 4.002 CV 1
ASSI { 149}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 43 and name HA ))
6.000 4.600 0.000 peak 149 spectrum 1 weight 0.11000E+01 volume 0.31942E-03 ppm1 8.081 ppm2 3.637 CV 1
ASSI { 150}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HG2 ))
4.000 2.000 2.000 peak 150 spectrum 1 weight 0.11000E+01 volume 0.65785E-03 ppm1 8.081 ppm2 2.484 CV 1
ASSI { 152}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 30 and name HB2 ))
3.900 1.900 1.900 peak 152 spectrum 1 weight 0.11000E+01 volume 0.87384E-03 ppm1 8.081 ppm2 1.901 CV 1
ASSI { 154}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 47 and name HD1%)
3.400 1.400 1.400 peak 154 spectrum 1 weight 0.11000E+01 volume 0.20257E-02 ppm1 8.081 ppm2 0.770 CV 1
ASSI { 155}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 33 and name HD1%)
4.400 2.400 1.600 peak 155 spectrum 1 weight 0.11000E+01 volume 0.43703E-03 ppm1 8.081 ppm2 0.262 CV 1
ASSI { 156}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 33 and name HB1 ))
6.000 4.800 0.000 peak 156 spectrum 1 weight 0.11000E+01 volume 0.26064E-03 ppm1 8.080 ppm2 0.082 CV 1
ASSI { 158}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HA ))
3.600 1.600 1.600 peak 158 spectrum 1 weight 0.11000E+01 volume 0.84566E-03 ppm1 7.985 ppm2 4.234 CV 1
ASSI { 159}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB2 ))
3.600 1.600 1.600 peak 159 spectrum 1 weight 0.11000E+01 volume 0.10542E-02 ppm1 7.983 ppm2 3.826 CV 1
ASSI { 160}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 51 and name HG2 ))
3.800 3.800 2.200 peak 160 spectrum 1 weight 0.11000E+01 volume 0.14832E-03 ppm1 7.983 ppm2 2.395 CV 1
ASSI { 161}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HB2 ))
4.300 2.300 1.700 peak 161 spectrum 1 weight 0.11000E+01 volume 0.89012E-03 ppm1 7.983 ppm2 1.637 CV 1
ASSI { 162}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 52 and name HD1%)
3.200 3.200 2.800 peak 162 spectrum 1 weight 0.11000E+01 volume 0.39880E-03 ppm1 7.985 ppm2 0.863 CV 1
ASSI { 163}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 11 and name HA ))
4.400 2.400 1.600 peak 163 spectrum 1 weight 0.11000E+01 volume 0.23524E-03 ppm1 9.327 ppm2 5.408 CV 1
ASSI { 164}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
2.600 0.900 0.900 peak 164 spectrum 1 weight 0.11000E+01 volume 0.24881E-02 ppm1 9.327 ppm2 4.011 CV 1
ASSI { 165}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HG1 ))
3.000 1.200 1.200 peak 165 spectrum 1 weight 0.11000E+01 volume 0.27604E-02 ppm1 9.328 ppm2 2.521 CV 1
ASSI { 166}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HB2 ))
2.200 0.600 0.600 peak 166 spectrum 1 weight 0.11000E+01 volume 0.47185E-02 ppm1 9.327 ppm2 2.092 CV 1
ASSI { 167}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HB1 ))
3.800 1.800 1.800 peak 167 spectrum 1 weight 0.11000E+01 volume 0.14337E-02 ppm1 9.327 ppm2 1.662 CV 1
ASSI { 168}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 10 and name HB2 ))
6.000 5.800 0.000 peak 168 spectrum 1 weight 0.11000E+01 volume 0.26130E-04 ppm1 9.327 ppm2 1.360 CV 1
ASSI { 169}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 15 and name HD1%)
4.400 4.400 1.600 peak 169 spectrum 1 weight 0.11000E+01 volume 0.75002E-03 ppm1 9.325 ppm2 0.844 CV 1
ASSI { 170}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 33 and name HD2%)
4.800 2.900 1.200 peak 170 spectrum 1 weight 0.11000E+01 volume 0.47554E-03 ppm1 9.328 ppm2 0.549 CV 1
ASSI { 171}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 33 and name HD1%)
5.600 3.900 0.400 peak 171 spectrum 1 weight 0.11000E+01 volume 0.27152E-03 ppm1 9.322 ppm2 0.238 CV 1
ASSI { 172}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 11 and name HB2 ))
5.200 3.400 0.800 peak 172 spectrum 1 weight 0.11000E+01 volume 0.18944E-03 ppm1 9.326 ppm2 3.453 CV 1
ASSI { 173}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 15 and name HA ))
2.900 1.100 1.100 peak 173 spectrum 1 weight 0.11000E+01 volume 0.21512E-02 ppm1 8.325 ppm2 3.892 CV 1
ASSI { 174}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 19 and name HB2 ))
5.400 3.600 0.600 peak 174 spectrum 1 weight 0.11000E+01 volume 0.12537E-03 ppm1 8.328 ppm2 2.913 CV 1
ASSI { 175}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 19 and name HB1 ))
5.200 3.400 0.800 peak 175 spectrum 1 weight 0.11000E+01 volume 0.12884E-03 ppm1 8.329 ppm2 2.753 CV 1
ASSI { 176}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HB2 ))
2.300 0.700 0.700 peak 176 spectrum 1 weight 0.11000E+01 volume 0.72793E-02 ppm1 8.328 ppm2 2.222 CV 1
ASSI { 177}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HB1 ))
2.900 1.000 1.000 peak 177 spectrum 1 weight 0.11000E+01 volume 0.44988E-02 ppm1 8.328 ppm2 1.996 CV 1
ASSI { 178}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HB2 ))
4.500 4.500 1.500 peak 178 spectrum 1 weight 0.11000E+01 volume 0.41921E-03 ppm1 8.329 ppm2 1.669 CV 1
ASSI { 179}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 15 and name HB1 ))
4.700 2.800 1.300 peak 179 spectrum 1 weight 0.11000E+01 volume 0.37583E-03 ppm1 8.328 ppm2 1.508 CV 1
ASSI { 180}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 52 and name HD2%)
3.500 1.500 1.500 peak 180 spectrum 1 weight 0.11000E+01 volume 0.10916E-02 ppm1 8.329 ppm2 0.837 CV 1
ASSI { 181}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 18 and name HD1%)
4.800 4.800 1.200 peak 181 spectrum 1 weight 0.11000E+01 volume 0.42495E-03 ppm1 8.329 ppm2 0.537 CV 1
ASSI { 182}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 33 and name HD1%)
6.000 6.000 0.000 peak 182 spectrum 1 weight 0.11000E+01 volume 0.30275E-04 ppm1 8.329 ppm2 0.261 CV 1
ASSI { 189}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 19 and name HB2 ))
5.300 3.500 0.700 peak 189 spectrum 1 weight 0.11000E+01 volume 0.14259E-03 ppm1 7.880 ppm2 2.931 CV 1
ASSI { 191}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HB2 ))
2.200 0.600 0.600 peak 191 spectrum 1 weight 0.11000E+01 volume 0.56244E-02 ppm1 7.881 ppm2 2.022 CV 1
ASSI { 192}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HG ))
3.800 1.800 1.800 peak 192 spectrum 1 weight 0.11000E+01 volume 0.13640E-02 ppm1 7.882 ppm2 1.676 CV 1
ASSI { 193}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HB1 ))
3.400 1.400 1.400 peak 193 spectrum 1 weight 0.11000E+01 volume 0.17573E-02 ppm1 7.879 ppm2 1.521 CV 1
ASSI { 194}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 33 and name HD2%)
5.000 5.000 1.000 peak 194 spectrum 1 weight 0.11000E+01 volume 0.36226E-03 ppm1 7.882 ppm2 0.543 CV 1
ASSI { 195}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 36 and name HA ))
5.800 4.100 0.200 peak 195 spectrum 1 weight 0.11000E+01 volume 0.14609E-03 ppm1 7.747 ppm2 4.546 CV 1
ASSI { 197}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 32 and name HA ))
3.000 1.100 1.100 peak 197 spectrum 1 weight 0.11000E+01 volume 0.17472E-02 ppm1 7.747 ppm2 3.998 CV 1
ASSI { 198}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 31 and name HA ))
3.800 1.900 1.900 peak 198 spectrum 1 weight 0.11000E+01 volume 0.11429E-02 ppm1 7.747 ppm2 3.881 CV 1
ASSI { 199}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 33 and name HA ))
3.700 1.700 1.700 peak 199 spectrum 1 weight 0.11000E+01 volume 0.85847E-03 ppm1 7.747 ppm2 3.644 CV 1
ASSI { 200}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 46 and name HD2 ))
5.900 4.400 0.100 peak 200 spectrum 1 weight 0.11000E+01 volume 0.61348E-04 ppm1 7.746 ppm2 2.950 CV 1
ASSI { 202}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 31 and name HB2 ))
3.500 3.500 2.500 peak 202 spectrum 1 weight 0.11000E+01 volume 0.25059E-03 ppm1 7.746 ppm2 2.089 CV 1
ASSI { 203}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HB ))
2.700 0.900 0.900 peak 203 spectrum 1 weight 0.11000E+01 volume 0.27056E-02 ppm1 7.748 ppm2 1.805 CV 1
ASSI { 205}
(( segid " " and resid 35 and name HN ))
( segid " " and resid 36 and name HG2%)
3.000 3.000 3.000 peak 205 spectrum 1 weight 0.11000E+01 volume 0.37005E-02 ppm1 7.747 ppm2 0.928 CV 1
ASSI { 207}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 33 and name HB1 ))
6.000 4.700 0.000 peak 207 spectrum 1 weight 0.11000E+01 volume 0.78848E-04 ppm1 7.747 ppm2 0.082 CV 1
ASSI { 208}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 46 and name HD1 ))
6.000 5.300 0.000 peak 208 spectrum 1 weight 0.11000E+01 volume 0.34179E-04 ppm1 7.743 ppm2 3.127 CV 1
ASSI { 210}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
2.600 0.800 0.800 peak 210 spectrum 1 weight 0.11000E+01 volume 0.37773E-02 ppm1 8.645 ppm2 4.074 CV 1
ASSI { 212}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB1 ))
3.500 1.500 1.500 peak 212 spectrum 1 weight 0.11000E+01 volume 0.15007E-02 ppm1 8.645 ppm2 2.299 CV 1
ASSI { 213}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 31 and name HB2 ))
3.500 1.600 1.600 peak 213 spectrum 1 weight 0.11000E+01 volume 0.18878E-02 ppm1 8.648 ppm2 2.086 CV 1
ASSI { 214}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HG ))
3.300 1.300 1.300 peak 214 spectrum 1 weight 0.11000E+01 volume 0.33743E-02 ppm1 8.646 ppm2 1.645 CV 1
ASSI { 216}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 18 and name HD2%)
4.600 4.600 1.400 peak 216 spectrum 1 weight 0.11000E+01 volume 0.59810E-03 ppm1 8.647 ppm2 0.541 CV 1
ASSI { 218}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 25 and name HB2 ))
6.000 4.900 0.000 peak 218 spectrum 1 weight 0.11000E+01 volume 0.86681E-04 ppm1 8.644 ppm2 3.370 CV 1
ASSI { 219}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
3.100 1.200 1.200 peak 219 spectrum 1 weight 0.11000E+01 volume 0.16738E-02 ppm1 8.453 ppm2 4.064 CV 1
ASSI { 221}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HG2 ))
5.700 4.100 0.300 peak 221 spectrum 1 weight 0.11000E+01 volume 0.11558E-03 ppm1 8.454 ppm2 2.488 CV 1
ASSI { 222}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB1 ))
3.400 1.400 1.400 peak 222 spectrum 1 weight 0.11000E+01 volume 0.14582E-02 ppm1 8.454 ppm2 2.297 CV 1
ASSI { 223}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 27 and name HB2 ))
2.800 2.800 3.200 peak 223 spectrum 1 weight 0.11000E+01 volume 0.85080E-03 ppm1 8.454 ppm2 2.087 CV 1
ASSI { 225}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HG ))
2.000 0.500 0.500 peak 225 spectrum 1 weight 0.11000E+01 volume 0.49115E-02 ppm1 8.454 ppm2 1.650 CV 1
ASSI { 226}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 28 and name HB% )
4.300 2.300 1.700 peak 226 spectrum 1 weight 0.11000E+01 volume 0.58183E-03 ppm1 8.455 ppm2 1.336 CV 1
ASSI { 227}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 34 and name HD1%)
3.500 3.500 2.500 peak 227 spectrum 1 weight 0.11000E+01 volume 0.42367E-02 ppm1 8.454 ppm2 0.845 CV 1
ASSI { 228}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 18 and name HD1%)
4.600 2.700 1.400 peak 228 spectrum 1 weight 0.11000E+01 volume 0.79741E-03 ppm1 8.454 ppm2 0.542 CV 1
ASSI { 229}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 33 and name HD1%)
5.600 3.900 0.400 peak 229 spectrum 1 weight 0.11000E+01 volume 0.94036E-04 ppm1 8.456 ppm2 0.261 CV 1
ASSI { 232}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HA ))
3.900 1.900 1.900 peak 232 spectrum 1 weight 0.11000E+01 volume 0.12757E-02 ppm1 7.967 ppm2 4.179 CV 1
ASSI { 236}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB ))
3.500 1.500 1.500 peak 236 spectrum 1 weight 0.11000E+01 volume 0.12719E-02 ppm1 7.966 ppm2 1.712 CV 1
ASSI { 237}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 42 and name HB% )
4.200 2.200 1.800 peak 237 spectrum 1 weight 0.11000E+01 volume 0.93125E-03 ppm1 7.966 ppm2 1.387 CV 1
ASSI { 240}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 44 and name HG11))
5.400 3.600 0.600 peak 240 spectrum 1 weight 0.11000E+01 volume 0.88174E-04 ppm1 7.965 ppm2 0.258 CV 1
ASSI { 242}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 31 and name HG2 ))
6.000 6.000 0.000 peak 242 spectrum 1 weight 0.11000E+01 volume 0.29912E-04 ppm1 8.662 ppm2 2.490 CV 1
ASSI { 243}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HB ))
2.400 0.700 0.700 peak 243 spectrum 1 weight 0.11000E+01 volume 0.54318E-02 ppm1 8.661 ppm2 1.800 CV 1
ASSI { 244}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HB2 ))
3.000 1.100 1.100 peak 244 spectrum 1 weight 0.11000E+01 volume 0.18530E-02 ppm1 8.662 ppm2 1.503 CV 1
ASSI { 245}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HG11))
2.400 0.700 0.700 peak 245 spectrum 1 weight 0.11000E+01 volume 0.28326E-02 ppm1 8.662 ppm2 1.083 CV 1
ASSI { 247}
(( segid " " and resid 34 and name HN ))
( segid " " and resid 33 and name HD1%)
4.500 2.500 1.500 peak 247 spectrum 1 weight 0.11000E+01 volume 0.75092E-03 ppm1 8.662 ppm2 0.234 CV 1
ASSI { 248}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HB1 ))
3.900 1.900 1.900 peak 248 spectrum 1 weight 0.11000E+01 volume 0.60821E-03 ppm1 8.662 ppm2 0.079 CV 1
ASSI { 249}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 31 and name HA ))
2.800 1.000 1.000 peak 249 spectrum 1 weight 0.11000E+01 volume 0.31725E-02 ppm1 8.661 ppm2 3.894 CV 1
ASSI { 250}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HG12))
2.800 0.900 0.900 peak 250 spectrum 1 weight 0.11000E+01 volume 0.56447E-02 ppm1 8.661 ppm2 1.896 CV 1
ASSI { 251}
(( segid " " and resid 34 and name HN ))
( segid " " and resid 33 and name HD2%)
4.600 2.700 1.400 peak 251 spectrum 1 weight 0.11000E+01 volume 0.61303E-03 ppm1 8.658 ppm2 0.546 CV 1
ASSI { 252}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HB2 ))
5.000 3.200 1.000 peak 252 spectrum 1 weight 0.11000E+01 volume 0.28279E-03 ppm1 8.788 ppm2 2.916 CV 1
ASSI { 253}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 40 and name HG12))
4.800 2.800 1.200 peak 253 spectrum 1 weight 0.11000E+01 volume 0.36224E-03 ppm1 8.788 ppm2 1.364 CV 1
ASSI { 254}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HA ))
5.100 3.200 0.900 peak 254 spectrum 1 weight 0.11000E+01 volume 0.36881E-03 ppm1 8.785 ppm2 4.381 CV 1
ASSI { 255}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HA ))
2.200 0.600 0.600 peak 255 spectrum 1 weight 0.11000E+01 volume 0.47311E-02 ppm1 8.786 ppm2 4.152 CV 1
ASSI { 256}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HB1 ))
4.200 2.200 1.800 peak 256 spectrum 1 weight 0.11000E+01 volume 0.94554E-03 ppm1 8.784 ppm2 2.767 CV 1
ASSI { 257}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 29 and name HB1 ))
3.100 3.100 2.900 peak 257 spectrum 1 weight 0.11000E+01 volume 0.35032E-02 ppm1 8.785 ppm2 2.248 CV 1
ASSI { 258}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HG ))
2.200 0.600 0.600 peak 258 spectrum 1 weight 0.11000E+01 volume 0.59495E-02 ppm1 8.786 ppm2 1.765 CV 1
ASSI { 259}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 40 and name HG11))
6.000 6.000 0.000 peak 259 spectrum 1 weight 0.11000E+01 volume 0.12121E-04 ppm1 8.785 ppm2 1.178 CV 1
ASSI { 261}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 33 and name HD1%)
4.700 4.700 1.300 peak 261 spectrum 1 weight 0.11000E+01 volume 0.25893E-03 ppm1 8.784 ppm2 0.260 CV 1
ASSI { 264}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HA ))
4.200 2.200 1.800 peak 264 spectrum 1 weight 0.11000E+01 volume 0.15670E-03 ppm1 7.411 ppm2 3.914 CV 1
ASSI { 265}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HA ))
2.600 0.800 0.800 peak 265 spectrum 1 weight 0.11000E+01 volume 0.43973E-02 ppm1 6.878 ppm2 4.561 CV 1
ASSI { 267}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 36 and name HG1 ))
2.800 1.000 1.000 peak 267 spectrum 1 weight 0.11000E+01 volume 0.22410E-02 ppm1 6.879 ppm2 3.865 CV 1
ASSI { 268}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 33 and name HA ))
4.200 2.200 1.800 peak 268 spectrum 1 weight 0.11000E+01 volume 0.54913E-03 ppm1 6.878 ppm2 3.626 CV 1
ASSI { 269}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB2 ))
2.500 0.800 0.800 peak 269 spectrum 1 weight 0.11000E+01 volume 0.50544E-02 ppm1 6.878 ppm2 2.852 CV 1
ASSI { 270}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB1 ))
2.300 0.700 0.700 peak 270 spectrum 1 weight 0.11000E+01 volume 0.82636E-02 ppm1 6.878 ppm2 2.628 CV 1
ASSI { 272}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 33 and name HB2 ))
5.500 3.800 0.500 peak 272 spectrum 1 weight 0.11000E+01 volume 0.29348E-03 ppm1 6.874 ppm2 1.529 CV 1
ASSI { 273}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 40 and name HG11))
5.100 5.100 0.900 peak 273 spectrum 1 weight 0.11000E+01 volume 0.25521E-03 ppm1 6.878 ppm2 1.136 CV 1
ASSI { 274}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 36 and name HG2%)
4.300 2.300 1.700 peak 274 spectrum 1 weight 0.11000E+01 volume 0.88228E-03 ppm1 6.879 ppm2 0.981 CV 1
ASSI { 276}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 33 and name HD2%)
6.000 6.000 0.000 peak 276 spectrum 1 weight 0.11000E+01 volume 0.23113E-04 ppm1 6.880 ppm2 0.544 CV 1
ASSI { 277}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 33 and name HD1%)
4.800 4.800 1.200 peak 277 spectrum 1 weight 0.11000E+01 volume 0.54242E-03 ppm1 6.879 ppm2 0.234 CV 1
ASSI { 278}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 33 and name HB1 ))
6.000 4.700 0.000 peak 278 spectrum 1 weight 0.11000E+01 volume 0.82686E-04 ppm1 6.878 ppm2 0.076 CV 1
ASSI { 279}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA ))
2.500 0.800 0.800 peak 279 spectrum 1 weight 0.11000E+01 volume 0.43997E-02 ppm1 8.776 ppm2 3.889 CV 1
ASSI { 280}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 11 and name HB2 ))
5.000 3.200 1.000 peak 280 spectrum 1 weight 0.11000E+01 volume 0.27117E-03 ppm1 8.777 ppm2 3.458 CV 1
ASSI { 281}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HG1 ))
3.900 1.900 1.900 peak 281 spectrum 1 weight 0.11000E+01 volume 0.11613E-02 ppm1 8.779 ppm2 2.497 CV 1
ASSI { 282}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HB2 ))
2.200 0.600 0.600 peak 282 spectrum 1 weight 0.11000E+01 volume 0.62038E-02 ppm1 8.778 ppm2 2.012 CV 1
ASSI { 283}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HB1 ))
3.000 1.100 1.100 peak 283 spectrum 1 weight 0.11000E+01 volume 0.54864E-02 ppm1 8.778 ppm2 1.523 CV 1
ASSI { 286}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HA ))
3.400 1.400 1.400 peak 286 spectrum 1 weight 0.11000E+01 volume 0.13468E-02 ppm1 8.424 ppm2 3.938 CV 1
ASSI { 287}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 46 and name HB2 ))
2.200 2.200 3.800 peak 287 spectrum 1 weight 0.11000E+01 volume 0.35178E-02 ppm1 8.423 ppm2 1.878 CV 1
ASSI { 288}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HG ))
3.700 1.700 1.700 peak 288 spectrum 1 weight 0.11000E+01 volume 0.19698E-02 ppm1 8.424 ppm2 1.397 CV 1
ASSI { 291}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 47 and name HD2%)
3.200 3.200 2.800 peak 291 spectrum 1 weight 0.11000E+01 volume 0.39136E-03 ppm1 8.424 ppm2 0.281 CV 1
ASSI { 292}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HB1 ))
3.600 1.700 1.700 peak 292 spectrum 1 weight 0.11000E+01 volume 0.24439E-02 ppm1 8.422 ppm2 1.541 CV 1
ASSI { 293}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HB1 ))
4.500 2.500 1.500 peak 293 spectrum 1 weight 0.11000E+01 volume 0.50679E-03 ppm1 8.422 ppm2 1.223 CV 1
ASSI { 295}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 41 and name HA ))
3.700 1.700 1.700 peak 295 spectrum 1 weight 0.11000E+01 volume 0.89179E-03 ppm1 8.279 ppm2 4.344 CV 1
ASSI { 296}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 42 and name HA ))
5.100 3.200 0.900 peak 296 spectrum 1 weight 0.11000E+01 volume 0.10572E-03 ppm1 8.277 ppm2 4.173 CV 1
ASSI { 297}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HA ))
3.400 1.400 1.400 peak 297 spectrum 1 weight 0.11000E+01 volume 0.75052E-03 ppm1 8.278 ppm2 3.636 CV 1
ASSI { 299}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 41 and name HB2 ))
3.400 3.400 2.600 peak 299 spectrum 1 weight 0.11000E+01 volume 0.28374E-03 ppm1 8.278 ppm2 2.871 CV 1
ASSI { 300}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 45 and name HG2 ))
6.000 6.000 0.000 peak 300 spectrum 1 weight 0.11000E+01 volume 0.26549E-04 ppm1 8.277 ppm2 2.399 CV 1
ASSI { 302}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 45 and name HB1 ))
5.300 3.500 0.700 peak 302 spectrum 1 weight 0.11000E+01 volume 0.29332E-03 ppm1 8.277 ppm2 2.045 CV 1
ASSI { 303}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 42 and name HB% )
4.200 2.200 1.800 peak 303 spectrum 1 weight 0.11000E+01 volume 0.61060E-03 ppm1 8.278 ppm2 1.379 CV 1
ASSI { 305}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 44 and name HG2%)
3.300 1.300 1.300 peak 305 spectrum 1 weight 0.11000E+01 volume 0.53015E-02 ppm1 8.279 ppm2 0.822 CV 1
ASSI { 306}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 18 and name HD2%)
4.300 2.300 1.700 peak 306 spectrum 1 weight 0.11000E+01 volume 0.81274E-03 ppm1 8.273 ppm2 0.527 CV 1
ASSI { 307}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HG11))
2.300 0.600 0.600 peak 307 spectrum 1 weight 0.11000E+01 volume 0.23970E-02 ppm1 8.279 ppm2 0.310 CV 1
ASSI { 309}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA ))
3.100 1.200 1.200 peak 309 spectrum 1 weight 0.11000E+01 volume 0.22396E-02 ppm1 7.672 ppm2 4.207 CV 1
ASSI { 310}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HB2 ))
3.400 1.400 1.400 peak 310 spectrum 1 weight 0.11000E+01 volume 0.31055E-02 ppm1 7.673 ppm2 4.093 CV 1
ASSI { 312}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HG2 ))
2.600 0.900 0.900 peak 312 spectrum 1 weight 0.11000E+01 volume 0.25700E-02 ppm1 7.673 ppm2 2.893 CV 1
ASSI { 313}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HG1 ))
2.600 0.800 0.800 peak 313 spectrum 1 weight 0.11000E+01 volume 0.39968E-02 ppm1 7.673 ppm2 2.569 CV 1
ASSI { 314}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HB1 ))
3.500 1.500 1.500 peak 314 spectrum 1 weight 0.11000E+01 volume 0.24542E-02 ppm1 7.673 ppm2 2.352 CV 1
ASSI { 315}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 21 and name HE% )
4.800 2.800 1.200 peak 315 spectrum 1 weight 0.11000E+01 volume 0.50364E-03 ppm1 7.674 ppm2 2.149 CV 1
ASSI { 316}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 24 and name HD1%)
5.000 5.000 1.000 peak 316 spectrum 1 weight 0.11000E+01 volume 0.24004E-03 ppm1 7.673 ppm2 0.822 CV 1
ASSI { 317}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 18 and name HD1%)
5.800 5.800 0.200 peak 317 spectrum 1 weight 0.11000E+01 volume 0.21874E-03 ppm1 7.674 ppm2 0.533 CV 1
ASSI { 318}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 11 and name HA ))
4.600 2.600 1.400 peak 318 spectrum 1 weight 0.11000E+01 volume 0.15293E-03 ppm1 9.072 ppm2 5.411 CV 1
ASSI { 320}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HA ))
3.100 1.200 1.200 peak 320 spectrum 1 weight 0.11000E+01 volume 0.17315E-02 ppm1 9.069 ppm2 3.918 CV 1
ASSI { 321}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HB2 ))
3.400 1.400 1.400 peak 321 spectrum 1 weight 0.11000E+01 volume 0.37783E-02 ppm1 9.072 ppm2 2.419 CV 1
ASSI { 323}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 14 and name HB1 ))
6.000 4.700 0.000 peak 323 spectrum 1 weight 0.11000E+01 volume 0.14786E-03 ppm1 9.072 ppm2 1.667 CV 1
ASSI { 324}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 9 and name HG1%)
3.300 3.300 2.700 peak 324 spectrum 1 weight 0.11000E+01 volume 0.34878E-03 ppm1 9.071 ppm2 0.914 CV 1
ASSI { 326}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
2.700 0.900 0.900 peak 326 spectrum 1 weight 0.11000E+01 volume 0.22653E-02 ppm1 7.952 ppm2 4.138 CV 1
ASSI { 327}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 15 and name HA ))
3.800 1.800 1.800 peak 327 spectrum 1 weight 0.11000E+01 volume 0.43871E-03 ppm1 7.952 ppm2 3.872 CV 1
ASSI { 328}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 23 and name HB2 ))
6.000 5.800 0.000 peak 328 spectrum 1 weight 0.11000E+01 volume 0.47388E-04 ppm1 7.954 ppm2 3.493 CV 1
ASSI { 329}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 17 and name HG2 ))
5.800 4.100 0.200 peak 329 spectrum 1 weight 0.11000E+01 volume 0.11966E-03 ppm1 7.952 ppm2 2.500 CV 1
ASSI { 330}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 16 and name HB2 ))
4.300 2.300 1.700 peak 330 spectrum 1 weight 0.11000E+01 volume 0.67711E-03 ppm1 7.952 ppm2 2.223 CV 1
ASSI { 332}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HB1 ))
3.600 1.600 1.600 peak 332 spectrum 1 weight 0.11000E+01 volume 0.10313E-02 ppm1 7.951 ppm2 1.520 CV 1
ASSI { 333}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 24 and name HD1%)
4.500 4.500 1.500 peak 333 spectrum 1 weight 0.11000E+01 volume 0.47577E-03 ppm1 7.951 ppm2 0.830 CV 1
ASSI { 334}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 18 and name HD1%)
4.300 2.300 1.700 peak 334 spectrum 1 weight 0.11000E+01 volume 0.92773E-03 ppm1 7.952 ppm2 0.535 CV 1
ASSI { 335}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HG ))
3.800 1.800 1.800 peak 335 spectrum 1 weight 0.11000E+01 volume 0.11789E-02 ppm1 7.950 ppm2 1.771 CV 1
ASSI { 337}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HA ))
3.200 1.300 1.300 peak 337 spectrum 1 weight 0.11000E+01 volume 0.16176E-02 ppm1 7.495 ppm2 3.914 CV 1
ASSI { 339}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 44 and name HA ))
3.800 1.800 1.800 peak 339 spectrum 1 weight 0.11000E+01 volume 0.50391E-03 ppm1 7.494 ppm2 2.966 CV 1
ASSI { 341}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HG1 ))
3.800 1.800 1.800 peak 341 spectrum 1 weight 0.11000E+01 volume 0.10322E-02 ppm1 7.493 ppm2 2.181 CV 1
ASSI { 342}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HB1 ))
3.000 1.200 1.200 peak 342 spectrum 1 weight 0.11000E+01 volume 0.31275E-02 ppm1 7.495 ppm2 2.045 CV 1
ASSI { 344}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HG2 ))
3.500 1.600 1.600 peak 344 spectrum 1 weight 0.11000E+01 volume 0.24112E-02 ppm1 7.495 ppm2 1.681 CV 1
ASSI { 345}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HG1 ))
2.800 1.000 1.000 peak 345 spectrum 1 weight 0.11000E+01 volume 0.21698E-02 ppm1 7.495 ppm2 1.540 CV 1
ASSI { 348}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 36 and name HG2%)
4.200 2.200 1.800 peak 348 spectrum 1 weight 0.11000E+01 volume 0.55152E-03 ppm1 7.495 ppm2 0.977 CV 1
ASSI { 349}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 44 and name HG2%)
4.600 2.600 1.400 peak 349 spectrum 1 weight 0.11000E+01 volume 0.43121E-03 ppm1 7.494 ppm2 0.803 CV 1
ASSI { 350}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 44 and name HG11))
3.500 3.500 2.500 peak 350 spectrum 1 weight 0.11000E+01 volume 0.23373E-03 ppm1 7.494 ppm2 0.276 CV 1
ASSI { 351}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HA ))
3.000 1.100 1.100 peak 351 spectrum 1 weight 0.11000E+01 volume 0.21436E-02 ppm1 8.094 ppm2 4.001 CV 1
ASSI { 352}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 29 and name HA ))
3.500 1.500 1.500 peak 352 spectrum 1 weight 0.11000E+01 volume 0.98536E-03 ppm1 8.091 ppm2 4.114 CV 1
ASSI { 353}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HG2 ))
5.700 4.100 0.300 peak 353 spectrum 1 weight 0.11000E+01 volume 0.99293E-04 ppm1 8.087 ppm2 2.500 CV 1
ASSI { 354}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HB2 ))
4.900 3.000 1.100 peak 354 spectrum 1 weight 0.11000E+01 volume 0.30777E-03 ppm1 8.094 ppm2 2.092 CV 1
ASSI { 355}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 34 and name HG12))
4.600 2.600 1.400 peak 355 spectrum 1 weight 0.11000E+01 volume 0.60279E-03 ppm1 8.093 ppm2 1.900 CV 1
ASSI { 356}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 34 and name HB ))
4.500 2.500 1.500 peak 356 spectrum 1 weight 0.11000E+01 volume 0.70466E-03 ppm1 8.093 ppm2 1.820 CV 1
ASSI { 357}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB2 ))
2.100 0.600 0.600 peak 357 spectrum 1 weight 0.11000E+01 volume 0.44371E-02 ppm1 8.095 ppm2 1.534 CV 1
ASSI { 358}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HG ))
2.700 0.900 0.900 peak 358 spectrum 1 weight 0.11000E+01 volume 0.49755E-02 ppm1 8.095 ppm2 1.366 CV 1
ASSI { 360}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 36 and name HG2%)
3.900 1.900 1.900 peak 360 spectrum 1 weight 0.11000E+01 volume 0.85134E-03 ppm1 8.090 ppm2 0.945 CV 1
ASSI { 361}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 33 and name HD2%)
4.000 2.000 2.000 peak 361 spectrum 1 weight 0.11000E+01 volume 0.18160E-02 ppm1 8.095 ppm2 0.548 CV 1
ASSI { 362}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 33 and name HD1%)
3.100 1.200 1.200 peak 362 spectrum 1 weight 0.11000E+01 volume 0.14860E-02 ppm1 8.095 ppm2 0.240 CV 1
ASSI { 363}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB1 ))
3.600 1.600 1.600 peak 363 spectrum 1 weight 0.11000E+01 volume 0.19425E-02 ppm1 8.095 ppm2 0.081 CV 1
ASSI { 367}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 28 and name HB% )
5.100 3.300 0.900 peak 367 spectrum 1 weight 0.11000E+01 volume 0.31722E-03 ppm1 8.321 ppm2 1.318 CV 1
ASSI { 368}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 30 and name HD1%)
5.900 4.300 0.100 peak 368 spectrum 1 weight 0.11000E+01 volume 0.10903E-03 ppm1 8.321 ppm2 0.943 CV 1
ASSI { 369}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 25 and name HA ))
4.700 2.800 1.300 peak 369 spectrum 1 weight 0.11000E+01 volume 0.17708E-03 ppm1 8.320 ppm2 4.807 CV 1
ASSI { 371}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HG2 ))
3.900 1.900 1.900 peak 371 spectrum 1 weight 0.11000E+01 volume 0.17122E-02 ppm1 8.319 ppm2 1.763 CV 1
ASSI { 372}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 30 and name HG ))
3.300 3.300 2.700 peak 372 spectrum 1 weight 0.11000E+01 volume 0.13245E-02 ppm1 8.318 ppm2 1.634 CV 1
ASSI { 373}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HA ))
3.000 1.100 1.100 peak 373 spectrum 1 weight 0.11000E+01 volume 0.25414E-02 ppm1 8.345 ppm2 4.385 CV 1
ASSI { 374}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HA ))
2.800 1.000 1.000 peak 374 spectrum 1 weight 0.11000E+01 volume 0.36372E-02 ppm1 8.343 ppm2 4.239 CV 1
ASSI { 375}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HB1 ))
2.100 0.600 0.600 peak 375 spectrum 1 weight 0.11000E+01 volume 0.11299E-01 ppm1 8.343 ppm2 4.074 CV 1
ASSI { 376}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HB2 ))
3.300 1.400 1.400 peak 376 spectrum 1 weight 0.11000E+01 volume 0.26418E-02 ppm1 8.345 ppm2 2.919 CV 1
ASSI { 377}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HB1 ))
2.500 0.800 0.800 peak 377 spectrum 1 weight 0.11000E+01 volume 0.33826E-02 ppm1 8.345 ppm2 2.769 CV 1
ASSI { 378}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 21 and name HB2 ))
4.500 2.500 1.500 peak 378 spectrum 1 weight 0.11000E+01 volume 0.72233E-03 ppm1 8.343 ppm2 2.516 CV 1
ASSI { 379}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 16 and name HB2 ))
2.700 2.700 3.300 peak 379 spectrum 1 weight 0.11000E+01 volume 0.11604E-02 ppm1 8.343 ppm2 2.200 CV 1
ASSI { 380}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 24 and name HD1%)
4.700 4.700 1.300 peak 380 spectrum 1 weight 0.11000E+01 volume 0.28956E-03 ppm1 8.344 ppm2 0.825 CV 1
ASSI { 381}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 18 and name HD1%)
5.800 5.800 0.200 peak 381 spectrum 1 weight 0.11000E+01 volume 0.18185E-03 ppm1 8.344 ppm2 0.537 CV 1
ASSI { 383}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 22 and name HA1 ))
6.000 6.000 0.000 peak 383 spectrum 1 weight 0.11000E+01 volume 0.77487E-04 ppm1 8.341 ppm2 3.492 CV 1
ASSI { 384}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 18 and name HB1 ))
5.300 3.500 0.700 peak 384 spectrum 1 weight 0.11000E+01 volume 0.16783E-03 ppm1 8.342 ppm2 1.516 CV 1
ASSI { 385}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 42 and name HA ))
3.200 1.300 1.300 peak 385 spectrum 1 weight 0.11000E+01 volume 0.12724E-02 ppm1 7.259 ppm2 4.174 CV 1
ASSI { 386}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HA ))
4.300 2.300 1.700 peak 386 spectrum 1 weight 0.11000E+01 volume 0.80120E-03 ppm1 7.257 ppm2 4.065 CV 1
ASSI { 390}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HG1 ))
3.000 1.100 1.100 peak 390 spectrum 1 weight 0.11000E+01 volume 0.34697E-02 ppm1 7.257 ppm2 2.194 CV 1
ASSI { 391}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB1 ))
2.700 0.900 0.900 peak 391 spectrum 1 weight 0.11000E+01 volume 0.67079E-02 ppm1 7.238 ppm2 2.047 CV 1
ASSI { 392}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB ))
2.800 1.000 1.000 peak 392 spectrum 1 weight 0.11000E+01 volume 0.25036E-02 ppm1 7.258 ppm2 1.766 CV 1
ASSI { 393}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HG12))
4.500 2.500 1.500 peak 393 spectrum 1 weight 0.11000E+01 volume 0.93210E-03 ppm1 7.258 ppm2 1.575 CV 1
ASSI { 394}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 47 and name HG ))
4.600 2.600 1.400 peak 394 spectrum 1 weight 0.11000E+01 volume 0.50995E-03 ppm1 7.258 ppm2 1.390 CV 1
ASSI { 396}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HG11))
4.200 2.200 1.800 peak 396 spectrum 1 weight 0.11000E+01 volume 0.50296E-03 ppm1 7.258 ppm2 0.306 CV 1
ASSI { 397}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 43 and name HA ))
4.600 2.600 1.400 peak 397 spectrum 1 weight 0.11000E+01 volume 0.20308E-03 ppm1 7.257 ppm2 3.644 CV 1
ASSI { 399}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 18 and name HD2%)
6.000 6.000 0.000 peak 399 spectrum 1 weight 0.11000E+01 volume 0.24525E-04 ppm1 7.253 ppm2 0.539 CV 1
ASSI { 400}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 29 and name HB2 ))
6.000 5.700 0.000 peak 400 spectrum 1 weight 0.11000E+01 volume 0.41380E-04 ppm1 7.929 ppm2 2.979 CV 1
ASSI { 401}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 28 and name HA ))
2.800 1.000 1.000 peak 401 spectrum 1 weight 0.11000E+01 volume 0.30473E-02 ppm1 7.925 ppm2 3.997 CV 1
ASSI { 402}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HA ))
2.500 0.800 0.800 peak 402 spectrum 1 weight 0.11000E+01 volume 0.34694E-02 ppm1 7.924 ppm2 3.893 CV 1
ASSI { 404}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 29 and name HB1 ))
4.500 2.500 1.500 peak 404 spectrum 1 weight 0.11000E+01 volume 0.62191E-03 ppm1 7.926 ppm2 2.307 CV 1
ASSI { 405}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HB1 ))
2.700 0.900 0.900 peak 405 spectrum 1 weight 0.11000E+01 volume 0.51207E-02 ppm1 7.925 ppm2 2.087 CV 1
ASSI { 407}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB1 ))
3.400 1.400 1.400 peak 407 spectrum 1 weight 0.11000E+01 volume 0.18606E-02 ppm1 7.925 ppm2 1.655 CV 1
ASSI { 408}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 32 and name HB% )
4.100 2.100 1.900 peak 408 spectrum 1 weight 0.11000E+01 volume 0.87935E-03 ppm1 7.926 ppm2 1.352 CV 1
ASSI { 410}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 33 and name HD1%)
6.000 6.000 0.000 peak 410 spectrum 1 weight 0.11000E+01 volume 0.53227E-06 ppm1 7.928 ppm2 0.261 CV 1
ASSI { 411}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HA ))
4.800 2.900 1.200 peak 411 spectrum 1 weight 0.11000E+01 volume 0.44002E-03 ppm1 7.789 ppm2 4.815 CV 1
ASSI { 413}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HA ))
3.000 1.100 1.100 peak 413 spectrum 1 weight 0.11000E+01 volume 0.14164E-02 ppm1 7.788 ppm2 4.448 CV 1
ASSI { 414}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HA1 ))
4.300 2.300 1.700 peak 414 spectrum 1 weight 0.11000E+01 volume 0.64063E-03 ppm1 7.789 ppm2 3.492 CV 1
ASSI { 415}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HB1 ))
3.900 1.900 1.900 peak 415 spectrum 1 weight 0.11000E+01 volume 0.49813E-03 ppm1 7.787 ppm2 2.772 CV 1
ASSI { 416}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HB1 ))
5.000 3.200 1.000 peak 416 spectrum 1 weight 0.11000E+01 volume 0.52830E-03 ppm1 7.788 ppm2 2.636 CV 1
ASSI { 418}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HG12))
2.200 0.600 0.600 peak 418 spectrum 1 weight 0.11000E+01 volume 0.40282E-02 ppm1 7.787 ppm2 1.163 CV 1
ASSI { 420}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 6 and name HB2 ))
4.400 2.400 1.600 peak 420 spectrum 1 weight 0.11000E+01 volume 0.45169E-03 ppm1 8.119 ppm2 2.209 CV 1
ASSI { 422}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HA1 ))
2.500 0.800 0.800 peak 422 spectrum 1 weight 0.11000E+01 volume 0.71976E-02 ppm1 8.021 ppm2 3.915 CV 1
ASSI { 423}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HG1 ))
6.000 6.000 0.000 peak 423 spectrum 1 weight 0.11000E+01 volume 0.72743E-05 ppm1 8.020 ppm2 2.397 CV 1
ASSI { 424}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HB1 ))
5.000 3.100 1.000 peak 424 spectrum 1 weight 0.11000E+01 volume 0.21845E-03 ppm1 8.021 ppm2 2.001 CV 1
ASSI { 425}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 48 and name HB2 ))
3.900 1.900 1.900 peak 425 spectrum 1 weight 0.11000E+01 volume 0.13694E-03 ppm1 8.021 ppm2 1.866 CV 1
ASSI { 426}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 48 and name HB1 ))
3.600 3.600 2.400 peak 426 spectrum 1 weight 0.11000E+01 volume 0.20980E-03 ppm1 8.025 ppm2 1.541 CV 1
ASSI { 427}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 48 and name HD1%)
3.600 3.600 2.400 peak 427 spectrum 1 weight 0.11000E+01 volume 0.21697E-03 ppm1 8.021 ppm2 0.883 CV 1
ASSI { 429}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 9 and name HB ))
5.300 3.500 0.700 peak 429 spectrum 1 weight 0.11000E+01 volume 0.21178E-04 ppm1 8.244 ppm2 2.115 CV 1
ASSI { 430}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HB2 ))
3.800 1.800 1.800 peak 430 spectrum 1 weight 0.11000E+01 volume 0.20621E-03 ppm1 8.244 ppm2 1.364 CV 1
ASSI { 431}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HB1 ))
4.600 2.700 1.400 peak 431 spectrum 1 weight 0.11000E+01 volume 0.52794E-03 ppm1 8.245 ppm2 1.096 CV 1
ASSI { 432}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 9 and name HG1%)
2.900 2.900 3.100 peak 432 spectrum 1 weight 0.11000E+01 volume 0.83308E-03 ppm1 8.242 ppm2 0.933 CV 1
ASSI { 433}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HA ))
3.300 1.400 1.400 peak 433 spectrum 1 weight 0.11000E+01 volume 0.56086E-03 ppm1 8.239 ppm2 5.412 CV 1
ASSI { 434}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA ))
3.900 1.900 1.900 peak 434 spectrum 1 weight 0.11000E+01 volume 0.63373E-03 ppm1 8.240 ppm2 3.910 CV 1
ASSI { 436}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 6 and name HA ))
6.000 6.000 0.000 peak 436 spectrum 1 weight 0.11000E+01 volume 0.11073E-04 ppm1 8.118 ppm2 4.718 CV 1
ASSI { 438}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 3 and name HA ))
5.000 3.100 1.000 peak 438 spectrum 1 weight 0.11000E+01 volume 0.26149E-03 ppm1 8.119 ppm2 4.296 CV 1
ASSI { 439}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA2 ))
2.400 0.700 0.700 peak 439 spectrum 1 weight 0.11000E+01 volume 0.11507E-01 ppm1 8.119 ppm2 3.905 CV 1
ASSI { 440}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 6 and name HG2 ))
4.300 2.300 1.700 peak 440 spectrum 1 weight 0.11000E+01 volume 0.36924E-03 ppm1 8.118 ppm2 2.677 CV 1
ASSI { 442}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 6 and name HB1 ))
3.900 1.900 1.900 peak 442 spectrum 1 weight 0.11000E+01 volume 0.85883E-03 ppm1 8.118 ppm2 1.960 CV 1
ASSI { 443}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 3 and name HB2 ))
4.300 2.400 1.700 peak 443 spectrum 1 weight 0.11000E+01 volume 0.30326E-03 ppm1 8.119 ppm2 1.632 CV 1
ASSI { 444}
(( segid " " and resid 5 and name HN ))
( segid " " and resid 3 and name HD1%)
2.900 2.900 3.100 peak 444 spectrum 1 weight 0.11000E+01 volume 0.78600E-03 ppm1 8.119 ppm2 0.906 CV 1
ASSI { 451}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HA ))
3.200 1.200 1.200 peak 451 spectrum 1 weight 0.11000E+01 volume 0.19552E-02 ppm1 7.708 ppm2 4.546 CV 1
ASSI { 452}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HA2 ))
2.000 0.500 0.500 peak 452 spectrum 1 weight 0.11000E+01 volume 0.12583E-01 ppm1 7.708 ppm2 4.008 CV 1
ASSI { 453}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 34 and name HA ))
3.000 1.100 1.100 peak 453 spectrum 1 weight 0.11000E+01 volume 0.18217E-02 ppm1 7.708 ppm2 3.641 CV 1
ASSI { 454}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 35 and name HB% )
4.400 2.500 1.600 peak 454 spectrum 1 weight 0.11000E+01 volume 0.92511E-03 ppm1 7.708 ppm2 1.462 CV 1
ASSI { 455}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 36 and name HG2%)
3.700 1.700 1.700 peak 455 spectrum 1 weight 0.11000E+01 volume 0.22823E-02 ppm1 7.709 ppm2 0.965 CV 1
ASSI { 456}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 33 and name HD1%)
6.000 6.000 0.000 peak 456 spectrum 1 weight 0.11000E+01 volume 0.13614E-03 ppm1 7.708 ppm2 0.233 CV 1
ASSI { 457}
(( segid " " and resid 14 and name HE22))
(( segid " " and resid 14 and name HG2 ))
3.700 1.700 1.700 peak 457 spectrum 1 weight 0.11000E+01 volume 0.14774E-02 ppm1 7.394 ppm2 2.698 CV 1
ASSI { 465}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 2 and name HA ))
2.400 2.400 3.600 peak 465 spectrum 1 weight 0.11000E+01 volume 0.22667E-02 ppm1 8.480 ppm2 4.454 CV 1
ASSI { 469}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 4 and name HA2 ))
2.600 0.800 0.800 peak 469 spectrum 1 weight 0.11000E+01 volume 0.77433E-02 ppm1 8.479 ppm2 3.912 CV 1
ASSI { 470}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 2 and name HB2 ))
4.700 2.800 1.300 peak 470 spectrum 1 weight 0.11000E+01 volume 0.11533E-03 ppm1 8.477 ppm2 2.295 CV 1
ASSI { 471}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 2 and name HB1 ))
3.400 3.400 2.600 peak 471 spectrum 1 weight 0.11000E+01 volume 0.29507E-03 ppm1 8.479 ppm2 1.934 CV 1
ASSI { 472}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HB2 ))
3.800 3.800 2.200 peak 472 spectrum 1 weight 0.11000E+01 volume 0.14818E-02 ppm1 8.479 ppm2 1.606 CV 1
ASSI { 474}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HA ))
4.700 4.700 1.300 peak 474 spectrum 1 weight 0.11000E+01 volume 0.40150E-03 ppm1 7.804 ppm2 4.450 CV 1
ASSI { 477}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HA2 ))
2.400 0.700 0.700 peak 477 spectrum 1 weight 0.11000E+01 volume 0.97499E-02 ppm1 7.803 ppm2 3.991 CV 1
ASSI { 478}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HB2 ))
3.200 1.200 1.200 peak 478 spectrum 1 weight 0.11000E+01 volume 0.14706E-02 ppm1 7.802 ppm2 1.861 CV 1
ASSI { 479}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HB1 ))
3.600 1.600 1.600 peak 479 spectrum 1 weight 0.11000E+01 volume 0.97823E-03 ppm1 7.803 ppm2 1.540 CV 1
ASSI { 480}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 47 and name HB1 ))
3.700 3.700 2.300 peak 480 spectrum 1 weight 0.11000E+01 volume 0.18960E-03 ppm1 7.800 ppm2 1.222 CV 1
ASSI { 481}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 48 and name HD1%)
3.200 3.200 2.800 peak 481 spectrum 1 weight 0.11000E+01 volume 0.45525E-03 ppm1 7.802 ppm2 0.902 CV 1
ASSI { 482}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 47 and name HD1%)
3.400 3.400 2.600 peak 482 spectrum 1 weight 0.11000E+01 volume 0.30598E-03 ppm1 7.802 ppm2 0.781 CV 1
ASSI { 483}
(( segid " " and resid 29 and name HD21))
( segid " " and resid 24 and name HD1%)
3.600 3.600 2.400 peak 483 spectrum 1 weight 0.11000E+01 volume 0.19914E-03 ppm1 7.393 ppm2 0.818 CV 1
ASSI { 487}
(( segid " " and resid 29 and name HD21))
( segid " " and resid 18 and name HD1%)
4.900 3.000 1.100 peak 487 spectrum 1 weight 0.11000E+01 volume 0.13943E-03 ppm1 7.391 ppm2 0.537 CV 1
ASSI { 490}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 23 and name HB1 ))
4.200 2.200 1.800 peak 490 spectrum 1 weight 0.11000E+01 volume 0.12919E-03 ppm1 6.680 ppm2 2.773 CV 1
ASSI { 494}
(( segid " " and resid 29 and name HD22))
( segid " " and resid 24 and name HG2%)
3.400 3.400 2.600 peak 494 spectrum 1 weight 0.11000E+01 volume 0.29615E-03 ppm1 6.677 ppm2 0.818 CV 1
ASSI { 497}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 33 and name HB2 ))
5.000 3.100 1.000 peak 497 spectrum 1 weight 0.11000E+01 volume 0.25486E-03 ppm1 8.900 ppm2 1.532 CV 1
ASSI { 498}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 33 and name HG ))
4.100 2.100 1.900 peak 498 spectrum 1 weight 0.11000E+01 volume 0.33188E-03 ppm1 8.899 ppm2 1.370 CV 1
ASSI { 499}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 36 and name HG2%)
4.900 3.000 1.100 peak 499 spectrum 1 weight 0.11000E+01 volume 0.44982E-03 ppm1 8.901 ppm2 0.965 CV 1
ASSI { 500}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 33 and name HD2%)
6.000 6.000 0.000 peak 500 spectrum 1 weight 0.11000E+01 volume 0.75002E-06 ppm1 8.901 ppm2 0.549 CV 1
ASSI { 501}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 36 and name HA ))
4.200 2.200 1.800 peak 501 spectrum 1 weight 0.11000E+01 volume 0.66944E-03 ppm1 8.898 ppm2 4.556 CV 1
ASSI { 503}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 36 and name HG1 ))
3.100 1.200 1.200 peak 503 spectrum 1 weight 0.11000E+01 volume 0.16065E-02 ppm1 8.900 ppm2 3.879 CV 1
ASSI { 504}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 33 and name HA ))
3.100 1.200 1.200 peak 504 spectrum 1 weight 0.11000E+01 volume 0.10283E-02 ppm1 8.900 ppm2 3.631 CV 1
ASSI { 506}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HB1 ))
5.300 3.500 0.700 peak 506 spectrum 1 weight 0.11000E+01 volume 0.40189E-03 ppm1 8.898 ppm2 2.623 CV 1
ASSI { 508}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 33 and name HD1%)
4.400 2.400 1.600 peak 508 spectrum 1 weight 0.11000E+01 volume 0.90780E-03 ppm1 8.900 ppm2 0.234 CV 1
ASSI { 509}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 33 and name HB1 ))
3.700 1.700 1.700 peak 509 spectrum 1 weight 0.11000E+01 volume 0.32232E-03 ppm1 8.898 ppm2 0.081 CV 1
ASSI { 510}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 23 and name HA ))
4.600 2.700 1.400 peak 510 spectrum 1 weight 0.11000E+01 volume 0.66290E-03 ppm1 7.774 ppm2 4.650 CV 1
ASSI { 511}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HA ))
2.800 1.000 1.000 peak 511 spectrum 1 weight 0.11000E+01 volume 0.34967E-02 ppm1 7.771 ppm2 4.383 CV 1
ASSI { 512}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 22 and name HA2 ))
2.500 0.800 0.800 peak 512 spectrum 1 weight 0.11000E+01 volume 0.41636E-02 ppm1 7.771 ppm2 4.104 CV 1
ASSI { 514}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HG2 ))
4.600 2.700 1.400 peak 514 spectrum 1 weight 0.11000E+01 volume 0.52650E-03 ppm1 7.772 ppm2 2.891 CV 1
ASSI { 515}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 23 and name HB1 ))
5.900 4.300 0.100 peak 515 spectrum 1 weight 0.11000E+01 volume 0.47149E-03 ppm1 7.772 ppm2 2.780 CV 1
ASSI { 516}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HG1 ))
4.300 2.300 1.700 peak 516 spectrum 1 weight 0.11000E+01 volume 0.91812E-03 ppm1 7.771 ppm2 2.574 CV 1
ASSI { 517}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB1 ))
4.500 2.500 1.500 peak 517 spectrum 1 weight 0.11000E+01 volume 0.57858E-03 ppm1 7.772 ppm2 2.353 CV 1
ASSI { 518}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 24 and name HD1%)
3.900 1.900 1.900 peak 518 spectrum 1 weight 0.11000E+01 volume 0.65185E-03 ppm1 7.772 ppm2 0.830 CV 1
ASSI { 521}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 34 and name HB ))
5.500 3.800 0.500 peak 521 spectrum 1 weight 0.11000E+01 volume 0.16643E-03 ppm1 7.667 ppm2 1.809 CV 1
ASSI { 524}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HA ))
3.400 1.500 1.500 peak 524 spectrum 1 weight 0.11000E+01 volume 0.11498E-02 ppm1 7.663 ppm2 4.152 CV 1
ASSI { 526}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HG1 ))
2.600 0.800 0.800 peak 526 spectrum 1 weight 0.11000E+01 volume 0.36811E-02 ppm1 7.664 ppm2 3.865 CV 1
ASSI { 527}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 34 and name HA ))
3.600 1.600 1.600 peak 527 spectrum 1 weight 0.11000E+01 volume 0.10214E-02 ppm1 7.663 ppm2 3.634 CV 1
ASSI { 528}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 46 and name HD2 ))
4.900 3.000 1.100 peak 528 spectrum 1 weight 0.11000E+01 volume 0.13525E-03 ppm1 7.662 ppm2 2.895 CV 1
ASSI { 530}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 35 and name HB% )
3.000 1.100 1.100 peak 530 spectrum 1 weight 0.11000E+01 volume 0.24431E-02 ppm1 7.663 ppm2 1.463 CV 1
ASSI { 532}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 33 and name HD1%)
5.500 5.500 0.500 peak 532 spectrum 1 weight 0.11000E+01 volume 0.19506E-03 ppm1 7.665 ppm2 0.259 CV 1
ASSI { 533}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HN ))
3.500 1.500 1.500 peak 533 spectrum 1 weight 0.11000E+01 volume 0.56334E-03 ppm1 8.237 ppm2 7.420 CV 1
ASSI { 535}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 11 and name HD% )
3.500 1.500 1.500 peak 535 spectrum 1 weight 0.11000E+01 volume 0.47388E-03 ppm1 8.234 ppm2 7.032 CV 1
ASSI { 537}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 33 and name HN ))
5.500 3.700 0.500 peak 537 spectrum 1 weight 0.11000E+01 volume 0.92908E-04 ppm1 7.660 ppm2 8.102 CV 1
ASSI { 538}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 43 and name HN ))
5.600 4.000 0.400 peak 538 spectrum 1 weight 0.11000E+01 volume 0.19945E-03 ppm1 7.658 ppm2 8.371 CV 1
ASSI { 539}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 34 and name HN ))
4.400 2.400 1.600 peak 539 spectrum 1 weight 0.11000E+01 volume 0.28874E-03 ppm1 7.660 ppm2 8.663 CV 1
ASSI { 540}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 38 and name HN ))
4.100 2.100 1.900 peak 540 spectrum 1 weight 0.11000E+01 volume 0.73676E-03 ppm1 7.660 ppm2 8.898 CV 1
ASSI { 541}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
2.600 0.900 0.900 peak 541 spectrum 1 weight 0.11000E+01 volume 0.29001E-02 ppm1 8.899 ppm2 7.697 CV 1
ASSI { 543}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 23 and name HN ))
2.000 0.500 0.500 peak 543 spectrum 1 weight 0.11000E+01 volume 0.11499E-01 ppm1 7.771 ppm2 7.907 CV 1
ASSI { 545}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 23 and name HD% )
5.000 5.000 1.000 peak 545 spectrum 1 weight 0.11000E+01 volume 0.38136E-03 ppm1 7.771 ppm2 7.284 CV 1
ASSI { 546}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 33 and name HN ))
5.000 3.100 1.000 peak 546 spectrum 1 weight 0.11000E+01 volume 0.31823E-03 ppm1 8.901 ppm2 8.102 CV 1
ASSI { 549}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HN ))
2.900 1.000 1.000 peak 549 spectrum 1 weight 0.11000E+01 volume 0.18520E-02 ppm1 7.802 ppm2 8.418 CV 1
ASSI { 550}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 5 and name HN ))
6.000 5.200 0.000 peak 550 spectrum 1 weight 0.11000E+01 volume 0.21896E-04 ppm1 8.479 ppm2 8.117 CV 1
ASSI { 556}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 29 and name HD22))
5.200 3.400 0.800 peak 556 spectrum 1 weight 0.11000E+01 volume 0.69722E-04 ppm1 7.788 ppm2 6.682 CV 1
ASSI { 558}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 29 and name HD21))
5.100 3.200 0.900 peak 558 spectrum 1 weight 0.11000E+01 volume 0.37450E-03 ppm1 7.787 ppm2 7.379 CV 1
ASSI { 559}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HN ))
2.600 0.800 0.800 peak 559 spectrum 1 weight 0.11000E+01 volume 0.21626E-02 ppm1 7.788 ppm2 9.104 CV 1
ASSI { 560}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HE21))
4.700 2.800 1.300 peak 560 spectrum 1 weight 0.11000E+01 volume 0.25668E-03 ppm1 7.924 ppm2 7.661 CV 1
ASSI { 561}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HE22))
6.000 6.000 0.000 peak 561 spectrum 1 weight 0.11000E+01 volume 0.59017E-04 ppm1 7.924 ppm2 6.918 CV 1
ASSI { 565}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HD22))
5.300 3.500 0.700 peak 565 spectrum 1 weight 0.11000E+01 volume 0.39908E-03 ppm1 8.345 ppm2 7.047 CV 1
ASSI { 566}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 18 and name HN ))
4.500 2.600 1.500 peak 566 spectrum 1 weight 0.11000E+01 volume 0.22362E-03 ppm1 8.345 ppm2 8.788 CV 1
ASSI { 567}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 11 and name HZ ))
5.400 3.700 0.600 peak 567 spectrum 1 weight 0.11000E+01 volume 0.21652E-03 ppm1 8.096 ppm2 7.191 CV 1
ASSI { 568}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 35 and name HN ))
4.300 2.300 1.700 peak 568 spectrum 1 weight 0.11000E+01 volume 0.60866E-03 ppm1 8.096 ppm2 7.731 CV 1
ASSI { 569}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 34 and name HN ))
2.700 0.900 0.900 peak 569 spectrum 1 weight 0.11000E+01 volume 0.18885E-02 ppm1 8.095 ppm2 8.660 CV 1
ASSI { 570}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HN ))
2.800 1.000 1.000 peak 570 spectrum 1 weight 0.11000E+01 volume 0.21962E-02 ppm1 7.493 ppm2 7.255 CV 1
ASSI { 572}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
2.600 0.800 0.800 peak 572 spectrum 1 weight 0.11000E+01 volume 0.31142E-02 ppm1 7.495 ppm2 8.389 CV 1
ASSI { 575}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 21 and name HN ))
4.400 2.400 1.600 peak 575 spectrum 1 weight 0.11000E+01 volume 0.34277E-03 ppm1 7.950 ppm2 7.676 CV 1
ASSI { 576}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 29 and name HD21))
4.300 2.300 1.700 peak 576 spectrum 1 weight 0.11000E+01 volume 0.21889E-03 ppm1 7.951 ppm2 7.393 CV 1
ASSI { 577}
(( segid " " and resid 19 and name HD21))
(( segid " " and resid 19 and name HD22))
3.700 3.700 2.300 peak 577 spectrum 1 weight 0.11000E+01 volume 0.21197E-03 ppm1 7.952 ppm2 7.053 CV 1
ASSI { 578}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 29 and name HD22))
4.400 2.400 1.600 peak 578 spectrum 1 weight 0.11000E+01 volume 0.28448E-03 ppm1 7.952 ppm2 6.672 CV 1
ASSI { 579}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 15 and name HN ))
4.400 2.400 1.600 peak 579 spectrum 1 weight 0.11000E+01 volume 0.19130E-03 ppm1 9.075 ppm2 8.774 CV 1
ASSI { 580}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 11 and name HN ))
5.700 4.100 0.300 peak 580 spectrum 1 weight 0.11000E+01 volume 0.43332E-04 ppm1 9.074 ppm2 8.247 CV 1
ASSI { 581}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 16 and name HN ))
5.200 3.400 0.800 peak 581 spectrum 1 weight 0.11000E+01 volume 0.11447E-03 ppm1 9.073 ppm2 7.889 CV 1
ASSI { 582}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
3.200 1.300 1.300 peak 582 spectrum 1 weight 0.11000E+01 volume 0.10015E-02 ppm1 9.072 ppm2 7.416 CV 1
ASSI { 583}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HE22))
6.000 5.700 0.000 peak 583 spectrum 1 weight 0.11000E+01 volume 0.78961E-04 ppm1 9.068 ppm2 6.933 CV 1
ASSI { 586}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 45 and name HN ))
3.500 3.500 2.500 peak 586 spectrum 1 weight 0.11000E+01 volume 0.23605E-03 ppm1 7.804 ppm2 7.279 CV 1
ASSI { 590}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 46 and name HN ))
5.000 3.200 1.000 peak 590 spectrum 1 weight 0.11000E+01 volume 0.13086E-03 ppm1 8.422 ppm2 7.498 CV 1
ASSI { 591}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 45 and name HN ))
4.700 2.800 1.300 peak 591 spectrum 1 weight 0.11000E+01 volume 0.18134E-03 ppm1 8.422 ppm2 7.269 CV 1
ASSI { 593}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 42 and name HN ))
5.000 3.100 1.000 peak 593 spectrum 1 weight 0.11000E+01 volume 0.12395E-03 ppm1 8.274 ppm2 8.102 CV 1
ASSI { 594}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 41 and name HN ))
4.900 3.000 1.100 peak 594 spectrum 1 weight 0.11000E+01 volume 0.14898E-03 ppm1 8.278 ppm2 7.958 CV 1
ASSI { 595}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 46 and name HN ))
4.200 2.200 1.800 peak 595 spectrum 1 weight 0.11000E+01 volume 0.29690E-03 ppm1 8.279 ppm2 7.500 CV 1
ASSI { 598}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HN ))
2.600 0.800 0.800 peak 598 spectrum 1 weight 0.11000E+01 volume 0.26464E-02 ppm1 7.674 ppm2 8.344 CV 1
ASSI { 599}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 18 and name HN ))
4.900 3.000 1.100 peak 599 spectrum 1 weight 0.11000E+01 volume 0.19676E-03 ppm1 7.674 ppm2 8.788 CV 1
ASSI { 601}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 23 and name HD% )
4.700 4.700 1.300 peak 601 spectrum 1 weight 0.11000E+01 volume 0.48249E-03 ppm1 7.674 ppm2 7.288 CV 1
ASSI { 603}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 23 and name HN ))
3.600 1.600 1.600 peak 603 spectrum 1 weight 0.11000E+01 volume 0.13471E-02 ppm1 7.674 ppm2 7.918 CV 1
ASSI { 605}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HN ))
2.700 0.900 0.900 peak 605 spectrum 1 weight 0.11000E+01 volume 0.23878E-02 ppm1 8.785 ppm2 8.331 CV 1
ASSI { 606}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 19 and name HN ))
2.500 0.800 0.800 peak 606 spectrum 1 weight 0.11000E+01 volume 0.34230E-02 ppm1 8.785 ppm2 7.936 CV 1
ASSI { 607}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 29 and name HD21))
4.600 2.600 1.400 peak 607 spectrum 1 weight 0.11000E+01 volume 0.33955E-03 ppm1 8.784 ppm2 7.389 CV 1
ASSI { 611}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 11 and name HZ ))
4.500 2.500 1.500 peak 611 spectrum 1 weight 0.11000E+01 volume 0.59819E-03 ppm1 8.661 ppm2 7.190 CV 1
ASSI { 612}
(( segid " " and resid 34 and name HN ))
( segid " " and resid 11 and name HE% )
4.400 2.400 1.600 peak 612 spectrum 1 weight 0.11000E+01 volume 0.54913E-03 ppm1 8.658 ppm2 6.937 CV 1
ASSI { 613}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 27 and name HN ))
3.500 1.500 1.500 peak 613 spectrum 1 weight 0.11000E+01 volume 0.10257E-02 ppm1 8.641 ppm2 8.320 CV 1
ASSI { 615}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HN ))
2.400 0.700 0.700 peak 615 spectrum 1 weight 0.11000E+01 volume 0.69474E-02 ppm1 8.645 ppm2 8.453 CV 1
ASSI { 617}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 31 and name HN ))
3.300 1.300 1.300 peak 617 spectrum 1 weight 0.11000E+01 volume 0.13634E-02 ppm1 8.646 ppm2 7.922 CV 1
ASSI { 618}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HN ))
2.600 0.900 0.900 peak 618 spectrum 1 weight 0.11000E+01 volume 0.32647E-02 ppm1 8.645 ppm2 7.643 CV 1
ASSI { 619}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HD21))
4.600 2.600 1.400 peak 619 spectrum 1 weight 0.11000E+01 volume 0.31374E-03 ppm1 8.646 ppm2 7.387 CV 1
ASSI { 620}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HD22))
4.300 2.300 1.700 peak 620 spectrum 1 weight 0.11000E+01 volume 0.32931E-03 ppm1 8.644 ppm2 6.679 CV 1
ASSI { 622}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HN ))
2.700 0.900 0.900 peak 622 spectrum 1 weight 0.11000E+01 volume 0.18923E-02 ppm1 8.455 ppm2 7.924 CV 1
ASSI { 623}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 28 and name HN ))
3.800 1.900 1.900 peak 623 spectrum 1 weight 0.11000E+01 volume 0.51847E-03 ppm1 8.454 ppm2 7.645 CV 1
ASSI { 624}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HD21))
5.100 3.200 0.900 peak 624 spectrum 1 weight 0.11000E+01 volume 0.30895E-03 ppm1 8.454 ppm2 7.397 CV 1
ASSI { 627}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 14 and name HN ))
5.600 4.000 0.400 peak 627 spectrum 1 weight 0.11000E+01 volume 0.80742E-04 ppm1 8.329 ppm2 9.334 CV 1
ASSI { 629}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
2.500 0.800 0.800 peak 629 spectrum 1 weight 0.11000E+01 volume 0.32666E-02 ppm1 8.328 ppm2 7.886 CV 1
ASSI { 631}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 49 and name HN ))
6.000 4.700 0.000 peak 631 spectrum 1 weight 0.11000E+01 volume 0.36590E-04 ppm1 8.390 ppm2 7.799 CV 1
ASSI { 640}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HN ))
2.300 0.700 0.700 peak 640 spectrum 1 weight 0.11000E+01 volume 0.50576E-02 ppm1 8.369 ppm2 8.250 CV 1
ASSI { 642}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 41 and name HN ))
3.600 1.600 1.600 peak 642 spectrum 1 weight 0.11000E+01 volume 0.83975E-03 ppm1 8.369 ppm2 7.959 CV 1
ASSI { 644}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 46 and name HN ))
5.000 3.100 1.000 peak 644 spectrum 1 weight 0.11000E+01 volume 0.14274E-03 ppm1 8.365 ppm2 7.500 CV 1
ASSI { 645}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 45 and name HN ))
4.000 2.000 2.000 peak 645 spectrum 1 weight 0.11000E+01 volume 0.47189E-03 ppm1 8.367 ppm2 7.255 CV 1
ASSI { 646}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 39 and name HN ))
4.700 2.800 1.300 peak 646 spectrum 1 weight 0.11000E+01 volume 0.19070E-03 ppm1 8.369 ppm2 6.879 CV 1
ASSI { 647}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 29 and name HN ))
4.800 2.800 1.200 peak 647 spectrum 1 weight 0.11000E+01 volume 0.16309E-03 ppm1 9.099 ppm2 8.651 CV 1
ASSI { 648}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HN ))
3.900 1.900 1.900 peak 648 spectrum 1 weight 0.11000E+01 volume 0.56298E-03 ppm1 9.099 ppm2 8.409 CV 1
ASSI { 651}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 29 and name HD21))
5.000 3.200 1.000 peak 651 spectrum 1 weight 0.11000E+01 volume 0.27607E-03 ppm1 9.101 ppm2 7.388 CV 1
ASSI { 652}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HD22))
5.400 3.600 0.600 peak 652 spectrum 1 weight 0.11000E+01 volume 0.26150E-03 ppm1 9.098 ppm2 7.089 CV 1
ASSI { 653}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 29 and name HD22))
3.800 1.800 1.800 peak 653 spectrum 1 weight 0.11000E+01 volume 0.32244E-03 ppm1 9.100 ppm2 6.679 CV 1
ASSI { 655}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HN ))
5.600 3.900 0.400 peak 655 spectrum 1 weight 0.11000E+01 volume 0.12143E-03 ppm1 8.407 ppm2 7.798 CV 1
ASSI { 656}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 28 and name HN ))
4.600 2.700 1.400 peak 656 spectrum 1 weight 0.11000E+01 volume 0.26773E-03 ppm1 8.408 ppm2 7.641 CV 1
ASSI { 657}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 29 and name HD21))
5.800 4.200 0.200 peak 657 spectrum 1 weight 0.11000E+01 volume 0.66899E-04 ppm1 8.405 ppm2 7.402 CV 1
ASSI { 658}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HD22))
6.000 6.000 0.000 peak 658 spectrum 1 weight 0.11000E+01 volume 0.50729E-04 ppm1 8.402 ppm2 7.066 CV 1
ASSI { 659}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 29 and name HD22))
5.800 4.200 0.200 peak 659 spectrum 1 weight 0.11000E+01 volume 0.44913E-04 ppm1 8.409 ppm2 6.684 CV 1
ASSI { 660}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 43 and name HN ))
4.700 2.700 1.300 peak 660 spectrum 1 weight 0.11000E+01 volume 0.21350E-03 ppm1 8.924 ppm2 8.372 CV 1
ASSI { 661}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 42 and name HN ))
3.700 1.700 1.700 peak 661 spectrum 1 weight 0.11000E+01 volume 0.90505E-03 ppm1 8.924 ppm2 8.119 CV 1
ASSI { 662}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 41 and name HN ))
2.700 0.900 0.900 peak 662 spectrum 1 weight 0.11000E+01 volume 0.25217E-02 ppm1 8.924 ppm2 7.966 CV 1
ASSI { 663}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 14 and name HE22))
5.200 3.400 0.800 peak 663 spectrum 1 weight 0.11000E+01 volume 0.20979E-03 ppm1 8.920 ppm2 7.397 CV 1
ASSI { 664}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HN ))
3.600 1.600 1.600 peak 664 spectrum 1 weight 0.11000E+01 volume 0.84747E-03 ppm1 8.924 ppm2 6.880 CV 1
ASSI { 665}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HN ))
2.900 1.000 1.000 peak 665 spectrum 1 weight 0.11000E+01 volume 0.15057E-02 ppm1 9.324 ppm2 9.070 CV 1
ASSI { 666}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HN ))
2.900 1.100 1.100 peak 666 spectrum 1 weight 0.11000E+01 volume 0.14345E-02 ppm1 9.327 ppm2 8.778 CV 1
ASSI { 668}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 16 and name HN ))
4.500 2.500 1.500 peak 668 spectrum 1 weight 0.11000E+01 volume 0.35298E-03 ppm1 9.329 ppm2 7.889 CV 1
ASSI { 669}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 12 and name HN ))
4.200 2.200 1.800 peak 669 spectrum 1 weight 0.11000E+01 volume 0.32385E-03 ppm1 9.326 ppm2 7.403 CV 1
ASSI { 672}
(( segid " " and resid 14 and name HE22))
(( segid " " and resid 14 and name HN ))
6.000 6.000 0.000 peak 672 spectrum 1 weight 0.11000E+01 volume 0.20888E-04 ppm1 7.391 ppm2 9.330 CV 1
ASSI { 676}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 45 and name HN ))
6.000 4.600 0.000 peak 676 spectrum 1 weight 0.11000E+01 volume 0.65713E-04 ppm1 7.969 ppm2 7.249 CV 1
ASSI { 677}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HD22))
4.200 2.200 1.800 peak 677 spectrum 1 weight 0.11000E+01 volume 0.64482E-03 ppm1 7.966 ppm2 6.978 CV 1
ASSI { 678}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 38 and name HN ))
6.000 4.600 0.000 peak 678 spectrum 1 weight 0.11000E+01 volume 0.10642E-03 ppm1 7.748 ppm2 8.909 CV 1
ASSI { 682}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 46 and name HH21))
4.900 3.000 1.100 peak 682 spectrum 1 weight 0.11000E+01 volume 0.36094E-03 ppm1 7.748 ppm2 6.920 CV 1
ASSI { 685}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HN ))
2.600 0.900 0.900 peak 685 spectrum 1 weight 0.11000E+01 volume 0.23070E-02 ppm1 7.883 ppm2 8.780 CV 1
ASSI { 688}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 34 and name HN ))
4.200 2.200 1.800 peak 688 spectrum 1 weight 0.11000E+01 volume 0.45390E-03 ppm1 8.080 ppm2 8.657 CV 1
ASSI { 689}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 30 and name HN ))
3.900 1.900 1.900 peak 689 spectrum 1 weight 0.11000E+01 volume 0.45611E-03 ppm1 8.079 ppm2 8.445 CV 1
ASSI { 690}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HN ))
2.800 1.000 1.000 peak 690 spectrum 1 weight 0.11000E+01 volume 0.18586E-02 ppm1 8.080 ppm2 7.919 CV 1
ASSI { 691}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 28 and name HN ))
3.200 3.200 2.800 peak 691 spectrum 1 weight 0.11000E+01 volume 0.42883E-03 ppm1 8.081 ppm2 7.687 CV 1
ASSI { 693}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HE22))
5.500 3.800 0.500 peak 693 spectrum 1 weight 0.11000E+01 volume 0.28235E-03 ppm1 8.079 ppm2 6.921 CV 1
ASSI { 694}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 25 and name HN ))
6.000 6.000 0.000 peak 694 spectrum 1 weight 0.11000E+01 volume 0.26001E-04 ppm1 7.897 ppm2 9.104 CV 1
ASSI { 695}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 18 and name HN ))
6.000 5.400 0.000 peak 695 spectrum 1 weight 0.11000E+01 volume 0.71859E-04 ppm1 7.892 ppm2 8.791 CV 1
ASSI { 697}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 29 and name HD21))
4.100 2.100 1.900 peak 697 spectrum 1 weight 0.11000E+01 volume 0.14561E-02 ppm1 7.893 ppm2 7.383 CV 1
ASSI { 699}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 29 and name HD22))
4.500 2.500 1.500 peak 699 spectrum 1 weight 0.11000E+01 volume 0.33026E-03 ppm1 7.894 ppm2 6.679 CV 1
ASSI { 700}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 25 and name HN ))
5.800 4.300 0.200 peak 700 spectrum 1 weight 0.11000E+01 volume 0.12186E-03 ppm1 7.638 ppm2 9.105 CV 1
ASSI { 702}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HN ))
2.600 0.800 0.800 peak 702 spectrum 1 weight 0.11000E+01 volume 0.38413E-02 ppm1 7.637 ppm2 8.329 CV 1
ASSI { 705}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 29 and name HD21))
2.300 0.600 0.600 peak 705 spectrum 1 weight 0.11000E+01 volume 0.24190E-02 ppm1 6.678 ppm2 7.393 CV 1
ASSI { 707}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 30 and name HN ))
4.600 2.600 1.400 peak 707 spectrum 1 weight 0.11000E+01 volume 0.48132E-04 ppm1 6.684 ppm2 8.437 CV 1
ASSI { 712}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 37 and name HN ))
3.900 1.900 1.900 peak 712 spectrum 1 weight 0.11000E+01 volume 0.90415E-03 ppm1 6.880 ppm2 7.695 CV 1
ASSI { 713}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 41 and name HN ))
4.700 2.700 1.300 peak 713 spectrum 1 weight 0.11000E+01 volume 0.30869E-03 ppm1 6.879 ppm2 7.970 CV 1
ASSI { 714}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 42 and name HN ))
4.500 2.500 1.500 peak 714 spectrum 1 weight 0.11000E+01 volume 0.43150E-03 ppm1 6.879 ppm2 8.109 CV 1
ASSI { 716}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HN ))
2.400 0.700 0.700 peak 716 spectrum 1 weight 0.11000E+01 volume 0.38382E-02 ppm1 6.879 ppm2 8.908 CV 1
ASSI { 717}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
2.400 0.700 0.700 peak 717 spectrum 1 weight 0.11000E+01 volume 0.49773E-02 ppm1 8.116 ppm2 8.367 CV 1
ASSI { 718}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HN ))
2.400 0.700 0.700 peak 718 spectrum 1 weight 0.11000E+01 volume 0.53795E-02 ppm1 8.114 ppm2 7.962 CV 1
ASSI { 719}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 45 and name HN ))
4.700 2.700 1.300 peak 719 spectrum 1 weight 0.11000E+01 volume 0.23944E-03 ppm1 8.113 ppm2 7.258 CV 1
ASSI { 721}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HD22))
5.700 4.000 0.300 peak 721 spectrum 1 weight 0.11000E+01 volume 0.27027E-03 ppm1 8.112 ppm2 6.975 CV 1
ASSI { 722}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 46 and name HN ))
6.000 5.300 0.000 peak 722 spectrum 1 weight 0.11000E+01 volume 0.21170E-04 ppm1 7.801 ppm2 7.481 CV 1
ASSI { 723}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 35 and name HA ))
3.900 1.900 1.900 peak 723 spectrum 1 weight 0.11000E+01 volume 0.20194E-02 ppm1 8.663 ppm2 4.137 CV 1
ASSI { 726}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HG2 ))
4.000 2.000 2.000 peak 726 spectrum 1 weight 0.11000E+01 volume 0.11150E-02 ppm1 9.327 ppm2 2.704 CV 1
ASSI { 727}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HG1 ))
2.700 0.900 0.900 peak 727 spectrum 1 weight 0.11000E+01 volume 0.45958E-02 ppm1 8.328 ppm2 2.343 CV 1
ASSI { 728}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HG2 ))
3.500 1.600 1.600 peak 728 spectrum 1 weight 0.11000E+01 volume 0.32528E-02 ppm1 8.328 ppm2 2.492 CV 1
ASSI { 733}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
2.300 0.700 0.700 peak 733 spectrum 1 weight 0.11000E+01 volume 0.37256E-02 ppm1 8.454 ppm2 3.894 CV 1
ASSI { 734}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 30 and name HD1%)
3.000 1.100 1.100 peak 734 spectrum 1 weight 0.11000E+01 volume 0.44424E-02 ppm1 8.455 ppm2 0.948 CV 1
ASSI { 735}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 45 and name HA ))
4.800 2.900 1.200 peak 735 spectrum 1 weight 0.11000E+01 volume 0.43122E-03 ppm1 8.279 ppm2 3.899 CV 1
ASSI { 737}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HG ))
2.300 0.700 0.700 peak 737 spectrum 1 weight 0.11000E+01 volume 0.55951E-02 ppm1 8.776 ppm2 1.685 CV 1
ASSI { 738}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 44 and name HA ))
4.400 2.500 1.600 peak 738 spectrum 1 weight 0.11000E+01 volume 0.22169E-03 ppm1 8.425 ppm2 3.006 CV 1
ASSI { 740}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HG12))
3.300 1.300 1.300 peak 740 spectrum 1 weight 0.11000E+01 volume 0.27186E-02 ppm1 8.279 ppm2 1.588 CV 1
ASSI { 741}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HB1 ))
3.100 1.200 1.200 peak 741 spectrum 1 weight 0.11000E+01 volume 0.42906E-02 ppm1 8.321 ppm2 2.013 CV 1
ASSI { 742}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 18 and name HB2 ))
4.100 2.100 1.900 peak 742 spectrum 1 weight 0.11000E+01 volume 0.70863E-03 ppm1 8.344 ppm2 1.935 CV 1
ASSI { 743}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 21 and name HB1 ))
5.100 3.300 0.900 peak 743 spectrum 1 weight 0.11000E+01 volume 0.86753E-03 ppm1 8.345 ppm2 2.351 CV 1
ASSI { 744}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HA1 ))
2.900 1.100 1.100 peak 744 spectrum 1 weight 0.11000E+01 volume 0.34852E-02 ppm1 8.899 ppm2 2.492 CV 1
ASSI { 746}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 51 and name HB2 ))
4.200 2.200 1.800 peak 746 spectrum 1 weight 0.11000E+01 volume 0.24295E-03 ppm1 7.983 ppm2 2.133 CV 1
ASSI { 747}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 51 and name HB1 ))
3.400 3.400 2.600 peak 747 spectrum 1 weight 0.11000E+01 volume 0.29282E-03 ppm1 7.985 ppm2 2.048 CV 1
ASSI { 750}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HB2 ))
4.500 2.600 1.500 peak 750 spectrum 1 weight 0.11000E+01 volume 0.53845E-03 ppm1 7.786 ppm2 3.355 CV 1
ASSI { 751}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HA2 ))
6.000 4.500 0.000 peak 751 spectrum 1 weight 0.11000E+01 volume 0.69532E-04 ppm1 7.793 ppm2 4.104 CV 1
ASSI { 752}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HA ))
3.100 1.200 1.200 peak 752 spectrum 1 weight 0.11000E+01 volume 0.23604E-02 ppm1 8.095 ppm2 3.897 CV 1
ASSI { 753}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 39 and name HA ))
3.500 1.600 1.600 peak 753 spectrum 1 weight 0.11000E+01 volume 0.10130E-02 ppm1 8.115 ppm2 4.569 CV 1
ASSI { 754}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 41 and name HA ))
5.000 3.100 1.000 peak 754 spectrum 1 weight 0.11000E+01 volume 0.13874E-03 ppm1 8.368 ppm2 4.338 CV 1
ASSI { 755}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 41 and name HA ))
4.100 2.100 1.900 peak 755 spectrum 1 weight 0.11000E+01 volume 0.42432E-03 ppm1 7.258 ppm2 4.341 CV 1
ASSI { 756}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HD1 ))
4.800 2.900 1.200 peak 756 spectrum 1 weight 0.11000E+01 volume 0.53259E-03 ppm1 7.496 ppm2 3.126 CV 1
ASSI { 759}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 6 and name HN ))
2.800 1.000 1.000 peak 759 spectrum 1 weight 0.11000E+01 volume 0.34790E-02 ppm1 8.118 ppm2 8.510 CV 1
ASSI { 762}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HN ))
3.500 1.500 1.500 peak 762 spectrum 1 weight 0.11000E+01 volume 0.12172E-02 ppm1 7.985 ppm2 8.327 CV 1
ASSI { 764}
(( segid " " and resid 17 and name HE21))
(( segid " " and resid 17 and name HN ))
6.000 5.200 0.000 peak 764 spectrum 1 weight 0.11000E+01 volume 0.67291E-04 ppm1 7.293 ppm2 8.330 CV 1
ASSI { 765}
(( segid " " and resid 17 and name HE22))
(( segid " " and resid 17 and name HN ))
6.000 6.000 0.000 peak 765 spectrum 1 weight 0.11000E+01 volume 0.25565E-04 ppm1 6.832 ppm2 8.330 CV 1
ASSI { 766}
(( segid " " and resid 17 and name HE21))
(( segid " " and resid 17 and name HA ))
5.300 3.500 0.700 peak 766 spectrum 1 weight 0.11000E+01 volume 0.32555E-03 ppm1 7.294 ppm2 4.074 CV 1
ASSI { 767}
(( segid " " and resid 17 and name HE22))
(( segid " " and resid 17 and name HA ))
6.000 5.500 0.000 peak 767 spectrum 1 weight 0.11000E+01 volume 0.17237E-03 ppm1 6.832 ppm2 4.066 CV 1
ASSI { 769}
(( segid " " and resid 17 and name HE21))
(( segid " " and resid 17 and name HG1 ))
3.400 1.400 1.400 peak 769 spectrum 1 weight 0.11000E+01 volume 0.15418E-02 ppm1 7.294 ppm2 2.355 CV 1
ASSI { 770}
(( segid " " and resid 17 and name HE21))
(( segid " " and resid 17 and name HB2 ))
3.100 1.200 1.200 peak 770 spectrum 1 weight 0.11000E+01 volume 0.61749E-03 ppm1 7.293 ppm2 2.162 CV 1
ASSI { 773}
(( segid " " and resid 17 and name HE22))
(( segid " " and resid 17 and name HB2 ))
5.000 3.200 1.000 peak 773 spectrum 1 weight 0.11000E+01 volume 0.30069E-03 ppm1 6.830 ppm2 2.150 CV 1
ASSI { 776}
(( segid " " and resid 17 and name HE21))
( segid " " and resid 40 and name HG2%)
3.800 1.800 1.800 peak 776 spectrum 1 weight 0.11000E+01 volume 0.66741E-03 ppm1 7.294 ppm2 0.845 CV 1
ASSI { 777}
(( segid " " and resid 17 and name HE22))
( segid " " and resid 40 and name HG2%)
3.300 1.400 1.400 peak 777 spectrum 1 weight 0.11000E+01 volume 0.63314E-03 ppm1 6.830 ppm2 0.848 CV 1
ASSI { 778}
(( segid " " and resid 17 and name HE21))
( segid " " and resid 18 and name HD1%)
6.000 6.000 0.000 peak 778 spectrum 1 weight 0.11000E+01 volume 0.11444E-04 ppm1 7.293 ppm2 0.535 CV 1
ASSI { 779}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HA1 ))
2.800 1.000 1.000 peak 779 spectrum 1 weight 0.11000E+01 volume 0.50075E-02 ppm1 6.875 ppm2 2.508 CV 1
ASSI { 780}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 30 and name HN ))
5.400 3.700 0.600 peak 780 spectrum 1 weight 0.11000E+01 volume 0.80589E-04 ppm1 8.091 ppm2 8.430 CV 1
ASSI { 781}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HN ))
4.400 2.400 1.600 peak 781 spectrum 1 weight 0.11000E+01 volume 0.28772E-03 ppm1 8.095 ppm2 7.915 CV 1
ASSI { 782}
(( segid " " and resid 41 and name HD22))
(( segid " " and resid 41 and name HA ))
4.900 3.000 1.100 peak 782 spectrum 1 weight 0.11000E+01 volume 0.42887E-03 ppm1 6.981 ppm2 4.349 CV 1
ASSI { 783}
(( segid " " and resid 41 and name HD22))
(( segid " " and resid 41 and name HB2 ))
3.800 1.800 1.800 peak 783 spectrum 1 weight 0.11000E+01 volume 0.20775E-02 ppm1 6.981 ppm2 2.859 CV 1
ASSI { 785}
(( segid " " and resid 41 and name HD22))
( segid " " and resid 40 and name HG2%)
4.000 2.000 2.000 peak 785 spectrum 1 weight 0.11000E+01 volume 0.66534E-03 ppm1 6.978 ppm2 0.864 CV 1
ASSI { 788}
(( segid " " and resid 41 and name HD22))
(( segid " " and resid 40 and name HN ))
5.600 3.900 0.400 peak 788 spectrum 1 weight 0.11000E+01 volume 0.10902E-03 ppm1 6.985 ppm2 8.922 CV 1
ASSI { 789}
(( segid " " and resid 41 and name HD22))
( segid " " and resid 42 and name HB% )
6.000 6.000 0.000 peak 789 spectrum 1 weight 0.11000E+01 volume 0.20976E-04 ppm1 6.986 ppm2 1.383 CV 1
ASSI { 792}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HE21))
5.700 4.100 0.300 peak 792 spectrum 1 weight 0.11000E+01 volume 0.16436E-04 ppm1 9.070 ppm2 7.682 CV 1
ASSI { 793}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 11 and name HB2 ))
6.000 5.800 0.000 peak 793 spectrum 1 weight 0.11000E+01 volume 0.37493E-04 ppm1 9.073 ppm2 3.454 CV 1
ASSI { 794}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 11 and name HB1 ))
6.000 4.400 0.000 peak 794 spectrum 1 weight 0.11000E+01 volume 0.89517E-04 ppm1 9.072 ppm2 2.727 CV 1
ASSI { 797}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HE22))
6.000 6.000 0.000 peak 797 spectrum 1 weight 0.11000E+01 volume 0.53655E-04 ppm1 9.321 ppm2 6.928 CV 1
ASSI { 798}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 26 and name HH22))
5.700 4.000 0.300 peak 798 spectrum 1 weight 0.11000E+01 volume 0.18986E-03 ppm1 8.784 ppm2 7.132 CV 1
ASSI { 799}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 12 and name HN ))
5.100 3.300 0.900 peak 799 spectrum 1 weight 0.11000E+01 volume 0.24477E-04 ppm1 7.881 ppm2 7.407 CV 1
ASSI { 804}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 19 and name HB1 ))
5.900 4.400 0.100 peak 804 spectrum 1 weight 0.11000E+01 volume 0.12611E-03 ppm1 7.881 ppm2 2.767 CV 1
ASSI { 805}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 33 and name HD1%)
6.000 6.000 0.000 peak 805 spectrum 1 weight 0.11000E+01 volume 0.48064E-04 ppm1 7.884 ppm2 0.244 CV 1
ASSI { 807}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HE22))
6.000 6.000 0.000 peak 807 spectrum 1 weight 0.11000E+01 volume 0.14455E-03 ppm1 8.328 ppm2 6.947 CV 1
ASSI { 809}
(( segid " " and resid 19 and name HD22))
(( segid " " and resid 16 and name HA ))
5.700 4.000 0.300 peak 809 spectrum 1 weight 0.11000E+01 volume 0.30247E-03 ppm1 7.036 ppm2 4.122 CV 1
ASSI { 810}
(( segid " " and resid 19 and name HD22))
(( segid " " and resid 19 and name HB2 ))
4.300 2.400 1.700 peak 810 spectrum 1 weight 0.11000E+01 volume 0.10290E-02 ppm1 7.036 ppm2 2.922 CV 1
ASSI { 812}
(( segid " " and resid 19 and name HD22))
(( segid " " and resid 16 and name HB1 ))
4.400 4.400 1.600 peak 812 spectrum 1 weight 0.11000E+01 volume 0.65911E-04 ppm1 7.030 ppm2 2.226 CV 1
ASSI { 813}
(( segid " " and resid 19 and name HD22))
( segid " " and resid 24 and name HD1%)
4.300 4.300 1.700 peak 813 spectrum 1 weight 0.11000E+01 volume 0.51076E-03 ppm1 7.034 ppm2 0.827 CV 1
ASSI { 814}
(( segid " " and resid 19 and name HD21))
( segid " " and resid 24 and name HD1%)
4.100 4.100 1.900 peak 814 spectrum 1 weight 0.11000E+01 volume 0.85396E-03 ppm1 7.948 ppm2 0.841 CV 1
ASSI { 815}
(( segid " " and resid 19 and name HD21))
(( segid " " and resid 16 and name HB2 ))
3.400 3.400 2.600 peak 815 spectrum 1 weight 0.11000E+01 volume 0.29566E-03 ppm1 7.944 ppm2 2.231 CV 1
ASSI { 816}
(( segid " " and resid 19 and name HD21))
(( segid " " and resid 19 and name HB1 ))
2.500 0.800 0.800 peak 816 spectrum 1 weight 0.11000E+01 volume 0.22234E-02 ppm1 7.950 ppm2 2.758 CV 1
ASSI { 817}
(( segid " " and resid 19 and name HD21))
(( segid " " and resid 19 and name HB2 ))
3.300 1.400 1.400 peak 817 spectrum 1 weight 0.11000E+01 volume 0.30439E-02 ppm1 7.949 ppm2 2.907 CV 1
ASSI { 818}
(( segid " " and resid 19 and name HD21))
(( segid " " and resid 16 and name HA ))
4.300 2.300 1.700 peak 818 spectrum 1 weight 0.11000E+01 volume 0.84070E-03 ppm1 7.950 ppm2 4.137 CV 1
ASSI { 819}
(( segid " " and resid 19 and name HD21))
(( segid " " and resid 19 and name HA ))
3.500 1.500 1.500 peak 819 spectrum 1 weight 0.11000E+01 volume 0.12842E-02 ppm1 7.951 ppm2 4.393 CV 1
ASSI { 820}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HN ))
2.500 0.800 0.800 peak 820 spectrum 1 weight 0.11000E+01 volume 0.34807E-02 ppm1 8.345 ppm2 7.951 CV 1
ASSI { 822}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 29 and name HD21))
6.000 6.000 0.000 peak 822 spectrum 1 weight 0.11000E+01 volume 0.48790E-04 ppm1 8.338 ppm2 7.349 CV 1
ASSI { 823}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 29 and name HD22))
6.000 5.100 0.000 peak 823 spectrum 1 weight 0.11000E+01 volume 0.61736E-04 ppm1 8.343 ppm2 6.678 CV 1
ASSI { 824}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 20 and name HN ))
4.600 2.700 1.400 peak 824 spectrum 1 weight 0.11000E+01 volume 0.31338E-03 ppm1 7.768 ppm2 8.346 CV 1
ASSI { 826}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 29 and name HD22))
6.000 6.000 0.000 peak 826 spectrum 1 weight 0.11000E+01 volume 0.38049E-04 ppm1 7.769 ppm2 6.674 CV 1
ASSI { 828}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 29 and name HN ))
6.000 4.500 0.000 peak 828 spectrum 1 weight 0.11000E+01 volume 0.45543E-04 ppm1 8.413 ppm2 8.653 CV 1
ASSI { 829}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 24 and name HA ))
6.000 6.000 0.000 peak 829 spectrum 1 weight 0.11000E+01 volume 0.68549E-05 ppm1 8.412 ppm2 4.449 CV 1
ASSI { 831}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 25 and name HD22))
5.800 4.200 0.200 peak 831 spectrum 1 weight 0.11000E+01 volume 0.14117E-03 ppm1 8.314 ppm2 7.089 CV 1
ASSI { 832}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 25 and name HN ))
6.000 5.400 0.000 peak 832 spectrum 1 weight 0.11000E+01 volume 0.42404E-04 ppm1 8.322 ppm2 9.100 CV 1
ASSI { 834}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 47 and name HD2%)
6.000 6.000 0.000 peak 834 spectrum 1 weight 0.11000E+01 volume 0.18847E-04 ppm1 7.640 ppm2 0.270 CV 1
ASSI { 842}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 39 and name HN ))
4.500 2.600 1.500 peak 842 spectrum 1 weight 0.11000E+01 volume 0.48434E-03 ppm1 7.667 ppm2 6.885 CV 1
ASSI { 845}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 47 and name HN ))
3.900 1.900 1.900 peak 845 spectrum 1 weight 0.11000E+01 volume 0.92529E-03 ppm1 7.260 ppm2 8.406 CV 1
ASSI { 846}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HN ))
2.500 0.800 0.800 peak 846 spectrum 1 weight 0.11000E+01 volume 0.33748E-02 ppm1 7.258 ppm2 8.287 CV 1
ASSI { 847}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 33 and name HB1 ))
6.000 4.600 0.000 peak 847 spectrum 1 weight 0.11000E+01 volume 0.59621E-04 ppm1 7.663 ppm2 0.077 CV 1
ASSI { 848}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 46 and name HD1 ))
6.000 6.000 0.000 peak 848 spectrum 1 weight 0.11000E+01 volume 0.48470E-05 ppm1 7.667 ppm2 3.117 CV 1
ASSI { 850}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 14 and name HE21))
5.600 4.000 0.400 peak 850 spectrum 1 weight 0.11000E+01 volume 0.16434E-03 ppm1 8.899 ppm2 7.976 CV 1
ASSI { 851}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 43 and name HN ))
6.000 6.000 0.000 peak 851 spectrum 1 weight 0.11000E+01 volume 0.18146E-04 ppm1 8.897 ppm2 8.374 CV 1
ASSI { 852}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 11 and name HD% )
4.000 4.000 2.000 peak 852 spectrum 1 weight 0.11000E+01 volume 0.54720E-03 ppm1 8.898 ppm2 7.069 CV 1
ASSI { 854}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 18 and name HN ))
6.000 4.500 0.000 peak 854 spectrum 1 weight 0.11000E+01 volume 0.95005E-05 ppm1 6.685 ppm2 8.787 CV 1
ASSI { 859}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 19 and name HA ))
5.100 5.100 0.900 peak 859 spectrum 1 weight 0.11000E+01 volume 0.72526E-04 ppm1 6.672 ppm2 4.422 CV 1
ASSI { 860}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 29 and name HA ))
6.000 6.000 0.000 peak 860 spectrum 1 weight 0.11000E+01 volume 0.24807E-04 ppm1 6.680 ppm2 4.109 CV 1
ASSI { 861}
(( segid " " and resid 29 and name HD21))
(( segid " " and resid 19 and name HA ))
6.000 6.000 0.000 peak 861 spectrum 1 weight 0.11000E+01 volume 0.16105E-04 ppm1 7.377 ppm2 4.413 CV 1
ASSI { 863}
(( segid " " and resid 29 and name HD21))
(( segid " " and resid 19 and name HB1 ))
5.000 3.200 1.000 peak 863 spectrum 1 weight 0.11000E+01 volume 0.27888E-04 ppm1 7.392 ppm2 2.772 CV 1
ASSI { 864}
(( segid " " and resid 29 and name HD21))
(( segid " " and resid 18 and name HB2 ))
5.700 4.100 0.300 peak 864 spectrum 1 weight 0.11000E+01 volume 0.13073E-04 ppm1 7.400 ppm2 1.907 CV 1
ASSI { 865}
(( segid " " and resid 29 and name HD21))
(( segid " " and resid 18 and name HB1 ))
6.000 6.000 0.000 peak 865 spectrum 1 weight 0.11000E+01 volume 0.68631E-05 ppm1 7.390 ppm2 1.526 CV 1
ASSI { 866}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 47 and name HD2%)
4.600 4.600 1.400 peak 866 spectrum 1 weight 0.11000E+01 volume 0.46815E-04 ppm1 7.807 ppm2 0.269 CV 1
ASSI { 867}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HN ))
3.600 1.600 1.600 peak 867 spectrum 1 weight 0.11000E+01 volume 0.18960E-02 ppm1 8.480 ppm2 8.678 CV 1
ASSI { 870}
(( segid " " and resid 17 and name HE21))
(( segid " " and resid 18 and name HN ))
6.000 6.000 0.000 peak 870 spectrum 1 weight 0.11000E+01 volume 0.49164E-04 ppm1 7.296 ppm2 8.792 CV 1
ASSI { 871}
(( segid " " and resid 17 and name HE22))
(( segid " " and resid 18 and name HN ))
6.000 6.000 0.000 peak 871 spectrum 1 weight 0.11000E+01 volume 0.35082E-04 ppm1 6.831 ppm2 8.788 CV 1
ASSI { 872}
(( segid " " and resid 17 and name HE21))
(( segid " " and resid 14 and name HN ))
6.000 6.000 0.000 peak 872 spectrum 1 weight 0.11000E+01 volume 0.52181E-05 ppm1 7.293 ppm2 9.302 CV 1
ASSI { 877}
(( segid " " and resid 17 and name HE21))
(( segid " " and resid 40 and name HB ))
6.000 5.500 0.000 peak 877 spectrum 1 weight 0.11000E+01 volume 0.26807E-04 ppm1 7.293 ppm2 1.715 CV 1
ASSI { 879}
(( segid " " and resid 14 and name HE21))
(( segid " " and resid 14 and name HN ))
6.000 4.900 0.000 peak 879 spectrum 1 weight 0.11000E+01 volume 0.45277E-04 ppm1 7.988 ppm2 9.334 CV 1
ASSI { 880}
(( segid " " and resid 14 and name HE21))
(( segid " " and resid 40 and name HN ))
6.000 4.800 0.000 peak 880 spectrum 1 weight 0.11000E+01 volume 0.37058E-04 ppm1 7.984 ppm2 8.923 CV 1
ASSI { 881}
(( segid " " and resid 14 and name HE21))
(( segid " " and resid 11 and name HA ))
6.000 6.000 0.000 peak 881 spectrum 1 weight 0.11000E+01 volume 0.24243E-04 ppm1 7.992 ppm2 5.390 CV 1
ASSI { 883}
(( segid " " and resid 14 and name HE22))
(( segid " " and resid 14 and name HA ))
4.600 2.700 1.400 peak 883 spectrum 1 weight 0.11000E+01 volume 0.64423E-03 ppm1 7.390 ppm2 4.007 CV 1
ASSI { 884}
(( segid " " and resid 14 and name HE21))
(( segid " " and resid 14 and name HA ))
5.500 3.800 0.500 peak 884 spectrum 1 weight 0.11000E+01 volume 0.18679E-03 ppm1 7.985 ppm2 4.008 CV 1
ASSI { 885}
(( segid " " and resid 14 and name HE22))
(( segid " " and resid 39 and name HA ))
6.000 6.000 0.000 peak 885 spectrum 1 weight 0.11000E+01 volume 0.34057E-04 ppm1 7.391 ppm2 4.553 CV 1
ASSI { 889}
(( segid " " and resid 14 and name HE22))
(( segid " " and resid 14 and name HB2 ))
4.900 3.000 1.100 peak 889 spectrum 1 weight 0.11000E+01 volume 0.17788E-03 ppm1 7.395 ppm2 2.097 CV 1
ASSI { 890}
(( segid " " and resid 14 and name HE22))
(( segid " " and resid 14 and name HB1 ))
5.900 4.300 0.100 peak 890 spectrum 1 weight 0.11000E+01 volume 0.19602E-03 ppm1 7.391 ppm2 1.654 CV 1
ASSI { 891}
(( segid " " and resid 14 and name HE22))
( segid " " and resid 40 and name HG2%)
6.000 6.000 0.000 peak 891 spectrum 1 weight 0.11000E+01 volume 0.13786E-03 ppm1 7.392 ppm2 0.851 CV 1
ASSI { 892}
(( segid " " and resid 14 and name HE22))
( segid " " and resid 33 and name HD2%)
6.000 5.100 0.000 peak 892 spectrum 1 weight 0.11000E+01 volume 0.64036E-04 ppm1 7.392 ppm2 0.543 CV 1
ASSI { 893}
(( segid " " and resid 14 and name HE22))
( segid " " and resid 33 and name HD1%)
6.000 6.000 0.000 peak 893 spectrum 1 weight 0.11000E+01 volume 0.13656E-03 ppm1 7.396 ppm2 0.233 CV 1
ASSI { 894}
(( segid " " and resid 14 and name HE21))
( segid " " and resid 33 and name HD1%)
5.900 4.400 0.100 peak 894 spectrum 1 weight 0.11000E+01 volume 0.13403E-03 ppm1 7.983 ppm2 0.234 CV 1
ASSI { 895}
(( segid " " and resid 14 and name HE21))
( segid " " and resid 33 and name HD2%)
4.800 2.900 1.200 peak 895 spectrum 1 weight 0.11000E+01 volume 0.74502E-04 ppm1 7.976 ppm2 0.538 CV 1
ASSI { 896}
(( segid " " and resid 14 and name HE21))
( segid " " and resid 40 and name HG2%)
6.000 6.000 0.000 peak 896 spectrum 1 weight 0.11000E+01 volume 0.11757E-03 ppm1 7.984 ppm2 0.855 CV 1
ASSI { 897}
(( segid " " and resid 14 and name HE21))
(( segid " " and resid 14 and name HB1 ))
4.700 2.800 1.300 peak 897 spectrum 1 weight 0.11000E+01 volume 0.24049E-03 ppm1 7.984 ppm2 1.670 CV 1
ASSI { 898}
(( segid " " and resid 14 and name HE21))
(( segid " " and resid 14 and name HB2 ))
4.200 2.200 1.800 peak 898 spectrum 1 weight 0.11000E+01 volume 0.15926E-03 ppm1 7.986 ppm2 2.098 CV 1
ASSI { 899}
(( segid " " and resid 14 and name HE21))
(( segid " " and resid 40 and name HG12))
6.000 6.000 0.000 peak 899 spectrum 1 weight 0.11000E+01 volume 0.66371E-05 ppm1 7.983 ppm2 1.363 CV 1
ASSI { 901}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 34 and name HN ))
6.000 6.000 0.000 peak 901 spectrum 1 weight 0.11000E+01 volume 0.12863E-04 ppm1 7.706 ppm2 8.660 CV 1
ASSI { 904}
(( segid " " and resid 13 and name HE21))
(( segid " " and resid 14 and name HN ))
6.000 6.000 0.000 peak 904 spectrum 1 weight 0.11000E+01 volume 0.11766E-04 ppm1 7.661 ppm2 9.336 CV 1
ASSI { 908}
(( segid " " and resid 13 and name HE22))
(( segid " " and resid 15 and name HN ))
6.000 6.000 0.000 peak 908 spectrum 1 weight 0.11000E+01 volume 0.28509E-04 ppm1 6.938 ppm2 8.814 CV 1
ASSI { 909}
(( segid " " and resid 13 and name HE22))
(( segid " " and resid 13 and name HE21))
1.600 0.300 0.600 peak 909 spectrum 1 weight 0.11000E+01 volume 0.25084E-01 ppm1 6.940 ppm2 7.674 CV 1
ASSI { 911}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 39 and name HB2 ))
6.000 6.000 0.000 peak 911 spectrum 1 weight 0.11000E+01 volume 0.39195E-04 ppm1 7.708 ppm2 2.847 CV 1
ASSI { 912}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 39 and name HB1 ))
5.600 3.900 0.400 peak 912 spectrum 1 weight 0.11000E+01 volume 0.22192E-03 ppm1 7.710 ppm2 2.635 CV 1
ASSI { 913}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 38 and name HA1 ))
3.900 1.900 1.900 peak 913 spectrum 1 weight 0.11000E+01 volume 0.15956E-02 ppm1 7.713 ppm2 2.455 CV 1
ASSI { 915}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 33 and name HB1 ))
5.500 3.800 0.500 peak 915 spectrum 1 weight 0.11000E+01 volume 0.53286E-04 ppm1 7.706 ppm2 0.079 CV 1
ASSI { 923}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 45 and name HG2 ))
6.000 6.000 0.000 peak 923 spectrum 1 weight 0.11000E+01 volume 0.18847E-04 ppm1 8.113 ppm2 2.402 CV 1
ASSI { 925}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HA ))
3.000 1.100 1.100 peak 925 spectrum 1 weight 0.11000E+01 volume 0.20899E-02 ppm1 8.526 ppm2 4.716 CV 1
ASSI { 926}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 36 and name HG2%)
2.700 2.700 3.300 peak 926 spectrum 1 weight 0.11000E+01 volume 0.11550E-02 ppm1 8.388 ppm2 1.013 CV 1
ASSI { 927}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 14 and name HN ))
6.000 6.000 0.000 peak 927 spectrum 1 weight 0.11000E+01 volume 0.16573E-04 ppm1 8.156 ppm2 9.273 CV 1
ASSI { 928}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 6 and name HN ))
2.800 2.800 3.200 peak 928 spectrum 1 weight 0.11000E+01 volume 0.92142E-03 ppm1 8.141 ppm2 8.522 CV 1
ASSI { 932}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 18 and name HD2%)
6.000 6.000 0.000 peak 932 spectrum 1 weight 0.11000E+01 volume 0.81292E-05 ppm1 7.967 ppm2 0.532 CV 1
ASSI { 934}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 33 and name HG ))
3.300 1.400 1.400 peak 934 spectrum 1 weight 0.11000E+01 volume 0.16292E-02 ppm1 6.879 ppm2 1.394 CV 1
ASSI { 937}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 9 and name HG1%)
6.000 6.000 0.000 peak 937 spectrum 1 weight 0.11000E+01 volume 0.16130E-07 ppm1 7.430 ppm2 0.939 CV 1
ASSI { 938}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA ))
6.000 4.900 0.000 peak 938 spectrum 1 weight 0.11000E+01 volume 0.22880E-04 ppm1 7.420 ppm2 5.421 CV 1
ASSI { 941}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 35 and name HN ))
2.500 0.800 0.800 peak 941 spectrum 1 weight 0.11000E+01 volume 0.33619E-02 ppm1 8.662 ppm2 7.740 CV 1
ASSI { 943}
(( segid " " and resid 34 and name HN ))
( segid " " and resid 11 and name HD% )
4.300 2.300 1.700 peak 943 spectrum 1 weight 0.11000E+01 volume 0.50016E-03 ppm1 8.658 ppm2 7.046 CV 1
ASSI { 946}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 33 and name HD2%)
3.100 3.100 2.900 peak 946 spectrum 1 weight 0.11000E+01 volume 0.33274E-02 ppm1 8.781 ppm2 0.539 CV 1
ASSI { 947}
(( segid " " and resid 15 and name HN ))
( segid " " and resid 33 and name HD1%)
5.700 4.000 0.300 peak 947 spectrum 1 weight 0.11000E+01 volume 0.92633E-04 ppm1 8.778 ppm2 0.246 CV 1
ASSI { 948}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 50 and name HN ))
6.000 6.000 0.000 peak 948 spectrum 1 weight 0.11000E+01 volume 0.76779E-05 ppm1 8.417 ppm2 8.012 CV 1
ASSI { 949}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 40 and name HN ))
5.900 4.300 0.100 peak 949 spectrum 1 weight 0.11000E+01 volume 0.10791E-04 ppm1 8.277 ppm2 8.927 CV 1
ASSI { 950}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 47 and name HD1%)
4.400 2.500 1.600 peak 950 spectrum 1 weight 0.11000E+01 volume 0.80233E-03 ppm1 8.421 ppm2 0.773 CV 1
ASSI { 951}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 41 and name HB1 ))
6.000 6.000 0.000 peak 951 spectrum 1 weight 0.11000E+01 volume 0.11807E-04 ppm1 8.282 ppm2 2.695 CV 1
ASSI { 952}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 18 and name HB2 ))
6.000 6.000 0.000 peak 952 spectrum 1 weight 0.11000E+01 volume 0.86131E-05 ppm1 7.676 ppm2 1.923 CV 1
ASSI { 953}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 11 and name HA ))
6.000 4.500 0.000 peak 953 spectrum 1 weight 0.11000E+01 volume 0.33936E-04 ppm1 8.775 ppm2 5.402 CV 1
ASSI { 954}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 33 and name HD1%)
6.000 6.000 0.000 peak 954 spectrum 1 weight 0.11000E+01 volume 0.51640E-04 ppm1 7.954 ppm2 0.267 CV 1
ASSI { 956}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 42 and name HN ))
4.400 2.400 1.600 peak 956 spectrum 1 weight 0.11000E+01 volume 0.63729E-04 ppm1 7.497 ppm2 8.101 CV 1
ASSI { 957}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 42 and name HA ))
3.500 1.500 1.500 peak 957 spectrum 1 weight 0.11000E+01 volume 0.11869E-02 ppm1 7.490 ppm2 4.177 CV 1
ASSI { 958}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 29 and name HB2 ))
6.000 6.000 0.000 peak 958 spectrum 1 weight 0.11000E+01 volume 0.40162E-05 ppm1 8.093 ppm2 2.961 CV 1
ASSI { 961}
(( segid " " and resid 24 and name HN ))
( segid " " and resid 18 and name HD1%)
6.000 6.000 0.000 peak 961 spectrum 1 weight 0.11000E+01 volume 0.56532E-05 ppm1 7.784 ppm2 0.530 CV 1
ASSI { 962}
(( segid " " and resid 24 and name HN ))
( segid " " and resid 47 and name HD2%)
6.000 6.000 0.000 peak 962 spectrum 1 weight 0.11000E+01 volume 0.37316E-04 ppm1 7.790 ppm2 0.262 CV 1
ASSI { 963}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HN ))
3.300 1.400 1.400 peak 963 spectrum 1 weight 0.11000E+01 volume 0.31415E-02 ppm1 8.021 ppm2 8.331 CV 1
ASSI { 964}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HN ))
2.200 0.600 0.600 peak 964 spectrum 1 weight 0.11000E+01 volume 0.13229E-01 ppm1 8.021 ppm2 7.796 CV 1
ASSI { 965}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 46 and name HN ))
3.400 3.400 2.600 peak 965 spectrum 1 weight 0.11000E+01 volume 0.29667E-03 ppm1 8.024 ppm2 7.508 CV 1
ASSI { 970}
(( segid " " and resid 19 and name HD21))
(( segid " " and resid 20 and name HN ))
6.000 4.800 0.000 peak 970 spectrum 1 weight 0.11000E+01 volume 0.32759E-04 ppm1 7.951 ppm2 8.356 CV 1
ASSI { 973}
(( segid " " and resid 25 and name HD21))
( segid " " and resid 28 and name HB% )
4.100 2.100 1.900 peak 973 spectrum 1 weight 0.11000E+01 volume 0.38970E-03 ppm1 7.797 ppm2 1.317 CV 1
ASSI { 978}
(( segid " " and resid 25 and name HD21))
(( segid " " and resid 28 and name HA ))
6.000 6.000 0.000 peak 978 spectrum 1 weight 0.11000E+01 volume 0.87907E-06 ppm1 7.794 ppm2 4.013 CV 1
ASSI { 979}
(( segid " " and resid 25 and name HD22))
(( segid " " and resid 28 and name HA ))
6.000 6.000 0.000 peak 979 spectrum 1 weight 0.11000E+01 volume 0.72986E-05 ppm1 7.078 ppm2 4.011 CV 1
ASSI { 982}
(( segid " " and resid 25 and name HD21))
(( segid " " and resid 26 and name HN ))
4.900 3.000 1.100 peak 982 spectrum 1 weight 0.11000E+01 volume 0.14325E-03 ppm1 7.797 ppm2 8.384 CV 1
ASSI { 983}
(( segid " " and resid 25 and name HD21))
(( segid " " and resid 25 and name HN ))
5.400 3.600 0.600 peak 983 spectrum 1 weight 0.11000E+01 volume 0.12448E-03 ppm1 7.799 ppm2 9.104 CV 1
ASSI { 986}
(( segid " " and resid 25 and name HD21))
(( segid " " and resid 29 and name HN ))
6.000 5.400 0.000 peak 986 spectrum 1 weight 0.11000E+01 volume 0.30380E-04 ppm1 7.800 ppm2 8.643 CV 1
ASSI { 988}
(( segid " " and resid 25 and name HD22))
(( segid " " and resid 27 and name HB1 ))
6.000 6.000 0.000 peak 988 spectrum 1 weight 0.11000E+01 volume 0.80341E-04 ppm1 7.078 ppm2 2.043 CV 1
ASSI { 992}
(( segid " " and resid 51 and name HE22))
(( segid " " and resid 49 and name HA2 ))
3.200 3.200 2.800 peak 992 spectrum 1 weight 0.11000E+01 volume 0.44945E-03 ppm1 6.919 ppm2 4.003 CV 1
ASSI { 993}
(( segid " " and resid 51 and name HE22))
(( segid " " and resid 51 and name HA ))
3.900 1.900 1.900 peak 993 spectrum 1 weight 0.11000E+01 volume 0.13112E-03 ppm1 6.914 ppm2 4.349 CV 1
ASSI { 1003}
(( segid " " and resid 51 and name HE21))
(( segid " " and resid 51 and name HB2 ))
4.300 2.300 1.700 peak 1003 spectrum 1 weight 0.11000E+01 volume 0.28309E-03 ppm1 7.622 ppm2 2.155 CV 1
ASSI { 1004}
(( segid " " and resid 51 and name HE21))
(( segid " " and resid 51 and name HG2 ))
3.200 1.200 1.200 peak 1004 spectrum 1 weight 0.11000E+01 volume 0.13850E-02 ppm1 7.621 ppm2 2.394 CV 1
ASSI { 1006}
(( segid " " and resid 51 and name HE21))
(( segid " " and resid 51 and name HA ))
4.600 2.600 1.400 peak 1006 spectrum 1 weight 0.11000E+01 volume 0.36352E-03 ppm1 7.620 ppm2 4.350 CV 1
ASSI { 1009}
(( segid " " and resid 51 and name HE22))
(( segid " " and resid 51 and name HG2 ))
4.300 2.300 1.700 peak 1009 spectrum 1 weight 0.11000E+01 volume 0.78655E-03 ppm1 6.914 ppm2 2.398 CV 1
ASSI { 1010}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 11 and name HA ))
6.000 6.000 0.000 peak 1010 spectrum 1 weight 0.11000E+01 volume 0.10839E-04 ppm1 8.907 ppm2 5.454 CV 1
Contact the webmaster for help, if required. Saturday, May 18, 2024 4:34:17 PM GMT (wattos1)