NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
13184 |
1u85   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 2}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HN ))
2.800 1.000 1.000 peak 2 spectrum 1 weight 0.10000E+01 volume 0.19693E-02 ppm1 4.748 ppm2 9.764 CV 1
ASSI { 3}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HN ))
2.400 0.700 0.700 peak 3 spectrum 1 weight 0.10000E+01 volume 0.49762E-02 ppm1 4.788 ppm2 9.336 CV 1
ASSI { 4}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HN ))
2.200 0.600 0.600 peak 4 spectrum 1 weight 0.10000E+01 volume 0.89155E-02 ppm1 2.070 ppm2 9.336 CV 1
ASSI { 5}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 12 and name HN ))
2.300 0.600 0.600 peak 5 spectrum 1 weight 0.10000E+01 volume 0.70082E-02 ppm1 1.388 ppm2 9.335 CV 1
ASSI { 6}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HN ))
2.600 0.900 0.900 peak 6 spectrum 1 weight 0.10000E+01 volume 0.29614E-02 ppm1 4.793 ppm2 9.070 CV 1
ASSI { 7}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HN ))
2.300 0.600 0.600 peak 7 spectrum 1 weight 0.10000E+01 volume 0.70690E-02 ppm1 3.646 ppm2 9.070 CV 1
ASSI { 8}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HB3 ))
2.800 1.000 1.000 peak 8 spectrum 1 weight 0.10000E+01 volume 0.18727E-02 ppm1 4.793 ppm2 3.647 CV 1
ASSI { 9}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HN ))
2.400 0.700 0.700 peak 9 spectrum 1 weight 0.10000E+01 volume 0.55682E-02 ppm1 4.309 ppm2 8.862 CV 1
ASSI { 10}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HN ))
2.400 0.700 0.700 peak 10 spectrum 1 weight 0.10000E+01 volume 0.46114E-02 ppm1 2.731 ppm2 8.863 CV 1
ASSI { 11}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 21 and name HN ))
2.500 0.800 0.800 peak 11 spectrum 1 weight 0.10000E+01 volume 0.35969E-02 ppm1 2.600 ppm2 8.862 CV 1
ASSI { 12}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB3 ))
2.300 0.700 0.700 peak 12 spectrum 1 weight 0.10000E+01 volume 0.64002E-02 ppm1 4.305 ppm2 2.598 CV 1
ASSI { 13}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB2 ))
2.100 2.100 3.900 peak 13 spectrum 1 weight 0.10000E+01 volume 0.12180E-01 ppm1 4.304 ppm2 2.738 CV 1
ASSI { 15}
(( segid " " and resid 2 and name HB3 ))
(( segid " " and resid 2 and name HN ))
4.100 2.100 2.100 peak 15 spectrum 1 weight 0.10000E+01 volume 0.20260E-03 ppm1 3.876 ppm2 8.821 CV 1
OR { 15}
(( segid " " and resid 2 and name HB2 ))
(( segid " " and resid 2 and name HN ))
ASSI { 19}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HN ))
2.600 2.600 3.400 peak 19 spectrum 1 weight 0.10000E+01 volume 0.30567E-02 ppm1 2.858 ppm2 8.665 CV 1
ASSI { 23}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HN ))
2.500 0.800 0.800 peak 23 spectrum 1 weight 0.10000E+01 volume 0.36545E-02 ppm1 3.113 ppm2 8.605 CV 1
ASSI { 24}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HN ))
2.600 0.900 0.900 peak 24 spectrum 1 weight 0.10000E+01 volume 0.29591E-02 ppm1 4.307 ppm2 8.602 CV 1
ASSI { 27}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB3 ))
2.400 0.700 0.700 peak 27 spectrum 1 weight 0.10000E+01 volume 0.45474E-02 ppm1 4.314 ppm2 2.074 CV 1
OR { 27}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 30}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HN ))
2.100 0.600 0.600 peak 30 spectrum 1 weight 0.10000E+01 volume 0.97699E-02 ppm1 2.073 ppm2 8.602 CV 1
OR { 30}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HN ))
ASSI { 32}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HN ))
2.300 0.700 0.700 peak 32 spectrum 1 weight 0.10000E+01 volume 0.57730E-02 ppm1 4.597 ppm2 8.302 CV 1
ASSI { 33}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HN ))
2.100 2.100 3.900 peak 33 spectrum 1 weight 0.10000E+01 volume 0.10810E-01 ppm1 2.703 ppm2 8.302 CV 1
ASSI { 34}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB3 ))
2.000 0.500 0.500 peak 34 spectrum 1 weight 0.10000E+01 volume 0.12676E-01 ppm1 4.600 ppm2 2.704 CV 1
OR { 34}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 35}
(( segid " " and resid 15 and name HD1 ))
(( segid " " and resid 15 and name HE1 ))
2.200 0.600 0.600 peak 35 spectrum 1 weight 0.10000E+01 volume 0.83427E-02 ppm1 7.777 ppm2 10.240 CV 1
ASSI { 36}
(( segid " " and resid 15 and name HZ2 ))
(( segid " " and resid 15 and name HE1 ))
2.600 0.900 0.900 peak 36 spectrum 1 weight 0.10000E+01 volume 0.28939E-02 ppm1 7.566 ppm2 10.240 CV 1
ASSI { 38}
(( segid " " and resid 4 and name HA2 ))
(( segid " " and resid 4 and name HN ))
2.200 0.600 0.600 peak 38 spectrum 1 weight 0.10000E+01 volume 0.86755E-02 ppm1 3.931 ppm2 8.503 CV 1
OR { 38}
(( segid " " and resid 4 and name HA1 ))
(( segid " " and resid 4 and name HN ))
ASSI { 39}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HN ))
2.600 0.900 0.900 peak 39 spectrum 1 weight 0.10000E+01 volume 0.29403E-02 ppm1 4.498 ppm2 8.506 CV 1
ASSI { 40}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HN ))
2.200 0.600 0.600 peak 40 spectrum 1 weight 0.10000E+01 volume 0.73987E-02 ppm1 1.537 ppm2 8.505 CV 1
ASSI { 41}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HN ))
3.200 1.200 1.200 peak 41 spectrum 1 weight 0.10000E+01 volume 0.95555E-03 ppm1 4.395 ppm2 8.425 CV 1
ASSI { 42}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HN ))
2.700 0.900 0.900 peak 42 spectrum 1 weight 0.10000E+01 volume 0.24833E-02 ppm1 4.405 ppm2 8.286 CV 1
ASSI { 44}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 32 and name HN ))
2.900 1.000 1.000 peak 44 spectrum 1 weight 0.10000E+01 volume 0.16641E-02 ppm1 1.599 ppm2 8.285 CV 1
ASSI { 45}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HN ))
2.500 0.800 0.800 peak 45 spectrum 1 weight 0.10000E+01 volume 0.38337E-02 ppm1 4.696 ppm2 8.226 CV 1
ASSI { 46}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 8 and name HN ))
2.200 0.600 0.600 peak 46 spectrum 1 weight 0.10000E+01 volume 0.87107E-02 ppm1 3.029 ppm2 8.226 CV 1
ASSI { 47}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HE ))
2.600 0.800 0.800 peak 47 spectrum 1 weight 0.10000E+01 volume 0.33281E-02 ppm1 3.151 ppm2 8.120 CV 1
ASSI { 49}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HE ))
2.500 0.800 0.800 peak 49 spectrum 1 weight 0.10000E+01 volume 0.42497E-02 ppm1 2.605 ppm2 8.120 CV 1
ASSI { 51}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
2.600 0.800 0.800 peak 51 spectrum 1 weight 0.10000E+01 volume 0.33985E-02 ppm1 4.047 ppm2 8.089 CV 1
ASSI { 52}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 5 and name HN ))
2.300 0.700 0.700 peak 52 spectrum 1 weight 0.10000E+01 volume 0.65602E-02 ppm1 1.783 ppm2 8.088 CV 1
ASSI { 55}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HN ))
2.300 0.700 0.700 peak 55 spectrum 1 weight 0.10000E+01 volume 0.58818E-02 ppm1 3.969 ppm2 7.966 CV 1
ASSI { 56}
( segid " " and resid 24 and name HB% )
(( segid " " and resid 24 and name HN ))
2.000 0.500 0.500 peak 56 spectrum 1 weight 0.10000E+01 volume 0.16109E-01 ppm1 1.433 ppm2 7.966 CV 1
ASSI { 57}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 24 and name HB% )
2.000 0.500 0.500 peak 57 spectrum 1 weight 0.10000E+01 volume 0.12698E-01 ppm1 3.969 ppm2 1.433 CV 1
ASSI { 58}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB ))
2.400 0.700 0.700 peak 58 spectrum 1 weight 0.10000E+01 volume 0.49282E-02 ppm1 4.049 ppm2 1.787 CV 1
ASSI { 63}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HN ))
2.800 1.000 1.000 peak 63 spectrum 1 weight 0.10000E+01 volume 0.20775E-02 ppm1 4.933 ppm2 7.890 CV 1
ASSI { 64}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HN ))
3.100 1.200 1.200 peak 64 spectrum 1 weight 0.10000E+01 volume 0.10244E-02 ppm1 4.047 ppm2 7.745 CV 1
ASSI { 65}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB ))
3.400 1.500 1.500 peak 65 spectrum 1 weight 0.10000E+01 volume 0.55906E-03 ppm1 4.046 ppm2 2.082 CV 1
ASSI { 66}
(( segid " " and resid 33 and name HB ))
(( segid " " and resid 33 and name HN ))
3.100 1.200 1.200 peak 66 spectrum 1 weight 0.10000E+01 volume 0.10269E-02 ppm1 2.080 ppm2 7.740 CV 1
ASSI { 67}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HN ))
2.800 0.900 0.900 peak 67 spectrum 1 weight 0.10000E+01 volume 0.21668E-02 ppm1 5.164 ppm2 7.712 CV 1
ASSI { 68}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HN ))
3.000 1.100 1.100 peak 68 spectrum 1 weight 0.10000E+01 volume 0.13034E-02 ppm1 3.591 ppm2 7.711 CV 1
ASSI { 69}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HN ))
3.100 1.200 1.200 peak 69 spectrum 1 weight 0.10000E+01 volume 0.10407E-02 ppm1 3.789 ppm2 7.711 CV 1
ASSI { 70}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB3 ))
2.400 0.700 0.700 peak 70 spectrum 1 weight 0.10000E+01 volume 0.54658E-02 ppm1 5.164 ppm2 3.593 CV 1
ASSI { 71}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB2 ))
2.400 0.700 0.700 peak 71 spectrum 1 weight 0.10000E+01 volume 0.55202E-02 ppm1 5.164 ppm2 3.795 CV 1
ASSI { 72}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HN ))
2.200 0.600 0.600 peak 72 spectrum 1 weight 0.10000E+01 volume 0.91651E-02 ppm1 4.040 ppm2 7.662 CV 1
ASSI { 77}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HN ))
2.400 0.700 0.700 peak 77 spectrum 1 weight 0.10000E+01 volume 0.54242E-02 ppm1 4.475 ppm2 7.583 CV 1
ASSI { 78}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HN ))
2.300 2.300 3.700 peak 78 spectrum 1 weight 0.10000E+01 volume 0.67586E-02 ppm1 2.030 ppm2 7.582 CV 1
ASSI { 83}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HN ))
2.000 0.500 0.500 peak 83 spectrum 1 weight 0.10000E+01 volume 0.16084E-01 ppm1 1.646 ppm2 7.502 CV 1
ASSI { 84}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HN ))
2.300 2.300 3.700 peak 84 spectrum 1 weight 0.10000E+01 volume 0.56578E-02 ppm1 1.553 ppm2 7.502 CV 1
ASSI { 85}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
2.300 0.700 0.700 peak 85 spectrum 1 weight 0.10000E+01 volume 0.60418E-02 ppm1 4.029 ppm2 1.649 CV 1
ASSI { 86}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB3 ))
2.100 0.600 0.600 peak 86 spectrum 1 weight 0.10000E+01 volume 0.10023E-01 ppm1 4.037 ppm2 1.540 CV 1
ASSI { 87}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HN ))
2.800 1.000 1.000 peak 87 spectrum 1 weight 0.10000E+01 volume 0.20721E-02 ppm1 4.612 ppm2 7.432 CV 1
ASSI { 88}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HB3 ))
2.900 1.100 1.100 peak 88 spectrum 1 weight 0.10000E+01 volume 0.15085E-02 ppm1 4.612 ppm2 1.062 CV 1
ASSI { 89}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HN ))
2.800 1.000 1.000 peak 89 spectrum 1 weight 0.10000E+01 volume 0.17873E-02 ppm1 1.059 ppm2 7.430 CV 1
ASSI { 90}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HN ))
2.400 0.700 0.700 peak 90 spectrum 1 weight 0.10000E+01 volume 0.55330E-02 ppm1 4.726 ppm2 7.395 CV 1
ASSI { 91}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
2.300 0.700 0.700 peak 91 spectrum 1 weight 0.10000E+01 volume 0.63842E-02 ppm1 4.726 ppm2 3.299 CV 1
ASSI { 92}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB3 ))
2.400 0.700 0.700 peak 92 spectrum 1 weight 0.10000E+01 volume 0.49570E-02 ppm1 4.725 ppm2 3.156 CV 1
ASSI { 94}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HN ))
2.600 0.900 0.900 peak 94 spectrum 1 weight 0.10000E+01 volume 0.29598E-02 ppm1 3.296 ppm2 7.394 CV 1
ASSI { 95}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 30 and name HN ))
2.100 2.100 3.900 peak 95 spectrum 1 weight 0.10000E+01 volume 0.99331E-02 ppm1 3.165 ppm2 7.395 CV 1
ASSI { 96}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HN ))
2.500 0.800 0.800 peak 96 spectrum 1 weight 0.10000E+01 volume 0.35105E-02 ppm1 3.460 ppm2 7.130 CV 1
ASSI { 97}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 23 and name HN ))
2.300 0.700 0.700 peak 97 spectrum 1 weight 0.10000E+01 volume 0.66050E-02 ppm1 1.982 ppm2 7.129 CV 1
ASSI { 98}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB3 ))
2.600 0.800 0.800 peak 98 spectrum 1 weight 0.10000E+01 volume 0.31198E-02 ppm1 3.461 ppm2 1.980 CV 1
ASSI { 99}
(( segid " " and resid 29 and name HD2 ))
(( segid " " and resid 29 and name HE ))
2.600 0.900 0.900 peak 99 spectrum 1 weight 0.10000E+01 volume 0.28702E-02 ppm1 2.868 ppm2 7.064 CV 1
OR { 99}
(( segid " " and resid 29 and name HD3 ))
(( segid " " and resid 29 and name HE ))
ASSI { 102}
(( segid " " and resid 29 and name HG3 ))
(( segid " " and resid 29 and name HE ))
3.400 1.500 1.500 peak 102 spectrum 1 weight 0.10000E+01 volume 0.59138E-03 ppm1 1.100 ppm2 7.065 CV 1
ASSI { 103}
(( segid " " and resid 29 and name HG2 ))
(( segid " " and resid 29 and name HE ))
3.200 1.300 1.300 peak 103 spectrum 1 weight 0.10000E+01 volume 0.82051E-03 ppm1 1.297 ppm2 7.066 CV 1
ASSI { 106}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HN ))
2.400 0.700 0.700 peak 106 spectrum 1 weight 0.10000E+01 volume 0.53122E-02 ppm1 4.331 ppm2 7.320 CV 1
ASSI { 109}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HN ))
2.400 0.700 0.700 peak 109 spectrum 1 weight 0.10000E+01 volume 0.52994E-02 ppm1 3.278 ppm2 7.319 CV 1
ASSI { 110}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HN ))
2.200 0.600 0.600 peak 110 spectrum 1 weight 0.10000E+01 volume 0.83459E-02 ppm1 4.029 ppm2 7.254 CV 1
ASSI { 111}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name HN ))
2.300 2.300 3.700 peak 111 spectrum 1 weight 0.10000E+01 volume 0.56162E-02 ppm1 1.823 ppm2 7.254 CV 1
ASSI { 113}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HB3 ))
2.200 0.600 0.600 peak 113 spectrum 1 weight 0.10000E+01 volume 0.90339E-02 ppm1 4.698 ppm2 3.031 CV 1
ASSI { 114}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB3 ))
2.700 0.900 0.900 peak 114 spectrum 1 weight 0.10000E+01 volume 0.22542E-02 ppm1 4.794 ppm2 1.387 CV 1
ASSI { 115}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB2 ))
2.300 0.700 0.700 peak 115 spectrum 1 weight 0.10000E+01 volume 0.57346E-02 ppm1 4.791 ppm2 2.073 CV 1
ASSI { 116}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HB3 ))
2.000 0.500 0.500 peak 116 spectrum 1 weight 0.10000E+01 volume 0.13088E-01 ppm1 2.073 ppm2 1.389 CV 1
ASSI { 117}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB3 ))
2.200 0.600 0.600 peak 117 spectrum 1 weight 0.10000E+01 volume 0.80675E-02 ppm1 4.497 ppm2 1.539 CV 1
OR { 117}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB2 ))
ASSI { 118}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB2 ))
2.600 0.800 0.800 peak 118 spectrum 1 weight 0.10000E+01 volume 0.32065E-02 ppm1 4.410 ppm2 1.664 CV 1
ASSI { 119}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB3 ))
2.700 0.900 0.900 peak 119 spectrum 1 weight 0.10000E+01 volume 0.23594E-02 ppm1 4.410 ppm2 1.603 CV 1
ASSI { 120}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB3 ))
2.300 0.700 0.700 peak 120 spectrum 1 weight 0.10000E+01 volume 0.59778E-02 ppm1 4.476 ppm2 2.171 CV 1
ASSI { 121}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB2 ))
2.500 0.800 0.800 peak 121 spectrum 1 weight 0.10000E+01 volume 0.36385E-02 ppm1 4.476 ppm2 2.031 CV 1
ASSI { 122}
(( segid " " and resid 17 and name HZ ))
( segid " " and resid 17 and name HE% )
2.000 0.500 0.500 peak 122 spectrum 1 weight 0.10000E+01 volume 0.15156E-01 ppm1 6.456 ppm2 6.962 CV 1
ASSI { 123}
(( segid " " and resid 17 and name HZ ))
(( segid " " and resid 15 and name HE3 ))
2.700 0.900 0.900 peak 123 spectrum 1 weight 0.10000E+01 volume 0.22532E-02 ppm1 6.458 ppm2 7.453 CV 1
ASSI { 124}
( segid " " and resid 17 and name HE% )
( segid " " and resid 17 and name HD% )
2.000 0.500 0.500 peak 124 spectrum 1 weight 0.10000E+01 volume 0.16855E-01 ppm1 6.962 ppm2 7.455 CV 1
ASSI { 126}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 3 and name HN ))
3.100 1.200 1.200 peak 126 spectrum 1 weight 0.10000E+01 volume 0.97571E-03 ppm1 1.201 ppm2 8.423 CV 1
ASSI { 127}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HB ))
3.000 1.100 1.100 peak 127 spectrum 1 weight 0.10000E+01 volume 0.14093E-02 ppm1 4.397 ppm2 4.259 CV 1
ASSI { 129}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 3 and name HG2%)
2.700 0.900 0.900 peak 129 spectrum 1 weight 0.10000E+01 volume 0.26385E-02 ppm1 4.398 ppm2 1.200 CV 1
ASSI { 130}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HN ))
2.300 0.700 0.700 peak 130 spectrum 1 weight 0.10000E+01 volume 0.61922E-02 ppm1 2.825 ppm2 9.071 CV 1
ASSI { 131}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HB2 ))
1.900 0.400 0.400 peak 131 spectrum 1 weight 0.10000E+01 volume 0.21422E-01 ppm1 3.647 ppm2 2.829 CV 1
ASSI { 132}
(( segid " " and resid 15 and name HH2 ))
(( segid " " and resid 15 and name HZ2 ))
2.200 0.600 0.600 peak 132 spectrum 1 weight 0.10000E+01 volume 0.73027E-02 ppm1 7.293 ppm2 7.573 CV 1
ASSI { 133}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HN ))
2.600 0.800 0.800 peak 133 spectrum 1 weight 0.10000E+01 volume 0.32257E-02 ppm1 2.631 ppm2 9.033 CV 1
ASSI { 134}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HN ))
2.200 0.600 0.600 peak 134 spectrum 1 weight 0.10000E+01 volume 0.83587E-02 ppm1 2.720 ppm2 9.032 CV 1
ASSI { 135}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HN ))
2.500 0.800 0.800 peak 135 spectrum 1 weight 0.10000E+01 volume 0.37953E-02 ppm1 4.111 ppm2 9.032 CV 1
ASSI { 136}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 18 and name HN ))
2.800 1.000 1.000 peak 136 spectrum 1 weight 0.10000E+01 volume 0.18458E-02 ppm1 4.162 ppm2 9.764 CV 1
ASSI { 137}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 18 and name HN ))
2.900 1.000 1.000 peak 137 spectrum 1 weight 0.10000E+01 volume 0.16778E-02 ppm1 4.111 ppm2 9.765 CV 1
ASSI { 139}
( segid " " and resid 33 and name HG2%)
(( segid " " and resid 33 and name HN ))
3.000 1.100 1.100 peak 139 spectrum 1 weight 0.10000E+01 volume 0.13332E-02 ppm1 0.881 ppm2 7.738 CV 1
ASSI { 140}
(( segid " " and resid 9 and name HE22))
(( segid " " and resid 9 and name HE21))
1.800 0.400 0.400 peak 140 spectrum 1 weight 0.10000E+01 volume 0.29995E-01 ppm1 6.198 ppm2 8.156 CV 1
ASSI { 142}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HB2 ))
2.000 0.500 0.500 peak 142 spectrum 1 weight 0.10000E+01 volume 0.13764E-01 ppm1 3.743 ppm2 2.863 CV 1
ASSI { 143}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HN ))
3.000 1.200 1.200 peak 143 spectrum 1 weight 0.10000E+01 volume 0.11898E-02 ppm1 3.741 ppm2 8.665 CV 1
ASSI { 144}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HG2 ))
2.600 0.800 0.800 peak 144 spectrum 1 weight 0.10000E+01 volume 0.31172E-02 ppm1 4.608 ppm2 1.561 CV 1
ASSI { 145}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HG3 ))
2.800 1.000 1.000 peak 145 spectrum 1 weight 0.10000E+01 volume 0.19092E-02 ppm1 4.609 ppm2 1.399 CV 1
ASSI { 146}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HG2 ))
2.400 0.700 0.700 peak 146 spectrum 1 weight 0.10000E+01 volume 0.50370E-02 ppm1 3.153 ppm2 1.564 CV 1
ASSI { 147}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HG3 ))
2.400 0.700 0.700 peak 147 spectrum 1 weight 0.10000E+01 volume 0.53826E-02 ppm1 3.154 ppm2 1.400 CV 1
ASSI { 148}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HG2 ))
2.500 0.800 0.800 peak 148 spectrum 1 weight 0.10000E+01 volume 0.37825E-02 ppm1 2.606 ppm2 1.563 CV 1
ASSI { 149}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HG3 ))
2.500 0.800 0.800 peak 149 spectrum 1 weight 0.10000E+01 volume 0.37121E-02 ppm1 2.606 ppm2 1.400 CV 1
ASSI { 150}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HD3 ))
1.900 0.400 0.400 peak 150 spectrum 1 weight 0.10000E+01 volume 0.22583E-01 ppm1 3.154 ppm2 2.606 CV 1
ASSI { 151}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HB2 ))
3.100 1.200 1.200 peak 151 spectrum 1 weight 0.10000E+01 volume 0.10304E-02 ppm1 3.154 ppm2 2.011 CV 1
ASSI { 152}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HB2 ))
3.200 1.300 1.300 peak 152 spectrum 1 weight 0.10000E+01 volume 0.80707E-03 ppm1 2.606 ppm2 2.014 CV 1
ASSI { 153}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HG3 ))
3.700 1.700 1.700 peak 153 spectrum 1 weight 0.10000E+01 volume 0.34721E-03 ppm1 2.008 ppm2 1.402 CV 1
ASSI { 154}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HG2 ))
2.800 1.000 1.000 peak 154 spectrum 1 weight 0.10000E+01 volume 0.18807E-02 ppm1 2.012 ppm2 1.563 CV 1
ASSI { 156}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HG3 ))
2.300 0.700 0.700 peak 156 spectrum 1 weight 0.10000E+01 volume 0.57794E-02 ppm1 1.558 ppm2 1.393 CV 1
ASSI { 157}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB2 ))
2.200 2.200 3.800 peak 157 spectrum 1 weight 0.10000E+01 volume 0.92483E-02 ppm1 4.936 ppm2 3.404 CV 1
ASSI { 158}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB3 ))
2.100 0.600 0.600 peak 158 spectrum 1 weight 0.10000E+01 volume 0.95363E-02 ppm1 4.938 ppm2 3.279 CV 1
ASSI { 159}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HN ))
3.100 1.200 1.200 peak 159 spectrum 1 weight 0.10000E+01 volume 0.10103E-02 ppm1 3.277 ppm2 7.888 CV 1
ASSI { 160}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HN ))
3.100 1.200 1.200 peak 160 spectrum 1 weight 0.10000E+01 volume 0.10080E-02 ppm1 3.403 ppm2 7.890 CV 1
ASSI { 161}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HB3 ))
2.000 0.500 0.500 peak 161 spectrum 1 weight 0.10000E+01 volume 0.15441E-01 ppm1 3.401 ppm2 3.280 CV 1
ASSI { 163}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HN ))
2.900 1.100 1.100 peak 163 spectrum 1 weight 0.10000E+01 volume 0.14394E-02 ppm1 2.319 ppm2 8.601 CV 1
ASSI { 164}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HG3 ))
2.800 1.000 1.000 peak 164 spectrum 1 weight 0.10000E+01 volume 0.19108E-02 ppm1 4.310 ppm2 2.185 CV 1
ASSI { 165}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HG2 ))
2.800 1.000 1.000 peak 165 spectrum 1 weight 0.10000E+01 volume 0.20356E-02 ppm1 4.313 ppm2 2.322 CV 1
ASSI { 166}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 9 and name HB2 ))
2.200 0.600 0.600 peak 166 spectrum 1 weight 0.10000E+01 volume 0.85891E-02 ppm1 2.182 ppm2 2.073 CV 1
OR { 166}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 9 and name HB3 ))
ASSI { 167}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HB3 ))
2.100 0.600 0.600 peak 167 spectrum 1 weight 0.10000E+01 volume 0.10791E-01 ppm1 2.321 ppm2 2.075 CV 1
OR { 167}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 170}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HG3 ))
2.500 0.800 0.800 peak 170 spectrum 1 weight 0.10000E+01 volume 0.34721E-02 ppm1 1.539 ppm2 1.265 CV 1
OR { 170}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HG3 ))
ASSI { 171}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HG2 ))
2.400 0.700 0.700 peak 171 spectrum 1 weight 0.10000E+01 volume 0.48898E-02 ppm1 1.537 ppm2 1.327 CV 1
OR { 171}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HG2 ))
ASSI { 172}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HG2 ))
2.800 1.000 1.000 peak 172 spectrum 1 weight 0.10000E+01 volume 0.21329E-02 ppm1 4.500 ppm2 1.324 CV 1
ASSI { 173}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HG3 ))
2.500 0.800 0.800 peak 173 spectrum 1 weight 0.10000E+01 volume 0.38049E-02 ppm1 4.499 ppm2 1.265 CV 1
ASSI { 174}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 6 and name HN ))
2.700 2.700 3.300 peak 174 spectrum 1 weight 0.10000E+01 volume 0.22356E-02 ppm1 1.324 ppm2 8.506 CV 1
ASSI { 175}
(( segid " " and resid 6 and name HG3 ))
(( segid " " and resid 6 and name HN ))
3.300 1.300 1.300 peak 175 spectrum 1 weight 0.10000E+01 volume 0.77187E-03 ppm1 1.260 ppm2 8.505 CV 1
ASSI { 176}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HD2 ))
2.900 1.000 1.000 peak 176 spectrum 1 weight 0.10000E+01 volume 0.16263E-02 ppm1 2.916 ppm2 1.618 CV 1
OR { 176}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HD2 ))
ASSI { 177}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HB2 ))
3.200 1.300 1.300 peak 177 spectrum 1 weight 0.10000E+01 volume 0.89635E-03 ppm1 2.916 ppm2 1.539 CV 1
OR { 177}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HB2 ))
OR { 177}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HB3 ))
ASSI { 178}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HD3 ))
3.300 1.300 1.300 peak 178 spectrum 1 weight 0.10000E+01 volume 0.79139E-03 ppm1 2.916 ppm2 1.474 CV 1
OR { 178}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HD3 ))
ASSI { 179}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HG2 ))
3.200 1.300 1.300 peak 179 spectrum 1 weight 0.10000E+01 volume 0.90595E-03 ppm1 2.915 ppm2 1.328 CV 1
OR { 179}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HG2 ))
ASSI { 180}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HG3 ))
2.900 1.000 1.000 peak 180 spectrum 1 weight 0.10000E+01 volume 0.17524E-02 ppm1 2.913 ppm2 1.266 CV 1
OR { 180}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HG3 ))
ASSI { 182}
(( segid " " and resid 6 and name HD3 ))
(( segid " " and resid 6 and name HG3 ))
2.400 0.700 0.700 peak 182 spectrum 1 weight 0.10000E+01 volume 0.45602E-02 ppm1 1.480 ppm2 1.266 CV 1
ASSI { 183}
(( segid " " and resid 6 and name HD3 ))
(( segid " " and resid 6 and name HG2 ))
2.800 1.000 1.000 peak 183 spectrum 1 weight 0.10000E+01 volume 0.19985E-02 ppm1 1.480 ppm2 1.329 CV 1
ASSI { 184}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HG3 ))
2.900 1.100 1.100 peak 184 spectrum 1 weight 0.10000E+01 volume 0.15207E-02 ppm1 1.624 ppm2 1.266 CV 1
ASSI { 185}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HG2 ))
2.500 0.800 0.800 peak 185 spectrum 1 weight 0.10000E+01 volume 0.40609E-02 ppm1 1.626 ppm2 1.327 CV 1
ASSI { 188}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HB2 ))
2.400 0.700 0.700 peak 188 spectrum 1 weight 0.10000E+01 volume 0.50690E-02 ppm1 1.626 ppm2 1.539 CV 1
OR { 188}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HB3 ))
ASSI { 189}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HD3 ))
2.700 0.900 0.900 peak 189 spectrum 1 weight 0.10000E+01 volume 0.21863E-02 ppm1 1.627 ppm2 1.477 CV 1
ASSI { 190}
(( segid " " and resid 6 and name HD3 ))
(( segid " " and resid 6 and name HN ))
3.800 1.800 1.800 peak 190 spectrum 1 weight 0.10000E+01 volume 0.29771E-03 ppm1 1.476 ppm2 8.507 CV 1
ASSI { 191}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 6 and name HN ))
3.800 1.800 1.800 peak 191 spectrum 1 weight 0.10000E+01 volume 0.32353E-03 ppm1 1.624 ppm2 8.506 CV 1
ASSI { 192}
(( segid " " and resid 6 and name HE3 ))
(( segid " " and resid 6 and name HN ))
4.300 2.300 2.000 peak 192 spectrum 1 weight 0.10000E+01 volume 0.15796E-03 ppm1 2.913 ppm2 8.506 CV 1
OR { 192}
(( segid " " and resid 6 and name HE2 ))
(( segid " " and resid 6 and name HN ))
ASSI { 193}
( segid " " and resid 32 and name HD1%)
(( segid " " and resid 32 and name HN ))
4.000 2.000 2.000 peak 193 spectrum 1 weight 0.10000E+01 volume 0.24260E-03 ppm1 0.925 ppm2 8.285 CV 1
ASSI { 194}
( segid " " and resid 32 and name HD2%)
(( segid " " and resid 32 and name HN ))
3.500 1.500 1.500 peak 194 spectrum 1 weight 0.10000E+01 volume 0.52770E-03 ppm1 0.875 ppm2 8.287 CV 1
ASSI { 195}
(( segid " " and resid 32 and name HB3 ))
( segid " " and resid 32 and name HD1%)
2.800 1.000 1.000 peak 195 spectrum 1 weight 0.10000E+01 volume 0.18001E-02 ppm1 1.600 ppm2 0.928 CV 1
ASSI { 196}
(( segid " " and resid 32 and name HB3 ))
( segid " " and resid 32 and name HD2%)
2.700 0.900 0.900 peak 196 spectrum 1 weight 0.10000E+01 volume 0.22522E-02 ppm1 1.603 ppm2 0.873 CV 1
ASSI { 197}
(( segid " " and resid 32 and name HB2 ))
( segid " " and resid 32 and name HD2%)
2.400 0.700 0.700 peak 197 spectrum 1 weight 0.10000E+01 volume 0.49602E-02 ppm1 1.664 ppm2 0.874 CV 1
ASSI { 198}
(( segid " " and resid 32 and name HB2 ))
( segid " " and resid 32 and name HD1%)
2.700 0.900 0.900 peak 198 spectrum 1 weight 0.10000E+01 volume 0.24318E-02 ppm1 1.663 ppm2 0.927 CV 1
ASSI { 200}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 32 and name HD2%)
2.700 0.900 0.900 peak 200 spectrum 1 weight 0.10000E+01 volume 0.21940E-02 ppm1 4.410 ppm2 0.870 CV 1
ASSI { 201}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HE ))
2.800 1.000 1.000 peak 201 spectrum 1 weight 0.10000E+01 volume 0.19485E-02 ppm1 1.058 ppm2 8.120 CV 1
ASSI { 202}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name HE ))
3.100 1.200 1.200 peak 202 spectrum 1 weight 0.10000E+01 volume 0.11437E-02 ppm1 1.400 ppm2 8.120 CV 1
ASSI { 203}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HE ))
2.900 1.000 1.000 peak 203 spectrum 1 weight 0.10000E+01 volume 0.16161E-02 ppm1 1.561 ppm2 8.120 CV 1
ASSI { 204}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HE ))
2.500 0.800 0.800 peak 204 spectrum 1 weight 0.10000E+01 volume 0.37185E-02 ppm1 2.010 ppm2 8.120 CV 1
ASSI { 205}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name HN ))
3.600 1.600 1.600 peak 205 spectrum 1 weight 0.10000E+01 volume 0.46690E-03 ppm1 1.398 ppm2 7.430 CV 1
ASSI { 206}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HN ))
3.500 1.600 1.600 peak 206 spectrum 1 weight 0.10000E+01 volume 0.48834E-03 ppm1 1.558 ppm2 7.431 CV 1
ASSI { 208}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HG12))
3.100 1.200 1.200 peak 208 spectrum 1 weight 0.10000E+01 volume 0.11197E-02 ppm1 4.049 ppm2 1.148 CV 1
ASSI { 209}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 5 and name HG2%)
2.200 0.600 0.600 peak 209 spectrum 1 weight 0.10000E+01 volume 0.88227E-02 ppm1 4.040 ppm2 0.864 CV 1
ASSI { 210}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 5 and name HD1%)
2.600 0.800 0.800 peak 210 spectrum 1 weight 0.10000E+01 volume 0.30759E-02 ppm1 4.047 ppm2 1.428 CV 1
ASSI { 211}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 5 and name HN ))
3.000 1.100 1.100 peak 211 spectrum 1 weight 0.10000E+01 volume 0.12205E-02 ppm1 0.868 ppm2 8.087 CV 1
ASSI { 212}
(( segid " " and resid 5 and name HG12))
(( segid " " and resid 5 and name HN ))
3.100 1.200 1.200 peak 212 spectrum 1 weight 0.10000E+01 volume 0.10333E-02 ppm1 1.148 ppm2 8.088 CV 1
ASSI { 218}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HN ))
2.700 0.900 0.900 peak 218 spectrum 1 weight 0.10000E+01 volume 0.22718E-02 ppm1 1.539 ppm2 7.663 CV 1
ASSI { 219}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HN ))
2.600 0.900 0.900 peak 219 spectrum 1 weight 0.10000E+01 volume 0.29729E-02 ppm1 1.467 ppm2 7.661 CV 1
ASSI { 220}
(( segid " " and resid 29 and name HG2 ))
(( segid " " and resid 29 and name HN ))
2.500 0.800 0.800 peak 220 spectrum 1 weight 0.10000E+01 volume 0.39041E-02 ppm1 1.298 ppm2 7.662 CV 1
ASSI { 221}
(( segid " " and resid 29 and name HG3 ))
(( segid " " and resid 29 and name HN ))
2.600 0.800 0.800 peak 221 spectrum 1 weight 0.10000E+01 volume 0.32289E-02 ppm1 1.099 ppm2 7.662 CV 1
ASSI { 222}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HE ))
3.500 1.500 1.500 peak 222 spectrum 1 weight 0.10000E+01 volume 0.51522E-03 ppm1 1.463 ppm2 7.067 CV 1
ASSI { 223}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HE ))
3.300 1.300 1.300 peak 223 spectrum 1 weight 0.10000E+01 volume 0.75715E-03 ppm1 1.533 ppm2 7.066 CV 1
ASSI { 224}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 28 and name HN ))
2.300 2.300 3.700 peak 224 spectrum 1 weight 0.10000E+01 volume 0.59810E-02 ppm1 1.874 ppm2 7.254 CV 1
ASSI { 225}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 28 and name HN ))
2.300 0.600 0.600 peak 225 spectrum 1 weight 0.10000E+01 volume 0.71619E-02 ppm1 1.697 ppm2 7.254 CV 1
ASSI { 226}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 28 and name HN ))
2.500 0.800 0.800 peak 226 spectrum 1 weight 0.10000E+01 volume 0.36193E-02 ppm1 1.491 ppm2 7.254 CV 1
ASSI { 230}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HB2 ))
3.100 1.200 1.200 peak 230 spectrum 1 weight 0.10000E+01 volume 0.10000E-02 ppm1 2.640 ppm2 2.026 CV 1
ASSI { 231}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HB2 ))
3.200 1.300 1.300 peak 231 spectrum 1 weight 0.10000E+01 volume 0.80355E-03 ppm1 2.562 ppm2 2.027 CV 1
ASSI { 232}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HB3 ))
3.300 1.400 1.400 peak 232 spectrum 1 weight 0.10000E+01 volume 0.73315E-03 ppm1 2.563 ppm2 2.173 CV 1
ASSI { 233}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HB3 ))
3.200 1.300 1.300 peak 233 spectrum 1 weight 0.10000E+01 volume 0.91395E-03 ppm1 2.632 ppm2 2.172 CV 1
ASSI { 234}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HN ))
2.900 1.000 1.000 peak 234 spectrum 1 weight 0.10000E+01 volume 0.16250E-02 ppm1 2.560 ppm2 7.582 CV 1
ASSI { 235}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HN ))
2.700 0.900 0.900 peak 235 spectrum 1 weight 0.10000E+01 volume 0.22145E-02 ppm1 2.637 ppm2 7.582 CV 1
ASSI { 237}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HN ))
2.200 2.200 3.800 peak 237 spectrum 1 weight 0.10000E+01 volume 0.86339E-02 ppm1 3.188 ppm2 7.499 CV 1
ASSI { 238}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 26 and name HN ))
2.300 0.600 0.600 peak 238 spectrum 1 weight 0.10000E+01 volume 0.67106E-02 ppm1 2.824 ppm2 7.500 CV 1
ASSI { 239}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB3 ))
2.200 2.200 3.800 peak 239 spectrum 1 weight 0.10000E+01 volume 0.82659E-02 ppm1 4.030 ppm2 2.822 CV 1
ASSI { 240}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HB3 ))
2.000 0.500 0.500 peak 240 spectrum 1 weight 0.10000E+01 volume 0.13834E-01 ppm1 3.191 ppm2 2.823 CV 1
ASSI { 241}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HB2 ))
2.600 0.800 0.800 peak 241 spectrum 1 weight 0.10000E+01 volume 0.30567E-02 ppm1 4.036 ppm2 3.188 CV 1
ASSI { 242}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
2.600 0.800 0.800 peak 242 spectrum 1 weight 0.10000E+01 volume 0.30734E-02 ppm1 4.334 ppm2 3.278 CV 1
ASSI { 243}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB3 ))
2.300 0.700 0.700 peak 243 spectrum 1 weight 0.10000E+01 volume 0.65186E-02 ppm1 4.335 ppm2 3.121 CV 1
ASSI { 244}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HB3 ))
2.000 0.500 0.500 peak 244 spectrum 1 weight 0.10000E+01 volume 0.13248E-01 ppm1 3.280 ppm2 3.121 CV 1
ASSI { 245}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 22 and name HN ))
2.400 2.400 3.600 peak 245 spectrum 1 weight 0.10000E+01 volume 0.43458E-02 ppm1 3.119 ppm2 7.319 CV 1
ASSI { 246}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HB2 ))
2.400 0.700 0.700 peak 246 spectrum 1 weight 0.10000E+01 volume 0.45474E-02 ppm1 4.751 ppm2 4.167 CV 1
ASSI { 247}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HB3 ))
2.200 0.600 0.600 peak 247 spectrum 1 weight 0.10000E+01 volume 0.75523E-02 ppm1 4.753 ppm2 4.112 CV 1
ASSI { 248}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HB2 ))
2.400 0.700 0.700 peak 248 spectrum 1 weight 0.10000E+01 volume 0.53954E-02 ppm1 4.790 ppm2 2.831 CV 1
ASSI { 249}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HE3 ))
4.000 2.000 2.000 peak 249 spectrum 1 weight 0.10000E+01 volume 0.23095E-03 ppm1 4.496 ppm2 2.912 CV 1
OR { 249}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HE2 ))
ASSI { 251}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HG3 ))
2.800 0.900 0.900 peak 251 spectrum 1 weight 0.10000E+01 volume 0.21466E-02 ppm1 4.480 ppm2 2.560 CV 1
ASSI { 252}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HG2 ))
3.500 1.500 1.500 peak 252 spectrum 1 weight 0.10000E+01 volume 0.54338E-03 ppm1 4.483 ppm2 2.638 CV 1
ASSI { 253}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB2 ))
2.500 0.800 0.800 peak 253 spectrum 1 weight 0.10000E+01 volume 0.43234E-02 ppm1 4.112 ppm2 2.721 CV 1
ASSI { 255}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.100 0.500 0.500 peak 255 spectrum 1 weight 0.10000E+01 volume 0.12458E-01 ppm1 4.669 ppm2 2.363 CV 1
ASSI { 256}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB3 ))
2.600 0.900 0.900 peak 256 spectrum 1 weight 0.10000E+01 volume 0.28820E-02 ppm1 4.670 ppm2 2.032 CV 1
ASSI { 257}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HB3 ))
1.900 0.500 0.500 peak 257 spectrum 1 weight 0.10000E+01 volume 0.18644E-01 ppm1 2.361 ppm2 2.031 CV 1
ASSI { 258}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HN ))
2.300 0.700 0.700 peak 258 spectrum 1 weight 0.10000E+01 volume 0.62370E-02 ppm1 1.448 ppm2 7.128 CV 1
ASSI { 259}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB2 ))
2.300 0.700 0.700 peak 259 spectrum 1 weight 0.10000E+01 volume 0.56962E-02 ppm1 3.462 ppm2 1.451 CV 1
ASSI { 260}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 23 and name HB2 ))
2.200 0.600 0.600 peak 260 spectrum 1 weight 0.10000E+01 volume 0.87523E-02 ppm1 1.980 ppm2 1.451 CV 1
ASSI { 261}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 23 and name HG ))
2.300 0.700 0.700 peak 261 spectrum 1 weight 0.10000E+01 volume 0.59298E-02 ppm1 1.981 ppm2 1.645 CV 1
ASSI { 262}
(( segid " " and resid 23 and name HG ))
(( segid " " and resid 23 and name HB2 ))
2.700 0.900 0.900 peak 262 spectrum 1 weight 0.10000E+01 volume 0.23764E-02 ppm1 1.643 ppm2 1.449 CV 1
ASSI { 263}
(( segid " " and resid 23 and name HG ))
( segid " " and resid 23 and name HD1%)
2.400 0.700 0.700 peak 263 spectrum 1 weight 0.10000E+01 volume 0.51234E-02 ppm1 1.644 ppm2 1.195 CV 1
ASSI { 264}
(( segid " " and resid 23 and name HG ))
( segid " " and resid 23 and name HD2%)
2.300 0.600 0.600 peak 264 spectrum 1 weight 0.10000E+01 volume 0.70818E-02 ppm1 1.643 ppm2 1.098 CV 1
ASSI { 265}
(( segid " " and resid 23 and name HB3 ))
( segid " " and resid 23 and name HD1%)
2.600 0.800 0.800 peak 265 spectrum 1 weight 0.10000E+01 volume 0.31867E-02 ppm1 1.983 ppm2 1.198 CV 1
ASSI { 266}
(( segid " " and resid 23 and name HB3 ))
( segid " " and resid 23 and name HD2%)
2.300 0.600 0.600 peak 266 spectrum 1 weight 0.10000E+01 volume 0.68610E-02 ppm1 1.983 ppm2 1.096 CV 1
ASSI { 267}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 23 and name HD1%)
2.400 0.700 0.700 peak 267 spectrum 1 weight 0.10000E+01 volume 0.44994E-02 ppm1 1.452 ppm2 1.197 CV 1
ASSI { 268}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 23 and name HD2%)
2.300 0.700 0.700 peak 268 spectrum 1 weight 0.10000E+01 volume 0.64162E-02 ppm1 1.452 ppm2 1.101 CV 1
ASSI { 269}
( segid " " and resid 23 and name HD1%)
( segid " " and resid 23 and name HD2%)
2.300 0.600 0.600 peak 269 spectrum 1 weight 0.10000E+01 volume 0.68002E-02 ppm1 1.197 ppm2 1.104 CV 1
ASSI { 270}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 23 and name HD2%)
3.300 1.300 1.300 peak 270 spectrum 1 weight 0.10000E+01 volume 0.76963E-03 ppm1 3.460 ppm2 1.099 CV 1
ASSI { 271}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 23 and name HD1%)
2.300 0.700 0.700 peak 271 spectrum 1 weight 0.10000E+01 volume 0.63234E-02 ppm1 3.462 ppm2 1.200 CV 1
ASSI { 272}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HG ))
2.700 0.900 0.900 peak 272 spectrum 1 weight 0.10000E+01 volume 0.23300E-02 ppm1 3.462 ppm2 1.649 CV 1
ASSI { 273}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HB3 ))
2.800 1.000 1.000 peak 273 spectrum 1 weight 0.10000E+01 volume 0.21134E-02 ppm1 2.610 ppm2 1.059 CV 1
ASSI { 274}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HB3 ))
3.000 1.200 1.200 peak 274 spectrum 1 weight 0.10000E+01 volume 0.11933E-02 ppm1 3.150 ppm2 1.057 CV 1
ASSI { 275}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HD2 ))
3.300 1.300 1.300 peak 275 spectrum 1 weight 0.10000E+01 volume 0.74659E-03 ppm1 4.236 ppm2 3.724 CV 1
ASSI { 276}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HB3 ))
1.800 0.400 0.400 peak 276 spectrum 1 weight 0.10000E+01 volume 0.28251E-01 ppm1 2.022 ppm2 1.277 CV 1
ASSI { 277}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 7 and name HB3 ))
2.900 1.000 1.000 peak 277 spectrum 1 weight 0.10000E+01 volume 0.16036E-02 ppm1 1.871 ppm2 1.277 CV 1
ASSI { 278}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 7 and name HB3 ))
2.800 1.000 1.000 peak 278 spectrum 1 weight 0.10000E+01 volume 0.20305E-02 ppm1 1.793 ppm2 1.275 CV 1
ASSI { 279}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 7 and name HG3 ))
2.100 0.600 0.600 peak 279 spectrum 1 weight 0.10000E+01 volume 0.10896E-01 ppm1 1.874 ppm2 1.795 CV 1
ASSI { 280}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HG2 ))
2.200 0.600 0.600 peak 280 spectrum 1 weight 0.10000E+01 volume 0.76067E-02 ppm1 2.022 ppm2 1.875 CV 1
ASSI { 281}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HG3 ))
2.700 0.900 0.900 peak 281 spectrum 1 weight 0.10000E+01 volume 0.24577E-02 ppm1 2.020 ppm2 1.795 CV 1
ASSI { 282}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HG2 ))
2.500 0.800 0.800 peak 282 spectrum 1 weight 0.10000E+01 volume 0.40097E-02 ppm1 3.724 ppm2 1.876 CV 1
ASSI { 283}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HG3 ))
2.700 0.900 0.900 peak 283 spectrum 1 weight 0.10000E+01 volume 0.24308E-02 ppm1 3.724 ppm2 1.791 CV 1
ASSI { 284}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HB3 ))
3.300 1.300 1.300 peak 284 spectrum 1 weight 0.10000E+01 volume 0.78275E-03 ppm1 3.722 ppm2 1.275 CV 1
ASSI { 285}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HB2 ))
3.100 1.200 1.200 peak 285 spectrum 1 weight 0.10000E+01 volume 0.11156E-02 ppm1 3.722 ppm2 2.019 CV 1
ASSI { 286}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB2 ))
2.200 0.600 0.600 peak 286 spectrum 1 weight 0.10000E+01 volume 0.85347E-02 ppm1 4.235 ppm2 2.022 CV 1
ASSI { 287}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG2 ))
2.700 2.700 3.300 peak 287 spectrum 1 weight 0.10000E+01 volume 0.22618E-02 ppm1 4.235 ppm2 1.874 CV 1
ASSI { 288}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HG3 ))
3.000 1.100 1.100 peak 288 spectrum 1 weight 0.10000E+01 volume 0.13943E-02 ppm1 4.235 ppm2 1.795 CV 1
ASSI { 289}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB3 ))
2.400 0.700 0.700 peak 289 spectrum 1 weight 0.10000E+01 volume 0.55330E-02 ppm1 4.235 ppm2 1.276 CV 1
ASSI { 290}
(( segid " " and resid 5 and name HG12))
( segid " " and resid 5 and name HG2%)
2.300 0.600 0.600 peak 290 spectrum 1 weight 0.10000E+01 volume 0.69858E-02 ppm1 1.148 ppm2 0.866 CV 1
ASSI { 291}
( segid " " and resid 5 and name HD1%)
( segid " " and resid 5 and name HG2%)
2.500 0.800 0.800 peak 291 spectrum 1 weight 0.10000E+01 volume 0.38721E-02 ppm1 1.423 ppm2 0.865 CV 1
ASSI { 292}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 5 and name HG12))
2.100 0.500 0.500 peak 292 spectrum 1 weight 0.10000E+01 volume 0.12180E-01 ppm1 1.426 ppm2 1.142 CV 1
ASSI { 293}
(( segid " " and resid 5 and name HB ))
( segid " " and resid 5 and name HG2%)
2.400 0.700 0.700 peak 293 spectrum 1 weight 0.10000E+01 volume 0.52258E-02 ppm1 1.786 ppm2 0.866 CV 1
ASSI { 294}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 5 and name HG12))
3.200 1.300 1.300 peak 294 spectrum 1 weight 0.10000E+01 volume 0.90755E-03 ppm1 1.785 ppm2 1.143 CV 1
ASSI { 295}
(( segid " " and resid 5 and name HB ))
( segid " " and resid 5 and name HD1%)
2.500 0.800 0.800 peak 295 spectrum 1 weight 0.10000E+01 volume 0.37409E-02 ppm1 1.785 ppm2 1.429 CV 1
ASSI { 296}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HD3 ))
3.200 1.300 1.300 peak 296 spectrum 1 weight 0.10000E+01 volume 0.80643E-03 ppm1 4.236 ppm2 3.667 CV 1
ASSI { 297}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HB2 ))
2.900 1.100 1.100 peak 297 spectrum 1 weight 0.10000E+01 volume 0.15309E-02 ppm1 3.669 ppm2 2.022 CV 1
ASSI { 298}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HG2 ))
2.600 0.800 0.800 peak 298 spectrum 1 weight 0.10000E+01 volume 0.31480E-02 ppm1 3.669 ppm2 1.875 CV 1
ASSI { 299}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 7 and name HG3 ))
2.600 0.800 0.800 peak 299 spectrum 1 weight 0.10000E+01 volume 0.33569E-02 ppm1 3.669 ppm2 1.792 CV 1
ASSI { 300}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 6 and name HG3 ))
3.500 1.600 1.600 peak 300 spectrum 1 weight 0.10000E+01 volume 0.48674E-03 ppm1 3.670 ppm2 1.265 CV 1
ASSI { 301}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 6 and name HB3 ))
2.600 0.900 0.900 peak 301 spectrum 1 weight 0.10000E+01 volume 0.27905E-02 ppm1 3.670 ppm2 1.538 CV 1
ASSI { 302}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 6 and name HB3 ))
2.700 0.900 0.900 peak 302 spectrum 1 weight 0.10000E+01 volume 0.24814E-02 ppm1 3.726 ppm2 1.537 CV 1
ASSI { 303}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 7 and name HD3 ))
2.400 0.700 0.700 peak 303 spectrum 1 weight 0.10000E+01 volume 0.52930E-02 ppm1 3.724 ppm2 3.667 CV 1
ASSI { 305}
( segid " " and resid 8 and name HD% )
( segid " " and resid 8 and name HE% )
1.800 0.400 0.400 peak 305 spectrum 1 weight 0.10000E+01 volume 0.23860E-01 ppm1 7.179 ppm2 7.399 CV 1
ASSI { 307}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HE22))
3.600 1.600 1.600 peak 307 spectrum 1 weight 0.10000E+01 volume 0.41921E-03 ppm1 4.311 ppm2 6.200 CV 1
ASSI { 308}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HE22))
3.200 1.300 1.300 peak 308 spectrum 1 weight 0.10000E+01 volume 0.79907E-03 ppm1 2.075 ppm2 6.201 CV 1
OR { 308}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HE22))
ASSI { 311}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 11 and name HB3 ))
2.700 0.900 0.900 peak 311 spectrum 1 weight 0.10000E+01 volume 0.26046E-02 ppm1 4.325 ppm2 2.032 CV 1
ASSI { 312}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 11 and name HG3 ))
3.200 1.300 1.300 peak 312 spectrum 1 weight 0.10000E+01 volume 0.84419E-03 ppm1 4.329 ppm2 2.093 CV 1
OR { 312}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 11 and name HG2 ))
OR { 312}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 11 and name HG2 ))
ASSI { 313}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 11 and name HB2 ))
2.900 1.100 1.100 peak 313 spectrum 1 weight 0.10000E+01 volume 0.15809E-02 ppm1 4.325 ppm2 2.365 CV 1
OR { 313}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 11 and name HB2 ))
ASSI { 314}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HG3 ))
2.600 0.900 0.900 peak 314 spectrum 1 weight 0.10000E+01 volume 0.28468E-02 ppm1 4.672 ppm2 2.090 CV 1
OR { 314}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HG2 ))
ASSI { 316}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HG3 ))
2.200 0.600 0.600 peak 316 spectrum 1 weight 0.10000E+01 volume 0.75171E-02 ppm1 2.365 ppm2 2.091 CV 1
OR { 316}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HG2 ))
ASSI { 317}
(( segid " " and resid 15 and name HZ3 ))
(( segid " " and resid 15 and name HZ2 ))
2.800 2.800 3.200 peak 317 spectrum 1 weight 0.10000E+01 volume 0.18676E-02 ppm1 7.226 ppm2 7.572 CV 1
ASSI { 318}
(( segid " " and resid 15 and name HZ3 ))
(( segid " " and resid 15 and name HE3 ))
2.600 0.800 0.800 peak 318 spectrum 1 weight 0.10000E+01 volume 0.33665E-02 ppm1 7.224 ppm2 7.452 CV 1
ASSI { 320}
(( segid " " and resid 15 and name HE3 ))
(( segid " " and resid 15 and name HZ2 ))
4.200 2.200 2.100 peak 320 spectrum 1 weight 0.10000E+01 volume 0.16397E-03 ppm1 7.456 ppm2 7.572 CV 1
ASSI { 321}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HB3 ))
1.900 0.500 0.500 peak 321 spectrum 1 weight 0.10000E+01 volume 0.19828E-01 ppm1 3.796 ppm2 3.592 CV 1
ASSI { 322}
(( segid " " and resid 23 and name HG ))
(( segid " " and resid 23 and name HN ))
2.900 2.900 3.100 peak 322 spectrum 1 weight 0.10000E+01 volume 0.16986E-02 ppm1 1.642 ppm2 7.129 CV 1
ASSI { 323}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HN ))
3.200 1.200 1.200 peak 323 spectrum 1 weight 0.10000E+01 volume 0.96035E-03 ppm1 2.010 ppm2 7.430 CV 1
ASSI { 324}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HN ))
4.300 2.300 2.000 peak 324 spectrum 1 weight 0.10000E+01 volume 0.14935E-03 ppm1 2.607 ppm2 7.427 CV 1
ASSI { 325}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HB2 ))
2.800 1.000 1.000 peak 325 spectrum 1 weight 0.10000E+01 volume 0.19869E-02 ppm1 4.609 ppm2 2.010 CV 1
ASSI { 326}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HB3 ))
2.000 0.500 0.500 peak 326 spectrum 1 weight 0.10000E+01 volume 0.12951E-01 ppm1 2.013 ppm2 1.061 CV 1
ASSI { 327}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB3 ))
2.800 1.000 1.000 peak 327 spectrum 1 weight 0.10000E+01 volume 0.19863E-02 ppm1 1.558 ppm2 1.057 CV 1
ASSI { 328}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name HB3 ))
2.900 1.100 1.100 peak 328 spectrum 1 weight 0.10000E+01 volume 0.15191E-02 ppm1 1.403 ppm2 1.057 CV 1
ASSI { 329}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name HN ))
2.500 0.800 0.800 peak 329 spectrum 1 weight 0.10000E+01 volume 0.41441E-02 ppm1 3.174 ppm2 8.606 CV 1
ASSI { 330}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HN ))
2.500 0.800 0.800 peak 330 spectrum 1 weight 0.10000E+01 volume 0.35585E-02 ppm1 3.472 ppm2 8.607 CV 1
ASSI { 331}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HA ))
2.100 0.600 0.600 peak 331 spectrum 1 weight 0.10000E+01 volume 0.10458E-01 ppm1 3.470 ppm2 3.112 CV 1
ASSI { 332}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HB3 ))
1.900 0.500 0.500 peak 332 spectrum 1 weight 0.10000E+01 volume 0.18730E-01 ppm1 3.473 ppm2 3.176 CV 1
ASSI { 356}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 5 and name HN ))
2.600 0.800 0.800 peak 356 spectrum 1 weight 0.10000E+01 volume 0.31944E-02 ppm1 1.425 ppm2 8.088 CV 1
ASSI { 358}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HD2 ))
2.200 0.600 0.600 peak 358 spectrum 1 weight 0.10000E+01 volume 0.78595E-02 ppm1 4.335 ppm2 6.836 CV 1
ASSI { 359}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HD2 ))
3.500 1.500 1.500 peak 359 spectrum 1 weight 0.10000E+01 volume 0.54722E-03 ppm1 4.729 ppm2 6.796 CV 1
ASSI { 360}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HE1 ))
5.300 3.500 1.000 peak 360 spectrum 1 weight 0.10000E+01 volume 0.44610E-04 ppm1 2.630 ppm2 10.241 CV 1
ASSI { 361}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HE1 ))
4.200 2.300 2.100 peak 361 spectrum 1 weight 0.10000E+01 volume 0.15965E-03 ppm1 2.714 ppm2 10.242 CV 1
ASSI { 362}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HE1 ))
6.200 4.700 0.100 peak 362 spectrum 1 weight 0.10000E+01 volume 0.17121E-04 ppm1 4.115 ppm2 10.245 CV 1
ASSI { 363}
(( segid " " and resid 6 and name HG3 ))
(( segid " " and resid 18 and name HN ))
4.100 2.100 2.100 peak 363 spectrum 1 weight 0.10000E+01 volume 0.20340E-03 ppm1 1.261 ppm2 9.765 CV 1
ASSI { 364}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 18 and name HN ))
3.800 1.800 1.800 peak 364 spectrum 1 weight 0.10000E+01 volume 0.30574E-03 ppm1 1.544 ppm2 9.765 CV 1
OR { 364}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 18 and name HN ))
ASSI { 365}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 18 and name HN ))
3.700 1.700 1.700 peak 365 spectrum 1 weight 0.10000E+01 volume 0.37633E-03 ppm1 1.622 ppm2 9.765 CV 1
ASSI { 366}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 18 and name HN ))
3.000 1.100 1.100 peak 366 spectrum 1 weight 0.10000E+01 volume 0.13514E-02 ppm1 2.858 ppm2 9.766 CV 1
ASSI { 367}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 18 and name HN ))
4.000 2.000 2.000 peak 367 spectrum 1 weight 0.10000E+01 volume 0.24334E-03 ppm1 3.280 ppm2 9.765 CV 1
ASSI { 369}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 12 and name HN ))
4.500 2.500 1.800 peak 369 spectrum 1 weight 0.10000E+01 volume 0.11114E-03 ppm1 1.194 ppm2 9.333 CV 1
ASSI { 370}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 10 and name HN ))
3.600 1.600 1.600 peak 370 spectrum 1 weight 0.10000E+01 volume 0.41057E-03 ppm1 1.095 ppm2 9.068 CV 1
ASSI { 371}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 10 and name HN ))
2.700 0.900 0.900 peak 371 spectrum 1 weight 0.10000E+01 volume 0.22618E-02 ppm1 1.198 ppm2 9.068 CV 1
ASSI { 372}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 21 and name HN ))
3.100 1.200 1.200 peak 372 spectrum 1 weight 0.10000E+01 volume 0.11175E-02 ppm1 1.056 ppm2 8.861 CV 1
ASSI { 373}
( segid " " and resid 24 and name HB% )
(( segid " " and resid 21 and name HN ))
3.200 1.300 1.300 peak 373 spectrum 1 weight 0.10000E+01 volume 0.93699E-03 ppm1 1.427 ppm2 8.861 CV 1
ASSI { 374}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 21 and name HN ))
3.700 1.700 1.700 peak 374 spectrum 1 weight 0.10000E+01 volume 0.37281E-03 ppm1 1.557 ppm2 8.861 CV 1
ASSI { 375}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 21 and name HN ))
2.600 2.600 3.400 peak 375 spectrum 1 weight 0.10000E+01 volume 0.27905E-02 ppm1 2.009 ppm2 8.861 CV 1
ASSI { 376}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 10 and name HN ))
2.600 0.900 0.900 peak 376 spectrum 1 weight 0.10000E+01 volume 0.28289E-02 ppm1 2.077 ppm2 9.068 CV 1
OR { 376}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 10 and name HN ))
ASSI { 378}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 10 and name HN ))
3.000 3.000 3.000 peak 378 spectrum 1 weight 0.10000E+01 volume 0.12093E-02 ppm1 2.321 ppm2 9.069 CV 1
ASSI { 379}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 12 and name HN ))
3.200 1.300 1.300 peak 379 spectrum 1 weight 0.10000E+01 volume 0.92899E-03 ppm1 2.360 ppm2 9.336 CV 1
ASSI { 380}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 12 and name HN ))
3.400 1.500 1.500 peak 380 spectrum 1 weight 0.10000E+01 volume 0.55906E-03 ppm1 2.829 ppm2 9.336 CV 1
ASSI { 381}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 15 and name HN ))
3.300 1.400 1.400 peak 381 spectrum 1 weight 0.10000E+01 volume 0.72259E-03 ppm1 2.828 ppm2 9.033 CV 1
ASSI { 382}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 21 and name HN ))
3.000 1.100 1.100 peak 382 spectrum 1 weight 0.10000E+01 volume 0.12167E-02 ppm1 3.115 ppm2 8.861 CV 1
ASSI { 383}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 21 and name HN ))
3.200 1.300 1.300 peak 383 spectrum 1 weight 0.10000E+01 volume 0.80515E-03 ppm1 3.178 ppm2 8.861 CV 1
ASSI { 384}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 21 and name HN ))
4.000 2.000 2.000 peak 384 spectrum 1 weight 0.10000E+01 volume 0.22145E-03 ppm1 3.278 ppm2 8.862 CV 1
ASSI { 385}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 15 and name HN ))
3.300 1.400 1.400 peak 385 spectrum 1 weight 0.10000E+01 volume 0.70306E-03 ppm1 3.275 ppm2 9.032 CV 1
ASSI { 386}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 15 and name HN ))
3.100 1.200 1.200 peak 386 spectrum 1 weight 0.10000E+01 volume 0.11658E-02 ppm1 3.402 ppm2 9.034 CV 1
ASSI { 387}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 21 and name HN ))
3.100 1.200 1.200 peak 387 spectrum 1 weight 0.10000E+01 volume 0.10202E-02 ppm1 3.470 ppm2 8.862 CV 1
ASSI { 388}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 15 and name HN ))
3.100 1.200 1.200 peak 388 spectrum 1 weight 0.10000E+01 volume 0.10845E-02 ppm1 3.646 ppm2 9.033 CV 1
ASSI { 389}
(( segid " " and resid 27 and name HD3 ))
(( segid " " and resid 12 and name HN ))
3.500 3.500 2.500 peak 389 spectrum 1 weight 0.10000E+01 volume 0.48194E-03 ppm1 3.309 ppm2 9.337 CV 1
ASSI { 390}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 12 and name HN ))
3.200 1.300 1.300 peak 390 spectrum 1 weight 0.10000E+01 volume 0.92003E-03 ppm1 3.644 ppm2 9.335 CV 1
ASSI { 391}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 12 and name HN ))
3.000 1.100 1.100 peak 391 spectrum 1 weight 0.10000E+01 volume 0.13895E-02 ppm1 4.116 ppm2 9.335 CV 1
ASSI { 392}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 10 and name HN ))
3.000 3.000 3.000 peak 392 spectrum 1 weight 0.10000E+01 volume 0.12426E-02 ppm1 3.793 ppm2 9.067 CV 1
ASSI { 393}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 10 and name HN ))
3.500 1.500 1.500 peak 393 spectrum 1 weight 0.10000E+01 volume 0.55490E-03 ppm1 4.116 ppm2 9.070 CV 1
ASSI { 394}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 12 and name HN ))
2.600 0.900 0.900 peak 394 spectrum 1 weight 0.10000E+01 volume 0.27521E-02 ppm1 4.324 ppm2 9.337 CV 1
ASSI { 396}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 10 and name HN ))
2.000 0.500 0.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.12842E-01 ppm1 4.307 ppm2 9.069 CV 1
ASSI { 397}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 12 and name HN ))
2.900 1.100 1.100 peak 397 spectrum 1 weight 0.10000E+01 volume 0.15738E-02 ppm1 4.668 ppm2 9.336 CV 1
ASSI { 398}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 12 and name HN ))
3.800 1.800 1.800 peak 398 spectrum 1 weight 0.10000E+01 volume 0.30843E-03 ppm1 4.932 ppm2 9.333 CV 1
ASSI { 399}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 15 and name HN ))
2.800 0.900 0.900 peak 399 spectrum 1 weight 0.10000E+01 volume 0.21569E-02 ppm1 4.597 ppm2 9.032 CV 1
ASSI { 400}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 10 and name HN ))
4.300 2.300 2.000 peak 400 spectrum 1 weight 0.10000E+01 volume 0.15853E-03 ppm1 4.597 ppm2 9.068 CV 1
ASSI { 401}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 10 and name HN ))
4.700 2.800 1.600 peak 401 spectrum 1 weight 0.10000E+01 volume 0.84099E-04 ppm1 4.671 ppm2 9.067 CV 1
ASSI { 402}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 21 and name HN ))
3.100 1.200 1.200 peak 402 spectrum 1 weight 0.10000E+01 volume 0.11034E-02 ppm1 4.607 ppm2 8.861 CV 1
ASSI { 405}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 15 and name HN ))
3.500 1.600 1.600 peak 405 spectrum 1 weight 0.10000E+01 volume 0.47426E-03 ppm1 4.932 ppm2 9.031 CV 1
ASSI { 406}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 10 and name HN ))
2.600 0.800 0.800 peak 406 spectrum 1 weight 0.10000E+01 volume 0.33505E-02 ppm1 5.160 ppm2 9.070 CV 1
ASSI { 409}
(( segid " " and resid 9 and name HE22))
(( segid " " and resid 10 and name HN ))
3.000 1.100 1.100 peak 409 spectrum 1 weight 0.10000E+01 volume 0.13956E-02 ppm1 6.195 ppm2 9.069 CV 1
ASSI { 410}
(( segid " " and resid 9 and name HE22))
(( segid " " and resid 15 and name HN ))
3.500 1.500 1.500 peak 410 spectrum 1 weight 0.10000E+01 volume 0.49602E-03 ppm1 6.195 ppm2 9.033 CV 1
ASSI { 411}
(( segid " " and resid 17 and name HZ ))
(( segid " " and resid 15 and name HN ))
4.400 2.400 1.900 peak 411 spectrum 1 weight 0.10000E+01 volume 0.13098E-03 ppm1 6.461 ppm2 9.031 CV 1
ASSI { 412}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 17 and name HN ))
3.800 1.800 1.800 peak 412 spectrum 1 weight 0.10000E+01 volume 0.32193E-03 ppm1 1.093 ppm2 8.664 CV 1
ASSI { 413}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 17 and name HN ))
3.700 1.700 1.700 peak 413 spectrum 1 weight 0.10000E+01 volume 0.36289E-03 ppm1 1.191 ppm2 8.665 CV 1
ASSI { 416}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 17 and name HN ))
2.800 1.000 1.000 peak 416 spectrum 1 weight 0.10000E+01 volume 0.17549E-02 ppm1 1.539 ppm2 8.664 CV 1
OR { 416}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 17 and name HN ))
ASSI { 417}
(( segid " " and resid 6 and name HD2 ))
(( segid " " and resid 17 and name HN ))
4.600 2.700 1.700 peak 417 spectrum 1 weight 0.10000E+01 volume 0.97155E-04 ppm1 1.626 ppm2 8.663 CV 1
ASSI { 418}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 20 and name HN ))
3.100 1.200 1.200 peak 418 spectrum 1 weight 0.10000E+01 volume 0.10157E-02 ppm1 1.559 ppm2 8.606 CV 1
ASSI { 419}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 20 and name HN ))
3.500 1.500 1.500 peak 419 spectrum 1 weight 0.10000E+01 volume 0.55234E-03 ppm1 1.399 ppm2 8.607 CV 1
ASSI { 420}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 9 and name HN ))
4.100 2.100 2.100 peak 420 spectrum 1 weight 0.10000E+01 volume 0.19076E-03 ppm1 1.196 ppm2 8.602 CV 1
ASSI { 421}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 9 and name HN ))
2.600 0.900 0.900 peak 421 spectrum 1 weight 0.10000E+01 volume 0.29255E-02 ppm1 1.086 ppm2 8.603 CV 1
ASSI { 422}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 6 and name HN ))
3.100 1.200 1.200 peak 422 spectrum 1 weight 0.10000E+01 volume 0.10740E-02 ppm1 0.868 ppm2 8.505 CV 1
ASSI { 423}
(( segid " " and resid 5 and name HG12))
(( segid " " and resid 6 and name HN ))
4.000 2.000 2.000 peak 423 spectrum 1 weight 0.10000E+01 volume 0.24020E-03 ppm1 1.146 ppm2 8.504 CV 1
ASSI { 426}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 4 and name HN ))
3.600 1.600 1.600 peak 426 spectrum 1 weight 0.10000E+01 volume 0.42690E-03 ppm1 1.427 ppm2 8.508 CV 1
ASSI { 429}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 6 and name HN ))
2.700 2.700 3.300 peak 429 spectrum 1 weight 0.10000E+01 volume 0.22993E-02 ppm1 1.784 ppm2 8.503 CV 1
ASSI { 431}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 8 and name HN ))
3.300 1.400 1.400 peak 431 spectrum 1 weight 0.10000E+01 volume 0.69954E-03 ppm1 1.097 ppm2 8.223 CV 1
ASSI { 432}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 8 and name HN ))
2.900 2.900 3.100 peak 432 spectrum 1 weight 0.10000E+01 volume 0.14356E-02 ppm1 1.277 ppm2 8.226 CV 1
ASSI { 433}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 8 and name HN ))
3.900 1.900 1.900 peak 433 spectrum 1 weight 0.10000E+01 volume 0.28075E-03 ppm1 1.447 ppm2 8.224 CV 1
ASSI { 434}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 8 and name HN ))
3.000 1.100 1.100 peak 434 spectrum 1 weight 0.10000E+01 volume 0.12900E-02 ppm1 1.537 ppm2 8.227 CV 1
ASSI { 435}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 8 and name HN ))
3.100 1.200 1.200 peak 435 spectrum 1 weight 0.10000E+01 volume 0.97443E-03 ppm1 1.788 ppm2 8.226 CV 1
ASSI { 436}
(( segid " " and resid 7 and name HG2 ))
(( segid " " and resid 8 and name HN ))
3.700 1.700 1.700 peak 436 spectrum 1 weight 0.10000E+01 volume 0.35649E-03 ppm1 1.874 ppm2 8.227 CV 1
ASSI { 437}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 9 and name HE21))
4.400 2.400 1.900 peak 437 spectrum 1 weight 0.10000E+01 volume 0.12509E-03 ppm1 0.857 ppm2 8.159 CV 1
ASSI { 438}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 24 and name HN ))
3.200 1.300 1.300 peak 438 spectrum 1 weight 0.10000E+01 volume 0.83107E-03 ppm1 1.093 ppm2 7.964 CV 1
ASSI { 439}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 24 and name HN ))
3.600 1.600 1.600 peak 439 spectrum 1 weight 0.10000E+01 volume 0.41985E-03 ppm1 1.200 ppm2 7.965 CV 1
ASSI { 440}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 24 and name HN ))
4.300 2.300 2.000 peak 440 spectrum 1 weight 0.10000E+01 volume 0.15793E-03 ppm1 1.548 ppm2 7.968 CV 1
ASSI { 441}
(( segid " " and resid 23 and name HG ))
(( segid " " and resid 24 and name HN ))
2.700 0.900 0.900 peak 441 spectrum 1 weight 0.10000E+01 volume 0.23358E-02 ppm1 1.642 ppm2 7.965 CV 1
ASSI { 442}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HH21))
4.600 2.600 1.700 peak 442 spectrum 1 weight 0.10000E+01 volume 0.10333E-03 ppm1 1.562 ppm2 8.025 CV 1
OR { 442}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HH22))
ASSI { 447}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 13 and name HN ))
2.800 1.000 1.000 peak 447 spectrum 1 weight 0.10000E+01 volume 0.18983E-02 ppm1 1.387 ppm2 7.891 CV 1
ASSI { 448}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HH21))
4.600 2.600 1.700 peak 448 spectrum 1 weight 0.10000E+01 volume 0.10560E-03 ppm1 1.052 ppm2 8.022 CV 1
OR { 448}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HH22))
ASSI { 449}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name HH21))
4.700 2.800 1.600 peak 449 spectrum 1 weight 0.10000E+01 volume 0.85283E-04 ppm1 1.396 ppm2 8.023 CV 1
OR { 449}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 19 and name HH22))
ASSI { 452}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 20 and name HN ))
3.400 1.500 1.500 peak 452 spectrum 1 weight 0.10000E+01 volume 0.57538E-03 ppm1 2.008 ppm2 8.606 CV 1
ASSI { 453}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 17 and name HN ))
3.600 1.600 1.600 peak 453 spectrum 1 weight 0.10000E+01 volume 0.45602E-03 ppm1 2.069 ppm2 8.665 CV 1
OR { 453}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 17 and name HN ))
ASSI { 456}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 20 and name HN ))
4.200 2.200 2.100 peak 456 spectrum 1 weight 0.10000E+01 volume 0.17137E-03 ppm1 2.603 ppm2 8.606 CV 1
OR { 456}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 20 and name HN ))
ASSI { 457}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 32 and name HN ))
3.100 1.200 1.200 peak 457 spectrum 1 weight 0.10000E+01 volume 0.10791E-02 ppm1 2.030 ppm2 8.287 CV 1
ASSI { 458}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 8 and name HN ))
2.900 1.000 1.000 peak 458 spectrum 1 weight 0.10000E+01 volume 0.16193E-02 ppm1 2.019 ppm2 8.225 CV 1
ASSI { 459}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 32 and name HN ))
3.000 1.100 1.100 peak 459 spectrum 1 weight 0.10000E+01 volume 0.13191E-02 ppm1 2.168 ppm2 8.288 CV 1
ASSI { 461}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HE21))
2.900 1.000 1.000 peak 461 spectrum 1 weight 0.10000E+01 volume 0.15921E-02 ppm1 2.075 ppm2 8.155 CV 1
OR { 461}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HE21))
ASSI { 463}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HE21))
2.600 0.800 0.800 peak 463 spectrum 1 weight 0.10000E+01 volume 0.33921E-02 ppm1 2.319 ppm2 8.156 CV 1
ASSI { 466}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 24 and name HN ))
2.700 2.700 3.300 peak 466 spectrum 1 weight 0.10000E+01 volume 0.25905E-02 ppm1 1.976 ppm2 7.965 CV 1
ASSI { 467}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 13 and name HN ))
2.800 1.000 1.000 peak 467 spectrum 1 weight 0.10000E+01 volume 0.18919E-02 ppm1 2.070 ppm2 7.891 CV 1
ASSI { 469}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 32 and name HN ))
3.900 1.900 1.900 peak 469 spectrum 1 weight 0.10000E+01 volume 0.25502E-03 ppm1 2.562 ppm2 8.286 CV 1
ASSI { 471}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 9 and name HE21))
3.500 1.600 1.600 peak 471 spectrum 1 weight 0.10000E+01 volume 0.48962E-03 ppm1 2.704 ppm2 8.157 CV 1
OR { 471}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 9 and name HE21))
ASSI { 472}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 9 and name HE21))
3.600 1.600 1.600 peak 472 spectrum 1 weight 0.10000E+01 volume 0.44066E-03 ppm1 2.826 ppm2 8.156 CV 1
ASSI { 473}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 8 and name HN ))
4.000 2.000 2.000 peak 473 spectrum 1 weight 0.10000E+01 volume 0.22026E-03 ppm1 2.859 ppm2 8.228 CV 1
ASSI { 474}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HH21))
3.000 1.100 1.100 peak 474 spectrum 1 weight 0.10000E+01 volume 0.12215E-02 ppm1 2.603 ppm2 8.023 CV 1
OR { 474}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HH22))
ASSI { 475}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 24 and name HN ))
4.700 2.800 1.600 peak 475 spectrum 1 weight 0.10000E+01 volume 0.84035E-04 ppm1 2.605 ppm2 7.967 CV 1
ASSI { 476}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 13 and name HN ))
3.400 1.500 1.500 peak 476 spectrum 1 weight 0.10000E+01 volume 0.57634E-03 ppm1 2.704 ppm2 7.893 CV 1
OR { 476}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 13 and name HN ))
ASSI { 477}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 13 and name HN ))
3.000 1.100 1.100 peak 477 spectrum 1 weight 0.10000E+01 volume 0.12941E-02 ppm1 2.829 ppm2 7.890 CV 1
ASSI { 481}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 17 and name HN ))
2.700 0.900 0.900 peak 481 spectrum 1 weight 0.10000E+01 volume 0.26878E-02 ppm1 3.027 ppm2 8.664 CV 1
ASSI { 482}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 9 and name HN ))
2.800 1.000 1.000 peak 482 spectrum 1 weight 0.10000E+01 volume 0.18157E-02 ppm1 3.027 ppm2 8.602 CV 1
OR { 482}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 9 and name HN ))
ASSI { 486}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 17 and name HN ))
2.500 2.500 3.500 peak 486 spectrum 1 weight 0.10000E+01 volume 0.39713E-02 ppm1 3.592 ppm2 8.665 CV 1
ASSI { 487}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 17 and name HN ))
2.700 0.900 0.900 peak 487 spectrum 1 weight 0.10000E+01 volume 0.25274E-02 ppm1 3.791 ppm2 8.663 CV 1
ASSI { 489}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 6 and name HN ))
3.700 1.700 1.700 peak 489 spectrum 1 weight 0.10000E+01 volume 0.37793E-03 ppm1 3.592 ppm2 8.503 CV 1
ASSI { 490}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 6 and name HN ))
3.600 1.600 1.600 peak 490 spectrum 1 weight 0.10000E+01 volume 0.46914E-03 ppm1 3.717 ppm2 8.502 CV 1
ASSI { 491}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HN ))
2.000 0.500 0.500 peak 491 spectrum 1 weight 0.10000E+01 volume 0.14980E-01 ppm1 4.046 ppm2 8.507 CV 1
ASSI { 492}
(( segid " " and resid 2 and name HB2 ))
(( segid " " and resid 3 and name HN ))
3.400 1.500 1.500 peak 492 spectrum 1 weight 0.10000E+01 volume 0.56962E-03 ppm1 3.880 ppm2 8.423 CV 1
OR { 492}
(( segid " " and resid 2 and name HB3 ))
(( segid " " and resid 3 and name HN ))
ASSI { 493}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 14 and name HN ))
2.300 2.300 3.700 peak 493 spectrum 1 weight 0.10000E+01 volume 0.61538E-02 ppm1 3.276 ppm2 8.302 CV 1
ASSI { 494}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 14 and name HN ))
2.100 2.100 3.900 peak 494 spectrum 1 weight 0.10000E+01 volume 0.11008E-01 ppm1 3.400 ppm2 8.303 CV 1
ASSI { 496}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 14 and name HN ))
3.900 1.900 1.900 peak 496 spectrum 1 weight 0.10000E+01 volume 0.27153E-03 ppm1 3.646 ppm2 8.300 CV 1
ASSI { 497}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 32 and name HN ))
3.800 1.800 1.800 peak 497 spectrum 1 weight 0.10000E+01 volume 0.31182E-03 ppm1 4.044 ppm2 8.289 CV 1
ASSI { 498}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 8 and name HN ))
3.000 1.100 1.100 peak 498 spectrum 1 weight 0.10000E+01 volume 0.12756E-02 ppm1 3.666 ppm2 8.227 CV 1
ASSI { 499}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 8 and name HN ))
3.100 1.200 1.200 peak 499 spectrum 1 weight 0.10000E+01 volume 0.10599E-02 ppm1 3.724 ppm2 8.226 CV 1
ASSI { 500}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 8 and name HN ))
4.600 2.600 1.700 peak 500 spectrum 1 weight 0.10000E+01 volume 0.10522E-03 ppm1 3.592 ppm2 8.226 CV 1
ASSI { 501}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 9 and name HE21))
3.200 3.200 2.800 peak 501 spectrum 1 weight 0.10000E+01 volume 0.87459E-03 ppm1 3.646 ppm2 8.156 CV 1
ASSI { 502}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 9 and name HE21))
4.600 2.600 1.700 peak 502 spectrum 1 weight 0.10000E+01 volume 0.99267E-04 ppm1 3.791 ppm2 8.161 CV 1
ASSI { 504}
(( segid " " and resid 4 and name HA2 ))
(( segid " " and resid 5 and name HN ))
2.100 0.500 0.500 peak 504 spectrum 1 weight 0.10000E+01 volume 0.12544E-01 ppm1 3.933 ppm2 8.087 CV 1
OR { 504}
(( segid " " and resid 4 and name HA1 ))
(( segid " " and resid 5 and name HN ))
ASSI { 506}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HH21))
3.300 1.300 1.300 peak 506 spectrum 1 weight 0.10000E+01 volume 0.77219E-03 ppm1 3.149 ppm2 8.023 CV 1
OR { 506}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HH22))
ASSI { 507}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 24 and name HN ))
3.200 1.200 1.200 peak 507 spectrum 1 weight 0.10000E+01 volume 0.95491E-03 ppm1 3.109 ppm2 7.967 CV 1
ASSI { 508}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 24 and name HN ))
4.300 2.300 2.000 peak 508 spectrum 1 weight 0.10000E+01 volume 0.15293E-03 ppm1 3.173 ppm2 7.968 CV 1
ASSI { 509}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 24 and name HN ))
4.700 2.800 1.600 peak 509 spectrum 1 weight 0.10000E+01 volume 0.83107E-04 ppm1 3.027 ppm2 7.970 CV 1
OR { 509}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 24 and name HN ))
ASSI { 510}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 24 and name HN ))
3.700 1.700 1.700 peak 510 spectrum 1 weight 0.10000E+01 volume 0.37473E-03 ppm1 3.286 ppm2 7.967 CV 1
ASSI { 511}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
2.900 1.100 1.100 peak 511 spectrum 1 weight 0.10000E+01 volume 0.14871E-02 ppm1 3.463 ppm2 7.965 CV 1
ASSI { 514}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 13 and name HN ))
2.600 2.600 3.400 peak 514 spectrum 1 weight 0.10000E+01 volume 0.32129E-02 ppm1 3.647 ppm2 7.891 CV 1
ASSI { 518}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 14 and name HN ))
4.500 2.600 1.800 peak 518 spectrum 1 weight 0.10000E+01 volume 0.10941E-03 ppm1 4.113 ppm2 8.307 CV 1
ASSI { 519}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 27 and name HE ))
3.500 1.500 1.500 peak 519 spectrum 1 weight 0.10000E+01 volume 0.50082E-03 ppm1 4.125 ppm2 8.077 CV 1
ASSI { 520}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 13 and name HN ))
3.800 1.800 1.800 peak 520 spectrum 1 weight 0.10000E+01 volume 0.29281E-03 ppm1 4.119 ppm2 7.891 CV 1
OR { 520}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 13 and name HN ))
ASSI { 521}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 17 and name HN ))
2.900 1.100 1.100 peak 521 spectrum 1 weight 0.10000E+01 volume 0.14903E-02 ppm1 4.306 ppm2 8.663 CV 1
ASSI { 523}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 17 and name HN ))
3.500 1.500 1.500 peak 523 spectrum 1 weight 0.10000E+01 volume 0.54402E-03 ppm1 4.694 ppm2 8.664 CV 1
ASSI { 525}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HN ))
2.000 0.500 0.500 peak 525 spectrum 1 weight 0.10000E+01 volume 0.13520E-01 ppm1 4.695 ppm2 8.602 CV 1
ASSI { 526}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HN ))
2.100 0.500 0.500 peak 526 spectrum 1 weight 0.10000E+01 volume 0.12148E-01 ppm1 4.607 ppm2 8.606 CV 1
ASSI { 527}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HN ))
2.400 0.700 0.700 peak 527 spectrum 1 weight 0.10000E+01 volume 0.48994E-02 ppm1 4.392 ppm2 8.501 CV 1
ASSI { 528}
(( segid " " and resid 3 and name HB ))
(( segid " " and resid 4 and name HN ))
2.800 1.000 1.000 peak 528 spectrum 1 weight 0.10000E+01 volume 0.17847E-02 ppm1 4.257 ppm2 8.501 CV 1
ASSI { 529}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 3 and name HN ))
2.500 0.800 0.800 peak 529 spectrum 1 weight 0.10000E+01 volume 0.35521E-02 ppm1 4.585 ppm2 8.422 CV 1
ASSI { 530}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 14 and name HN ))
2.700 0.900 0.900 peak 530 spectrum 1 weight 0.10000E+01 volume 0.25540E-02 ppm1 4.936 ppm2 8.302 CV 1
ASSI { 531}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 32 and name HN ))
4.100 2.100 2.100 peak 531 spectrum 1 weight 0.10000E+01 volume 0.19489E-03 ppm1 4.728 ppm2 8.283 CV 1
ASSI { 532}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 8 and name HN ))
3.400 1.400 1.400 peak 532 spectrum 1 weight 0.10000E+01 volume 0.63842E-03 ppm1 4.499 ppm2 8.226 CV 1
ASSI { 533}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HN ))
2.300 2.300 3.700 peak 533 spectrum 1 weight 0.10000E+01 volume 0.66850E-02 ppm1 4.233 ppm2 8.226 CV 1
ASSI { 534}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HE21))
3.400 1.400 1.400 peak 534 spectrum 1 weight 0.10000E+01 volume 0.66306E-03 ppm1 4.311 ppm2 8.153 CV 1
ASSI { 535}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 9 and name HE21))
2.800 1.000 1.000 peak 535 spectrum 1 weight 0.10000E+01 volume 0.19060E-02 ppm1 4.600 ppm2 8.156 CV 1
ASSI { 536}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HE ))
3.600 1.600 1.600 peak 536 spectrum 1 weight 0.10000E+01 volume 0.43106E-03 ppm1 4.604 ppm2 8.120 CV 1
ASSI { 539}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 13 and name HN ))
3.500 1.600 1.600 peak 539 spectrum 1 weight 0.10000E+01 volume 0.47298E-03 ppm1 4.323 ppm2 7.891 CV 1
OR { 539}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 13 and name HN ))
ASSI { 540}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 24 and name HN ))
2.600 0.800 0.800 peak 540 spectrum 1 weight 0.10000E+01 volume 0.31736E-02 ppm1 4.307 ppm2 7.965 CV 1
ASSI { 542}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HN ))
2.800 1.000 1.000 peak 542 spectrum 1 weight 0.10000E+01 volume 0.18785E-02 ppm1 4.791 ppm2 7.889 CV 1
ASSI { 545}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 13 and name HN ))
3.600 1.600 1.600 peak 545 spectrum 1 weight 0.10000E+01 volume 0.46722E-03 ppm1 4.670 ppm2 7.891 CV 1
ASSI { 546}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 13 and name HN ))
4.000 2.000 2.000 peak 546 spectrum 1 weight 0.10000E+01 volume 0.24474E-03 ppm1 4.594 ppm2 7.892 CV 1
ASSI { 547}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HN ))
2.200 2.200 3.800 peak 547 spectrum 1 weight 0.10000E+01 volume 0.90723E-02 ppm1 4.476 ppm2 8.287 CV 1
ASSI { 548}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HN ))
2.200 0.600 0.600 peak 548 spectrum 1 weight 0.10000E+01 volume 0.90947E-02 ppm1 5.163 ppm2 8.664 CV 1
ASSI { 549}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 9 and name HN ))
4.100 2.100 2.100 peak 549 spectrum 1 weight 0.10000E+01 volume 0.20385E-03 ppm1 5.160 ppm2 8.606 CV 1
ASSI { 557}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 27 and name HN ))
6.000 4.500 0.300 peak 557 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.822 ppm2 8.530 CV 1
ASSI { 565}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 33 and name HN ))
3.400 1.400 1.400 peak 565 spectrum 1 weight 0.10000E+01 volume 0.60258E-03 ppm1 1.606 ppm2 7.739 CV 1
ASSI { 566}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 33 and name HN ))
3.300 1.400 1.400 peak 566 spectrum 1 weight 0.10000E+01 volume 0.68002E-03 ppm1 1.672 ppm2 7.740 CV 1
ASSI { 567}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 29 and name HN ))
3.000 1.200 1.200 peak 567 spectrum 1 weight 0.10000E+01 volume 0.11818E-02 ppm1 1.697 ppm2 7.663 CV 1
ASSI { 569}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 29 and name HN ))
2.900 1.000 1.000 peak 569 spectrum 1 weight 0.10000E+01 volume 0.16673E-02 ppm1 1.880 ppm2 7.663 CV 1
ASSI { 570}
( segid " " and resid 32 and name HD2%)
(( segid " " and resid 31 and name HN ))
4.700 2.700 1.600 peak 570 spectrum 1 weight 0.10000E+01 volume 0.90467E-04 ppm1 0.870 ppm2 7.576 CV 1
ASSI { 572}
( segid " " and resid 25 and name HD1%)
( segid " " and resid 17 and name HD% )
4.600 2.700 1.700 peak 572 spectrum 1 weight 0.10000E+01 volume 0.95779E-04 ppm1 0.860 ppm2 7.452 CV 1
OR { 572}
( segid " " and resid 25 and name HD2%)
( segid " " and resid 17 and name HD% )
OR { 572}
( segid " " and resid 5 and name HG2%)
( segid " " and resid 17 and name HD% )
ASSI { 578}
( segid " " and resid 23 and name HD2%)
( segid " " and resid 17 and name HD% )
2.900 1.100 1.100 peak 578 spectrum 1 weight 0.10000E+01 volume 0.14516E-02 ppm1 1.094 ppm2 7.453 CV 1
ASSI { 580}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 26 and name HN ))
3.200 1.300 1.300 peak 580 spectrum 1 weight 0.10000E+01 volume 0.92163E-03 ppm1 1.194 ppm2 7.497 CV 1
ASSI { 581}
( segid " " and resid 23 and name HD1%)
( segid " " and resid 17 and name HD% )
2.200 0.600 0.600 peak 581 spectrum 1 weight 0.10000E+01 volume 0.80387E-02 ppm1 1.196 ppm2 7.453 CV 1
ASSI { 583}
(( segid " " and resid 29 and name HG3 ))
(( segid " " and resid 30 and name HN ))
2.900 1.100 1.100 peak 583 spectrum 1 weight 0.10000E+01 volume 0.15146E-02 ppm1 1.095 ppm2 7.401 CV 1
ASSI { 584}
(( segid " " and resid 29 and name HG2 ))
(( segid " " and resid 30 and name HN ))
3.500 1.500 1.500 peak 584 spectrum 1 weight 0.10000E+01 volume 0.55170E-03 ppm1 1.294 ppm2 7.396 CV 1
ASSI { 585}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 22 and name HN ))
2.600 0.800 0.800 peak 585 spectrum 1 weight 0.10000E+01 volume 0.34049E-02 ppm1 1.057 ppm2 7.321 CV 1
ASSI { 586}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 22 and name HN ))
5.100 3.300 1.200 peak 586 spectrum 1 weight 0.10000E+01 volume 0.52706E-04 ppm1 1.202 ppm2 7.321 CV 1
ASSI { 587}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 17 and name HD% )
3.500 1.500 1.500 peak 587 spectrum 1 weight 0.10000E+01 volume 0.55554E-03 ppm1 1.456 ppm2 7.452 CV 1
ASSI { 588}
( segid " " and resid 24 and name HB% )
(( segid " " and resid 25 and name HN ))
2.200 0.600 0.600 peak 588 spectrum 1 weight 0.10000E+01 volume 0.73091E-02 ppm1 1.432 ppm2 7.501 CV 1
ASSI { 590}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 31 and name HN ))
3.900 1.900 1.900 peak 590 spectrum 1 weight 0.10000E+01 volume 0.25546E-03 ppm1 1.469 ppm2 7.580 CV 1
OR { 590}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 31 and name HN ))
ASSI { 592}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 30 and name HN ))
3.400 1.500 1.500 peak 592 spectrum 1 weight 0.10000E+01 volume 0.57986E-03 ppm1 1.465 ppm2 7.397 CV 1
ASSI { 593}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 30 and name HN ))
3.400 1.500 1.500 peak 593 spectrum 1 weight 0.10000E+01 volume 0.59714E-03 ppm1 1.535 ppm2 7.398 CV 1
ASSI { 594}
(( segid " " and resid 23 and name HG ))
( segid " " and resid 17 and name HD% )
3.100 1.200 1.200 peak 594 spectrum 1 weight 0.10000E+01 volume 0.98179E-03 ppm1 1.637 ppm2 7.455 CV 1
ASSI { 595}
(( segid " " and resid 7 and name HG3 ))
( segid " " and resid 8 and name HE% )
2.800 1.000 1.000 peak 595 spectrum 1 weight 0.10000E+01 volume 0.18957E-02 ppm1 1.795 ppm2 7.398 CV 1
ASSI { 596}
(( segid " " and resid 7 and name HG2 ))
( segid " " and resid 8 and name HE% )
2.900 1.100 1.100 peak 596 spectrum 1 weight 0.10000E+01 volume 0.14471E-02 ppm1 1.869 ppm2 7.398 CV 1
ASSI { 597}
( segid " " and resid 24 and name HB% )
(( segid " " and resid 22 and name HN ))
3.300 1.400 1.400 peak 597 spectrum 1 weight 0.10000E+01 volume 0.70754E-03 ppm1 1.432 ppm2 7.318 CV 1
ASSI { 598}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 22 and name HN ))
3.600 1.600 1.600 peak 598 spectrum 1 weight 0.10000E+01 volume 0.44898E-03 ppm1 1.558 ppm2 7.319 CV 1
ASSI { 599}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 22 and name HN ))
3.800 1.800 1.800 peak 599 spectrum 1 weight 0.10000E+01 volume 0.30347E-03 ppm1 1.650 ppm2 7.319 CV 1
ASSI { 604}
( segid " " and resid 23 and name HD2%)
( segid " " and resid 8 and name HD% )
2.300 0.700 0.700 peak 604 spectrum 1 weight 0.10000E+01 volume 0.58082E-02 ppm1 1.094 ppm2 7.179 CV 1
ASSI { 605}
( segid " " and resid 23 and name HD1%)
( segid " " and resid 8 and name HD% )
3.800 1.800 1.800 peak 605 spectrum 1 weight 0.10000E+01 volume 0.31665E-03 ppm1 1.196 ppm2 7.178 CV 1
ASSI { 606}
(( segid " " and resid 7 and name HB3 ))
( segid " " and resid 8 and name HD% )
3.000 3.000 3.000 peak 606 spectrum 1 weight 0.10000E+01 volume 0.13904E-02 ppm1 1.276 ppm2 7.178 CV 1
ASSI { 607}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 8 and name HD% )
3.200 1.200 1.200 peak 607 spectrum 1 weight 0.10000E+01 volume 0.94595E-03 ppm1 1.449 ppm2 7.178 CV 1
ASSI { 608}
(( segid " " and resid 6 and name HB3 ))
( segid " " and resid 8 and name HD% )
3.900 1.900 1.900 peak 608 spectrum 1 weight 0.10000E+01 volume 0.25265E-03 ppm1 1.538 ppm2 7.179 CV 1
ASSI { 609}
(( segid " " and resid 23 and name HG ))
( segid " " and resid 8 and name HD% )
3.800 1.800 1.800 peak 609 spectrum 1 weight 0.10000E+01 volume 0.30219E-03 ppm1 1.633 ppm2 7.178 CV 1
OR { 609}
(( segid " " and resid 6 and name HD2 ))
( segid " " and resid 8 and name HD% )
ASSI { 610}
(( segid " " and resid 7 and name HG3 ))
( segid " " and resid 8 and name HD% )
2.700 2.700 3.300 peak 610 spectrum 1 weight 0.10000E+01 volume 0.23466E-02 ppm1 1.789 ppm2 7.180 CV 1
ASSI { 611}
(( segid " " and resid 7 and name HG2 ))
( segid " " and resid 8 and name HD% )
3.300 1.300 1.300 peak 611 spectrum 1 weight 0.10000E+01 volume 0.76259E-03 ppm1 1.874 ppm2 7.179 CV 1
ASSI { 612}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 23 and name HN ))
2.800 2.800 3.200 peak 612 spectrum 1 weight 0.10000E+01 volume 0.18113E-02 ppm1 1.096 ppm2 7.129 CV 1
ASSI { 613}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 23 and name HN ))
3.000 1.100 1.100 peak 613 spectrum 1 weight 0.10000E+01 volume 0.12487E-02 ppm1 1.198 ppm2 7.127 CV 1
ASSI { 614}
( segid " " and resid 23 and name HD2%)
( segid " " and resid 17 and name HE% )
4.000 2.000 2.000 peak 614 spectrum 1 weight 0.10000E+01 volume 0.23585E-03 ppm1 1.095 ppm2 6.961 CV 1
ASSI { 615}
( segid " " and resid 23 and name HD1%)
( segid " " and resid 17 and name HE% )
2.300 0.700 0.700 peak 615 spectrum 1 weight 0.10000E+01 volume 0.58338E-02 ppm1 1.195 ppm2 6.960 CV 1
ASSI { 616}
(( segid " " and resid 23 and name HB2 ))
( segid " " and resid 17 and name HE% )
3.500 3.500 2.500 peak 616 spectrum 1 weight 0.10000E+01 volume 0.49890E-03 ppm1 1.455 ppm2 6.960 CV 1
ASSI { 617}
(( segid " " and resid 23 and name HG ))
( segid " " and resid 17 and name HE% )
3.800 1.800 1.800 peak 617 spectrum 1 weight 0.10000E+01 volume 0.29979E-03 ppm1 1.645 ppm2 6.960 CV 1
ASSI { 618}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 22 and name HD2 ))
3.400 1.400 1.400 peak 618 spectrum 1 weight 0.10000E+01 volume 0.65954E-03 ppm1 1.059 ppm2 6.838 CV 1
ASSI { 619}
(( segid " " and resid 19 and name HG3 ))
(( segid " " and resid 22 and name HD2 ))
3.600 1.600 1.600 peak 619 spectrum 1 weight 0.10000E+01 volume 0.45794E-03 ppm1 1.401 ppm2 6.835 CV 1
ASSI { 620}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 22 and name HD2 ))
3.500 3.500 2.500 peak 620 spectrum 1 weight 0.10000E+01 volume 0.47234E-03 ppm1 1.558 ppm2 6.835 CV 1
ASSI { 621}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 22 and name HD2 ))
3.400 1.400 1.400 peak 621 spectrum 1 weight 0.10000E+01 volume 0.64898E-03 ppm1 1.645 ppm2 6.837 CV 1
ASSI { 622}
(( segid " " and resid 29 and name HG3 ))
(( segid " " and resid 30 and name HD2 ))
4.200 2.200 2.100 peak 622 spectrum 1 weight 0.10000E+01 volume 0.16865E-03 ppm1 1.098 ppm2 6.794 CV 1
ASSI { 623}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 30 and name HD2 ))
3.700 1.700 1.700 peak 623 spectrum 1 weight 0.10000E+01 volume 0.37121E-03 ppm1 1.196 ppm2 6.793 CV 1
ASSI { 625}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 30 and name HD2 ))
2.700 2.700 3.300 peak 625 spectrum 1 weight 0.10000E+01 volume 0.22183E-02 ppm1 1.391 ppm2 6.792 CV 1
ASSI { 629}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 30 and name HD2 ))
2.900 1.000 1.000 peak 629 spectrum 1 weight 0.10000E+01 volume 0.16871E-02 ppm1 2.072 ppm2 6.795 CV 1
ASSI { 633}
(( segid " " and resid 23 and name HB3 ))
( segid " " and resid 17 and name HE% )
4.200 2.300 2.100 peak 633 spectrum 1 weight 0.10000E+01 volume 0.16049E-03 ppm1 1.977 ppm2 6.958 CV 1
ASSI { 634}
(( segid " " and resid 15 and name HB3 ))
( segid " " and resid 17 and name HE% )
2.600 0.800 0.800 peak 634 spectrum 1 weight 0.10000E+01 volume 0.29879E-02 ppm1 2.631 ppm2 6.963 CV 1
ASSI { 635}
(( segid " " and resid 15 and name HB2 ))
( segid " " and resid 17 and name HE% )
2.800 1.000 1.000 peak 635 spectrum 1 weight 0.10000E+01 volume 0.20577E-02 ppm1 2.725 ppm2 6.962 CV 1
ASSI { 636}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 17 and name HE% )
2.300 0.700 0.700 peak 636 spectrum 1 weight 0.10000E+01 volume 0.62914E-02 ppm1 2.827 ppm2 6.962 CV 1
ASSI { 637}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 22 and name HD2 ))
2.900 1.000 1.000 peak 637 spectrum 1 weight 0.10000E+01 volume 0.17015E-02 ppm1 2.603 ppm2 6.835 CV 1
ASSI { 638}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 22 and name HD2 ))
3.500 1.600 1.600 peak 638 spectrum 1 weight 0.10000E+01 volume 0.47202E-03 ppm1 2.012 ppm2 6.839 CV 1
ASSI { 639}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 22 and name HD2 ))
3.800 1.800 1.800 peak 639 spectrum 1 weight 0.10000E+01 volume 0.33153E-03 ppm1 2.733 ppm2 6.834 CV 1
ASSI { 640}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 30 and name HD2 ))
3.900 1.900 1.900 peak 640 spectrum 1 weight 0.10000E+01 volume 0.26036E-03 ppm1 2.837 ppm2 6.792 CV 1
OR { 640}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 30 and name HD2 ))
ASSI { 641}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 23 and name HN ))
3.100 1.200 1.200 peak 641 spectrum 1 weight 0.10000E+01 volume 0.10743E-02 ppm1 2.862 ppm2 7.126 CV 1
ASSI { 642}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 8 and name HD% )
3.300 1.300 1.300 peak 642 spectrum 1 weight 0.10000E+01 volume 0.78083E-03 ppm1 2.858 ppm2 7.179 CV 1
ASSI { 650}
(( segid " " and resid 23 and name HB3 ))
( segid " " and resid 8 and name HD% )
2.900 2.900 3.100 peak 650 spectrum 1 weight 0.10000E+01 volume 0.15946E-02 ppm1 1.983 ppm2 7.183 CV 1
ASSI { 651}
(( segid " " and resid 9 and name HB3 ))
( segid " " and resid 8 and name HD% )
4.100 2.100 2.100 peak 651 spectrum 1 weight 0.10000E+01 volume 0.19572E-03 ppm1 2.072 ppm2 7.184 CV 1
OR { 651}
(( segid " " and resid 9 and name HB2 ))
( segid " " and resid 8 and name HD% )
ASSI { 656}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 22 and name HN ))
2.500 0.800 0.800 peak 656 spectrum 1 weight 0.10000E+01 volume 0.34561E-02 ppm1 2.008 ppm2 7.320 CV 1
ASSI { 657}
(( segid " " and resid 21 and name HB3 ))
(( segid " " and resid 22 and name HN ))
3.000 1.100 1.100 peak 657 spectrum 1 weight 0.10000E+01 volume 0.13284E-02 ppm1 2.602 ppm2 7.320 CV 1
ASSI { 658}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 22 and name HN ))
3.100 1.200 1.200 peak 658 spectrum 1 weight 0.10000E+01 volume 0.97987E-03 ppm1 2.734 ppm2 7.321 CV 1
ASSI { 660}
(( segid " " and resid 8 and name HB2 ))
( segid " " and resid 8 and name HE% )
2.600 2.600 3.400 peak 660 spectrum 1 weight 0.10000E+01 volume 0.28257E-02 ppm1 3.024 ppm2 7.400 CV 1
OR { 660}
(( segid " " and resid 8 and name HB3 ))
( segid " " and resid 8 and name HE% )
ASSI { 662}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 30 and name HN ))
4.100 2.100 2.100 peak 662 spectrum 1 weight 0.10000E+01 volume 0.20087E-03 ppm1 2.174 ppm2 7.391 CV 1
ASSI { 663}
(( segid " " and resid 7 and name HB2 ))
( segid " " and resid 8 and name HE% )
2.800 1.000 1.000 peak 663 spectrum 1 weight 0.10000E+01 volume 0.20001E-02 ppm1 2.017 ppm2 7.399 CV 1
ASSI { 664}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HE3 ))
3.000 1.100 1.100 peak 664 spectrum 1 weight 0.10000E+01 volume 0.12768E-02 ppm1 2.633 ppm2 7.451 CV 1
ASSI { 665}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HE3 ))
2.900 2.900 3.100 peak 665 spectrum 1 weight 0.10000E+01 volume 0.15345E-02 ppm1 2.722 ppm2 7.451 CV 1
ASSI { 666}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 17 and name HD% )
2.100 0.500 0.500 peak 666 spectrum 1 weight 0.10000E+01 volume 0.11434E-01 ppm1 2.860 ppm2 7.452 CV 1
ASSI { 667}
(( segid " " and resid 8 and name HB2 ))
( segid " " and resid 17 and name HD% )
2.800 1.000 1.000 peak 667 spectrum 1 weight 0.10000E+01 volume 0.19133E-02 ppm1 3.029 ppm2 7.451 CV 1
OR { 667}
(( segid " " and resid 8 and name HB3 ))
( segid " " and resid 17 and name HD% )
ASSI { 668}
(( segid " " and resid 23 and name HB3 ))
( segid " " and resid 17 and name HD% )
3.100 1.200 1.200 peak 668 spectrum 1 weight 0.10000E+01 volume 0.10676E-02 ppm1 1.979 ppm2 7.449 CV 1
ASSI { 669}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 25 and name HN ))
4.400 2.400 1.900 peak 669 spectrum 1 weight 0.10000E+01 volume 0.12797E-03 ppm1 1.981 ppm2 7.499 CV 1
ASSI { 672}
(( segid " " and resid 29 and name HD3 ))
(( segid " " and resid 29 and name HN ))
3.200 1.300 1.300 peak 672 spectrum 1 weight 0.10000E+01 volume 0.92323E-03 ppm1 2.866 ppm2 7.662 CV 1
OR { 672}
(( segid " " and resid 29 and name HD2 ))
(( segid " " and resid 29 and name HN ))
ASSI { 673}
(( segid " " and resid 29 and name HD2 ))
(( segid " " and resid 31 and name HN ))
4.100 2.100 2.100 peak 673 spectrum 1 weight 0.10000E+01 volume 0.19453E-03 ppm1 2.851 ppm2 7.582 CV 1
OR { 673}
(( segid " " and resid 29 and name HD3 ))
(( segid " " and resid 31 and name HN ))
ASSI { 675}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 33 and name HN ))
3.900 1.900 1.900 peak 675 spectrum 1 weight 0.10000E+01 volume 0.24967E-03 ppm1 2.165 ppm2 7.739 CV 1
ASSI { 676}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HD1 ))
3.100 1.200 1.200 peak 676 spectrum 1 weight 0.10000E+01 volume 0.10938E-02 ppm1 2.631 ppm2 7.783 CV 1
ASSI { 677}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HD1 ))
2.700 0.900 0.900 peak 677 spectrum 1 weight 0.10000E+01 volume 0.24500E-02 ppm1 2.718 ppm2 7.783 CV 1
ASSI { 678}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 16 and name HN ))
2.700 0.900 0.900 peak 678 spectrum 1 weight 0.10000E+01 volume 0.25761E-02 ppm1 2.631 ppm2 7.713 CV 1
ASSI { 679}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 16 and name HN ))
3.100 1.200 1.200 peak 679 spectrum 1 weight 0.10000E+01 volume 0.10340E-02 ppm1 2.719 ppm2 7.712 CV 1
ASSI { 680}
(( segid " " and resid 29 and name HD3 ))
(( segid " " and resid 15 and name HD1 ))
4.500 2.500 1.800 peak 680 spectrum 1 weight 0.10000E+01 volume 0.12074E-03 ppm1 2.854 ppm2 7.782 CV 1
OR { 680}
(( segid " " and resid 29 and name HD2 ))
(( segid " " and resid 15 and name HD1 ))
ASSI { 682}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 23 and name HN ))
3.600 1.600 1.600 peak 682 spectrum 1 weight 0.10000E+01 volume 0.41537E-03 ppm1 3.029 ppm2 7.127 CV 1
OR { 682}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 23 and name HN ))
ASSI { 684}
(( segid " " and resid 8 and name HB2 ))
( segid " " and resid 8 and name HD% )
2.000 0.500 0.500 peak 684 spectrum 1 weight 0.10000E+01 volume 0.16906E-01 ppm1 3.029 ppm2 7.179 CV 1
OR { 684}
(( segid " " and resid 8 and name HB3 ))
( segid " " and resid 8 and name HD% )
ASSI { 685}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 8 and name HD% )
2.700 0.900 0.900 peak 685 spectrum 1 weight 0.10000E+01 volume 0.22708E-02 ppm1 3.106 ppm2 7.178 CV 1
ASSI { 686}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 8 and name HD% )
3.200 1.300 1.300 peak 686 spectrum 1 weight 0.10000E+01 volume 0.88259E-03 ppm1 3.178 ppm2 7.180 CV 1
ASSI { 687}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 23 and name HN ))
2.500 0.800 0.800 peak 687 spectrum 1 weight 0.10000E+01 volume 0.35233E-02 ppm1 3.115 ppm2 7.128 CV 1
ASSI { 688}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 23 and name HN ))
3.900 3.900 2.100 peak 688 spectrum 1 weight 0.10000E+01 volume 0.25559E-03 ppm1 3.183 ppm2 7.128 CV 1
ASSI { 689}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 23 and name HN ))
2.600 0.900 0.900 peak 689 spectrum 1 weight 0.10000E+01 volume 0.29380E-02 ppm1 3.286 ppm2 7.128 CV 1
ASSI { 691}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 8 and name HD% )
3.000 1.100 1.100 peak 691 spectrum 1 weight 0.10000E+01 volume 0.13341E-02 ppm1 3.465 ppm2 7.177 CV 1
ASSI { 692}
(( segid " " and resid 7 and name HD3 ))
( segid " " and resid 8 and name HD% )
2.800 2.800 3.200 peak 692 spectrum 1 weight 0.10000E+01 volume 0.18465E-02 ppm1 3.670 ppm2 7.179 CV 1
ASSI { 693}
(( segid " " and resid 7 and name HD2 ))
( segid " " and resid 8 and name HD% )
3.000 1.100 1.100 peak 693 spectrum 1 weight 0.10000E+01 volume 0.13748E-02 ppm1 3.724 ppm2 7.180 CV 1
ASSI { 698}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 28 and name HN ))
3.800 1.800 1.800 peak 698 spectrum 1 weight 0.10000E+01 volume 0.32641E-03 ppm1 3.182 ppm2 7.257 CV 1
ASSI { 701}
(( segid " " and resid 26 and name HB2 ))
( segid " " and resid 17 and name HE% )
2.900 1.100 1.100 peak 701 spectrum 1 weight 0.10000E+01 volume 0.14650E-02 ppm1 3.183 ppm2 6.962 CV 1
ASSI { 702}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 17 and name HE% )
3.500 1.500 1.500 peak 702 spectrum 1 weight 0.10000E+01 volume 0.53346E-03 ppm1 3.119 ppm2 6.963 CV 1
ASSI { 704}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 17 and name HE% )
3.600 1.600 1.600 peak 704 spectrum 1 weight 0.10000E+01 volume 0.45570E-03 ppm1 3.289 ppm2 6.960 CV 1
ASSI { 705}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 17 and name HE% )
2.800 1.000 1.000 peak 705 spectrum 1 weight 0.10000E+01 volume 0.17725E-02 ppm1 3.465 ppm2 6.961 CV 1
ASSI { 706}
(( segid " " and resid 10 and name HB3 ))
( segid " " and resid 17 and name HE% )
2.900 1.100 1.100 peak 706 spectrum 1 weight 0.10000E+01 volume 0.14884E-02 ppm1 3.648 ppm2 6.962 CV 1
ASSI { 707}
(( segid " " and resid 17 and name HB3 ))
( segid " " and resid 17 and name HE% )
3.000 3.000 3.000 peak 707 spectrum 1 weight 0.10000E+01 volume 0.12794E-02 ppm1 3.749 ppm2 6.962 CV 1
ASSI { 708}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 17 and name HE% )
4.000 2.000 2.000 peak 708 spectrum 1 weight 0.10000E+01 volume 0.22474E-03 ppm1 4.032 ppm2 6.960 CV 1
ASSI { 709}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 17 and name HE% )
3.700 1.700 1.700 peak 709 spectrum 1 weight 0.10000E+01 volume 0.38977E-03 ppm1 4.113 ppm2 6.963 CV 1
ASSI { 710}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 22 and name HD2 ))
4.200 2.200 2.100 peak 710 spectrum 1 weight 0.10000E+01 volume 0.16631E-03 ppm1 3.153 ppm2 6.836 CV 1
ASSI { 711}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 30 and name HD2 ))
2.400 2.400 3.600 peak 711 spectrum 1 weight 0.10000E+01 volume 0.52418E-02 ppm1 3.154 ppm2 6.794 CV 1
ASSI { 712}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HD2 ))
2.400 0.700 0.700 peak 712 spectrum 1 weight 0.10000E+01 volume 0.45378E-02 ppm1 3.303 ppm2 6.794 CV 1
ASSI { 714}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HD2 ))
3.100 1.200 1.200 peak 714 spectrum 1 weight 0.10000E+01 volume 0.96483E-03 ppm1 3.282 ppm2 6.835 CV 1
ASSI { 716}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 30 and name HD2 ))
4.000 2.000 2.000 peak 716 spectrum 1 weight 0.10000E+01 volume 0.24164E-03 ppm1 4.035 ppm2 6.792 CV 1
OR { 716}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 30 and name HD2 ))
OR { 716}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 30 and name HD2 ))
ASSI { 717}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 30 and name HD2 ))
4.600 2.700 1.700 peak 717 spectrum 1 weight 0.10000E+01 volume 0.94403E-04 ppm1 4.126 ppm2 6.791 CV 1
ASSI { 718}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HE ))
3.500 1.600 1.600 peak 718 spectrum 1 weight 0.10000E+01 volume 0.47490E-03 ppm1 4.037 ppm2 7.067 CV 1
ASSI { 719}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 23 and name HN ))
3.600 1.600 1.600 peak 719 spectrum 1 weight 0.10000E+01 volume 0.42818E-03 ppm1 3.968 ppm2 7.129 CV 1
ASSI { 720}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 23 and name HN ))
3.300 1.400 1.400 peak 720 spectrum 1 weight 0.10000E+01 volume 0.69666E-03 ppm1 3.749 ppm2 7.127 CV 1
ASSI { 722}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HZ3 ))
3.300 3.300 2.700 peak 722 spectrum 1 weight 0.10000E+01 volume 0.73315E-03 ppm1 4.111 ppm2 7.228 CV 1
ASSI { 723}
(( segid " " and resid 18 and name HB3 ))
( segid " " and resid 8 and name HD% )
4.000 2.000 2.000 peak 723 spectrum 1 weight 0.10000E+01 volume 0.22846E-03 ppm1 4.115 ppm2 7.179 CV 1
ASSI { 724}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 22 and name HN ))
3.700 1.700 1.700 peak 724 spectrum 1 weight 0.10000E+01 volume 0.34497E-03 ppm1 3.747 ppm2 7.320 CV 1
ASSI { 725}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 22 and name HN ))
3.800 1.800 1.800 peak 725 spectrum 1 weight 0.10000E+01 volume 0.33601E-03 ppm1 3.462 ppm2 7.324 CV 1
ASSI { 726}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 17 and name HD% )
2.400 0.700 0.700 peak 726 spectrum 1 weight 0.10000E+01 volume 0.45954E-02 ppm1 3.118 ppm2 7.452 CV 1
ASSI { 728}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 17 and name HD% )
2.500 0.800 0.800 peak 728 spectrum 1 weight 0.10000E+01 volume 0.35777E-02 ppm1 3.281 ppm2 7.450 CV 1
ASSI { 729}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 25 and name HN ))
3.700 1.700 1.700 peak 729 spectrum 1 weight 0.10000E+01 volume 0.35233E-03 ppm1 3.292 ppm2 7.501 CV 1
ASSI { 730}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 31 and name HN ))
2.900 2.900 3.100 peak 730 spectrum 1 weight 0.10000E+01 volume 0.17383E-02 ppm1 3.156 ppm2 7.581 CV 1
ASSI { 731}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 29 and name HN ))
3.600 3.600 2.400 peak 731 spectrum 1 weight 0.10000E+01 volume 0.40353E-03 ppm1 3.162 ppm2 7.662 CV 1
ASSI { 732}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 29 and name HN ))
3.500 1.500 1.500 peak 732 spectrum 1 weight 0.10000E+01 volume 0.51938E-03 ppm1 3.294 ppm2 7.662 CV 1
ASSI { 733}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 31 and name HN ))
3.000 1.100 1.100 peak 733 spectrum 1 weight 0.10000E+01 volume 0.12205E-02 ppm1 3.296 ppm2 7.583 CV 1
ASSI { 734}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 15 and name HD1 ))
4.000 2.000 2.000 peak 734 spectrum 1 weight 0.10000E+01 volume 0.21758E-03 ppm1 3.272 ppm2 7.782 CV 1
ASSI { 735}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 15 and name HD1 ))
3.500 3.500 2.500 peak 735 spectrum 1 weight 0.10000E+01 volume 0.51170E-03 ppm1 3.400 ppm2 7.784 CV 1
ASSI { 737}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 16 and name HN ))
2.000 0.500 0.500 peak 737 spectrum 1 weight 0.10000E+01 volume 0.13543E-01 ppm1 4.115 ppm2 7.713 CV 1
ASSI { 738}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HD1 ))
2.700 2.700 3.300 peak 738 spectrum 1 weight 0.10000E+01 volume 0.23482E-02 ppm1 4.113 ppm2 7.782 CV 1
ASSI { 740}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 31 and name HN ))
2.700 0.900 0.900 peak 740 spectrum 1 weight 0.10000E+01 volume 0.25947E-02 ppm1 4.037 ppm2 7.582 CV 1
OR { 740}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 31 and name HN ))
ASSI { 741}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HN ))
3.300 1.400 1.400 peak 741 spectrum 1 weight 0.10000E+01 volume 0.71939E-03 ppm1 3.960 ppm2 7.502 CV 1
ASSI { 742}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 17 and name HD% )
3.600 3.600 2.400 peak 742 spectrum 1 weight 0.10000E+01 volume 0.42850E-03 ppm1 4.028 ppm2 7.452 CV 1
OR { 742}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 17 and name HD% )
OR { 742}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 15 and name HE3 ))
OR { 742}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 17 and name HD% )
ASSI { 744}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 19 and name HN ))
3.400 1.500 1.500 peak 744 spectrum 1 weight 0.10000E+01 volume 0.58114E-03 ppm1 4.167 ppm2 7.429 CV 1
ASSI { 746}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 30 and name HN ))
2.600 0.800 0.800 peak 746 spectrum 1 weight 0.10000E+01 volume 0.31745E-02 ppm1 4.042 ppm2 7.392 CV 1
ASSI { 747}
(( segid " " and resid 17 and name HB3 ))
( segid " " and resid 17 and name HD% )
2.100 0.500 0.500 peak 747 spectrum 1 weight 0.10000E+01 volume 0.11741E-01 ppm1 3.744 ppm2 7.449 CV 1
ASSI { 748}
(( segid " " and resid 10 and name HB3 ))
( segid " " and resid 17 and name HD% )
3.700 1.700 1.700 peak 748 spectrum 1 weight 0.10000E+01 volume 0.38017E-03 ppm1 3.636 ppm2 7.458 CV 1
ASSI { 750}
(( segid " " and resid 7 and name HD3 ))
( segid " " and resid 8 and name HE% )
3.300 3.300 2.700 peak 750 spectrum 1 weight 0.10000E+01 volume 0.69154E-03 ppm1 3.670 ppm2 7.398 CV 1
ASSI { 753}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 26 and name HN ))
2.700 0.900 0.900 peak 753 spectrum 1 weight 0.10000E+01 volume 0.25719E-02 ppm1 3.462 ppm2 7.501 CV 1
ASSI { 754}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 17 and name HD% )
2.600 0.800 0.800 peak 754 spectrum 1 weight 0.10000E+01 volume 0.31092E-02 ppm1 3.464 ppm2 7.454 CV 1
ASSI { 755}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 8 and name HE% )
2.600 0.800 0.800 peak 755 spectrum 1 weight 0.10000E+01 volume 0.32321E-02 ppm1 3.469 ppm2 7.398 CV 1
ASSI { 757}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HN ))
2.800 1.000 1.000 peak 757 spectrum 1 weight 0.10000E+01 volume 0.19098E-02 ppm1 4.328 ppm2 7.128 CV 1
ASSI { 758}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 8 and name HD% )
4.400 2.500 1.900 peak 758 spectrum 1 weight 0.10000E+01 volume 0.12218E-03 ppm1 4.318 ppm2 7.178 CV 1
OR { 758}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 8 and name HD% )
OR { 758}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 8 and name HD% )
ASSI { 759}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 8 and name HD% )
3.200 3.200 2.800 peak 759 spectrum 1 weight 0.10000E+01 volume 0.87363E-03 ppm1 4.236 ppm2 7.180 CV 1
ASSI { 762}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HN ))
2.600 0.800 0.800 peak 762 spectrum 1 weight 0.10000E+01 volume 0.30199E-02 ppm1 4.332 ppm2 7.501 CV 1
ASSI { 763}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name HN ))
2.200 0.600 0.600 peak 763 spectrum 1 weight 0.10000E+01 volume 0.82435E-02 ppm1 4.410 ppm2 7.740 CV 1
ASSI { 764}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 30 and name HN ))
3.500 1.600 1.600 peak 764 spectrum 1 weight 0.10000E+01 volume 0.47586E-03 ppm1 4.480 ppm2 7.394 CV 1
ASSI { 765}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 8 and name HD% )
3.800 1.800 1.800 peak 765 spectrum 1 weight 0.10000E+01 volume 0.32481E-03 ppm1 4.496 ppm2 7.181 CV 1
ASSI { 766}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 22 and name HN ))
3.900 1.900 1.900 peak 766 spectrum 1 weight 0.10000E+01 volume 0.27819E-03 ppm1 4.606 ppm2 7.318 CV 1
ASSI { 767}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 8 and name HE% )
2.400 0.700 0.700 peak 767 spectrum 1 weight 0.10000E+01 volume 0.44898E-02 ppm1 4.608 ppm2 7.399 CV 1
ASSI { 768}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 19 and name HN ))
2.900 1.100 1.100 peak 768 spectrum 1 weight 0.10000E+01 volume 0.15060E-02 ppm1 4.749 ppm2 7.431 CV 1
ASSI { 769}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 8 and name HD% )
2.900 1.000 1.000 peak 769 spectrum 1 weight 0.10000E+01 volume 0.16183E-02 ppm1 4.608 ppm2 7.180 CV 1
ASSI { 770}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 8 and name HD% )
2.100 2.100 3.900 peak 770 spectrum 1 weight 0.10000E+01 volume 0.10103E-01 ppm1 4.699 ppm2 7.181 CV 1
ASSI { 772}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 17 and name HE% )
3.600 1.700 1.700 peak 772 spectrum 1 weight 0.10000E+01 volume 0.40705E-03 ppm1 4.789 ppm2 6.961 CV 1
ASSI { 773}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 30 and name HD2 ))
3.800 1.800 1.800 peak 773 spectrum 1 weight 0.10000E+01 volume 0.31988E-03 ppm1 4.799 ppm2 6.792 CV 1
ASSI { 774}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 30 and name HD2 ))
4.100 2.100 2.100 peak 774 spectrum 1 weight 0.10000E+01 volume 0.21210E-03 ppm1 4.324 ppm2 6.794 CV 1
ASSI { 775}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HN ))
2.500 0.800 0.800 peak 775 spectrum 1 weight 0.10000E+01 volume 0.35425E-02 ppm1 4.725 ppm2 7.582 CV 1
ASSI { 776}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 29 and name HN ))
4.400 2.400 1.900 peak 776 spectrum 1 weight 0.10000E+01 volume 0.13613E-03 ppm1 4.728 ppm2 7.664 CV 1
ASSI { 777}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 17 and name HE% )
3.200 1.300 1.300 peak 777 spectrum 1 weight 0.10000E+01 volume 0.93763E-03 ppm1 5.164 ppm2 6.960 CV 1
ASSI { 778}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 17 and name HD% )
2.500 0.800 0.800 peak 778 spectrum 1 weight 0.10000E+01 volume 0.37121E-02 ppm1 5.161 ppm2 7.453 CV 1
ASSI { 781}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 26 and name HD2 ))
4.700 2.800 1.600 peak 781 spectrum 1 weight 0.10000E+01 volume 0.88067E-04 ppm1 5.160 ppm2 7.231 CV 1
OR { 781}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 15 and name HZ3 ))
ASSI { 783}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 8 and name HE% )
4.200 2.300 2.100 peak 783 spectrum 1 weight 0.10000E+01 volume 0.16090E-03 ppm1 4.232 ppm2 7.399 CV 1
ASSI { 785}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 17 and name HZ ))
3.300 1.300 1.300 peak 785 spectrum 1 weight 0.10000E+01 volume 0.76675E-03 ppm1 1.194 ppm2 6.458 CV 1
ASSI { 787}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 9 and name HE22))
4.200 2.200 2.100 peak 787 spectrum 1 weight 0.10000E+01 volume 0.16177E-03 ppm1 1.202 ppm2 6.207 CV 1
ASSI { 788}
(( segid " " and resid 9 and name HG3 ))
(( segid " " and resid 9 and name HE22))
2.700 2.700 3.300 peak 788 spectrum 1 weight 0.10000E+01 volume 0.22401E-02 ppm1 2.183 ppm2 6.201 CV 1
ASSI { 789}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HE22))
3.100 1.200 1.200 peak 789 spectrum 1 weight 0.10000E+01 volume 0.10544E-02 ppm1 2.319 ppm2 6.200 CV 1
ASSI { 790}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 9 and name HE22))
3.300 1.400 1.400 peak 790 spectrum 1 weight 0.10000E+01 volume 0.71075E-03 ppm1 2.702 ppm2 6.201 CV 1
OR { 790}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 9 and name HE22))
ASSI { 791}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 17 and name HZ ))
2.700 0.900 0.900 peak 791 spectrum 1 weight 0.10000E+01 volume 0.24676E-02 ppm1 2.632 ppm2 6.461 CV 1
ASSI { 792}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 17 and name HZ ))
2.900 1.100 1.100 peak 792 spectrum 1 weight 0.10000E+01 volume 0.14599E-02 ppm1 2.720 ppm2 6.460 CV 1
ASSI { 793}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 17 and name HZ ))
2.500 0.800 0.800 peak 793 spectrum 1 weight 0.10000E+01 volume 0.42561E-02 ppm1 2.818 ppm2 6.460 CV 1
ASSI { 795}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 17 and name HZ ))
2.800 1.000 1.000 peak 795 spectrum 1 weight 0.10000E+01 volume 0.20369E-02 ppm1 3.190 ppm2 6.462 CV 1
ASSI { 796}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 17 and name HZ ))
3.600 1.700 1.700 peak 796 spectrum 1 weight 0.10000E+01 volume 0.40481E-03 ppm1 3.458 ppm2 6.458 CV 1
ASSI { 797}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 9 and name HE22))
3.400 3.400 2.600 peak 797 spectrum 1 weight 0.10000E+01 volume 0.61250E-03 ppm1 3.642 ppm2 6.201 CV 1
ASSI { 798}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 9 and name HE22))
3.900 1.900 1.900 peak 798 spectrum 1 weight 0.10000E+01 volume 0.28155E-03 ppm1 3.794 ppm2 6.201 CV 1
ASSI { 799}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 9 and name HE22))
5.000 3.100 1.300 peak 799 spectrum 1 weight 0.10000E+01 volume 0.60290E-04 ppm1 4.120 ppm2 6.204 CV 1
ASSI { 800}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 17 and name HZ ))
3.400 1.400 1.400 peak 800 spectrum 1 weight 0.10000E+01 volume 0.64866E-03 ppm1 4.031 ppm2 6.461 CV 1
ASSI { 801}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 17 and name HZ ))
3.900 1.900 1.900 peak 801 spectrum 1 weight 0.10000E+01 volume 0.28420E-03 ppm1 4.115 ppm2 6.459 CV 1
ASSI { 802}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 9 and name HE22))
2.500 0.800 0.800 peak 802 spectrum 1 weight 0.10000E+01 volume 0.34337E-02 ppm1 4.601 ppm2 6.201 CV 1
ASSI { 803}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 9 and name HE22))
5.200 3.400 1.100 peak 803 spectrum 1 weight 0.10000E+01 volume 0.48674E-04 ppm1 5.158 ppm2 6.204 CV 1
ASSI { 804}
( segid " " and resid 17 and name HE% )
(( segid " " and resid 15 and name HE1 ))
4.500 2.600 1.800 peak 804 spectrum 1 weight 0.10000E+01 volume 0.10996E-03 ppm1 6.968 ppm2 10.239 CV 1
ASSI { 805}
(( segid " " and resid 15 and name HZ3 ))
(( segid " " and resid 15 and name HE1 ))
4.900 3.000 1.400 peak 805 spectrum 1 weight 0.10000E+01 volume 0.70498E-04 ppm1 7.224 ppm2 10.242 CV 1
OR { 805}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 15 and name HE1 ))
ASSI { 806}
(( segid " " and resid 15 and name HH2 ))
(( segid " " and resid 15 and name HE1 ))
4.300 2.300 2.000 peak 806 spectrum 1 weight 0.10000E+01 volume 0.15850E-03 ppm1 7.293 ppm2 10.238 CV 1
ASSI { 807}
(( segid " " and resid 15 and name HE3 ))
(( segid " " and resid 15 and name HE1 ))
3.800 1.800 1.800 peak 807 spectrum 1 weight 0.10000E+01 volume 0.32577E-03 ppm1 7.449 ppm2 10.242 CV 1
ASSI { 809}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HN ))
2.400 0.700 0.700 peak 809 spectrum 1 weight 0.10000E+01 volume 0.46210E-02 ppm1 7.434 ppm2 9.765 CV 1
ASSI { 810}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
2.100 0.600 0.600 peak 810 spectrum 1 weight 0.10000E+01 volume 0.10602E-01 ppm1 7.888 ppm2 9.336 CV 1
ASSI { 811}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 12 and name HN ))
3.500 1.500 1.500 peak 811 spectrum 1 weight 0.10000E+01 volume 0.52354E-03 ppm1 6.784 ppm2 9.338 CV 1
ASSI { 812}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HE1 ))
4.100 2.100 2.100 peak 812 spectrum 1 weight 0.10000E+01 volume 0.19553E-03 ppm1 9.032 ppm2 10.246 CV 1
ASSI { 814}
( segid " " and resid 17 and name HE% )
(( segid " " and resid 10 and name HN ))
3.400 1.400 1.400 peak 814 spectrum 1 weight 0.10000E+01 volume 0.60642E-03 ppm1 6.959 ppm2 9.067 CV 1
ASSI { 815}
( segid " " and resid 17 and name HE% )
(( segid " " and resid 15 and name HN ))
3.700 1.700 1.700 peak 815 spectrum 1 weight 0.10000E+01 volume 0.38465E-03 ppm1 6.960 ppm2 9.034 CV 1
ASSI { 816}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 21 and name HN ))
3.900 1.900 1.900 peak 816 spectrum 1 weight 0.10000E+01 volume 0.25002E-03 ppm1 6.834 ppm2 8.859 CV 1
ASSI { 817}
( segid " " and resid 17 and name HE% )
(( segid " " and resid 17 and name HN ))
3.500 1.500 1.500 peak 817 spectrum 1 weight 0.10000E+01 volume 0.51202E-03 ppm1 6.962 ppm2 8.665 CV 1
ASSI { 821}
( segid " " and resid 8 and name HD% )
(( segid " " and resid 20 and name HN ))
2.700 2.700 3.300 peak 821 spectrum 1 weight 0.10000E+01 volume 0.26507E-02 ppm1 7.178 ppm2 8.604 CV 1
ASSI { 822}
( segid " " and resid 8 and name HD% )
(( segid " " and resid 17 and name HN ))
3.400 1.400 1.400 peak 822 spectrum 1 weight 0.10000E+01 volume 0.64642E-03 ppm1 7.174 ppm2 8.663 CV 1
ASSI { 823}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 20 and name HN ))
4.100 2.100 2.100 peak 823 spectrum 1 weight 0.10000E+01 volume 0.20900E-03 ppm1 7.308 ppm2 8.607 CV 1
ASSI { 824}
( segid " " and resid 8 and name HE% )
(( segid " " and resid 20 and name HN ))
2.500 0.800 0.800 peak 824 spectrum 1 weight 0.10000E+01 volume 0.35841E-02 ppm1 7.401 ppm2 8.606 CV 1
ASSI { 825}
( segid " " and resid 17 and name HD% )
(( segid " " and resid 17 and name HN ))
2.400 0.700 0.700 peak 825 spectrum 1 weight 0.10000E+01 volume 0.53986E-02 ppm1 7.448 ppm2 8.664 CV 1
ASSI { 831}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 21 and name HN ))
3.500 1.500 1.500 peak 831 spectrum 1 weight 0.10000E+01 volume 0.51714E-03 ppm1 7.124 ppm2 8.859 CV 1
ASSI { 832}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HN ))
2.500 0.800 0.800 peak 832 spectrum 1 weight 0.10000E+01 volume 0.38977E-02 ppm1 7.322 ppm2 8.863 CV 1
ASSI { 833}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 21 and name HN ))
4.200 2.200 2.100 peak 833 spectrum 1 weight 0.10000E+01 volume 0.16458E-03 ppm1 7.414 ppm2 8.865 CV 1
OR { 833}
( segid " " and resid 8 and name HE% )
(( segid " " and resid 21 and name HN ))
ASSI { 834}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 15 and name HN ))
3.500 1.500 1.500 peak 834 spectrum 1 weight 0.10000E+01 volume 0.51042E-03 ppm1 7.227 ppm2 9.033 CV 1
ASSI { 835}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 10 and name HN ))
3.400 1.500 1.500 peak 835 spectrum 1 weight 0.10000E+01 volume 0.56098E-03 ppm1 7.226 ppm2 9.071 CV 1
ASSI { 836}
(( segid " " and resid 15 and name HE3 ))
(( segid " " and resid 15 and name HN ))
3.500 3.500 2.500 peak 836 spectrum 1 weight 0.10000E+01 volume 0.49986E-03 ppm1 7.449 ppm2 9.033 CV 1
ASSI { 837}
( segid " " and resid 17 and name HD% )
(( segid " " and resid 10 and name HN ))
3.500 1.500 1.500 peak 837 spectrum 1 weight 0.10000E+01 volume 0.49378E-03 ppm1 7.450 ppm2 9.068 CV 1
ASSI { 838}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HN ))
3.100 3.100 2.900 peak 838 spectrum 1 weight 0.10000E+01 volume 0.97251E-03 ppm1 7.705 ppm2 9.032 CV 1
ASSI { 840}
(( segid " " and resid 15 and name HD1 ))
(( segid " " and resid 15 and name HN ))
2.600 0.900 0.900 peak 840 spectrum 1 weight 0.10000E+01 volume 0.28078E-02 ppm1 7.779 ppm2 9.033 CV 1
ASSI { 841}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 15 and name HN ))
3.700 1.700 1.700 peak 841 spectrum 1 weight 0.10000E+01 volume 0.36833E-03 ppm1 7.891 ppm2 9.032 CV 1
ASSI { 842}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 10 and name HN ))
3.900 1.900 1.900 peak 842 spectrum 1 weight 0.10000E+01 volume 0.26052E-03 ppm1 7.891 ppm2 9.068 CV 1
ASSI { 843}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 21 and name HN ))
3.900 1.900 1.900 peak 843 spectrum 1 weight 0.10000E+01 volume 0.27195E-03 ppm1 7.967 ppm2 8.860 CV 1
ASSI { 844}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HN ))
2.500 0.800 0.800 peak 844 spectrum 1 weight 0.10000E+01 volume 0.36769E-02 ppm1 8.082 ppm2 8.503 CV 1
ASSI { 846}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 9 and name HN ))
3.100 1.200 1.200 peak 846 spectrum 1 weight 0.10000E+01 volume 0.11168E-02 ppm1 8.219 ppm2 8.601 CV 1
ASSI { 847}
(( segid " " and resid 19 and name HE ))
(( segid " " and resid 20 and name HN ))
3.700 1.700 1.700 peak 847 spectrum 1 weight 0.10000E+01 volume 0.35681E-03 ppm1 8.121 ppm2 8.605 CV 1
ASSI { 848}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 17 and name HN ))
2.800 1.000 1.000 peak 848 spectrum 1 weight 0.10000E+01 volume 0.19050E-02 ppm1 8.219 ppm2 8.661 CV 1
ASSI { 849}
(( segid " " and resid 19 and name HE ))
(( segid " " and resid 21 and name HN ))
3.400 1.500 1.500 peak 849 spectrum 1 weight 0.10000E+01 volume 0.59266E-03 ppm1 8.116 ppm2 8.865 CV 1
ASSI { 850}
(( segid " " and resid 9 and name HE21))
(( segid " " and resid 15 and name HN ))
3.700 1.700 1.700 peak 850 spectrum 1 weight 0.10000E+01 volume 0.36513E-03 ppm1 8.155 ppm2 9.033 CV 1
ASSI { 851}
(( segid " " and resid 9 and name HE21))
(( segid " " and resid 10 and name HN ))
2.800 1.000 1.000 peak 851 spectrum 1 weight 0.10000E+01 volume 0.19985E-02 ppm1 8.153 ppm2 9.071 CV 1
ASSI { 852}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HN ))
2.500 0.800 0.800 peak 852 spectrum 1 weight 0.10000E+01 volume 0.41217E-02 ppm1 8.299 ppm2 9.033 CV 1
ASSI { 853}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 10 and name HN ))
3.700 1.800 1.800 peak 853 spectrum 1 weight 0.10000E+01 volume 0.34049E-03 ppm1 8.304 ppm2 9.068 CV 1
ASSI { 854}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 10 and name HN ))
3.200 1.300 1.300 peak 854 spectrum 1 weight 0.10000E+01 volume 0.79907E-03 ppm1 8.595 ppm2 9.068 CV 1
ASSI { 855}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 10 and name HN ))
3.500 1.600 1.600 peak 855 spectrum 1 weight 0.10000E+01 volume 0.48514E-03 ppm1 8.661 ppm2 9.068 CV 1
ASSI { 856}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 10 and name HN ))
4.300 2.300 2.000 peak 856 spectrum 1 weight 0.10000E+01 volume 0.15469E-03 ppm1 8.504 ppm2 9.070 CV 1
ASSI { 859}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 21 and name HN ))
2.500 0.800 0.800 peak 859 spectrum 1 weight 0.10000E+01 volume 0.36225E-02 ppm1 8.602 ppm2 8.862 CV 1
ASSI { 862}
(( segid " " and resid 9 and name HE22))
(( segid " " and resid 14 and name HN ))
3.600 1.600 1.600 peak 862 spectrum 1 weight 0.10000E+01 volume 0.41921E-03 ppm1 6.198 ppm2 8.306 CV 1
ASSI { 864}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 19 and name HE ))
2.700 0.900 0.900 peak 864 spectrum 1 weight 0.10000E+01 volume 0.22193E-02 ppm1 6.832 ppm2 8.121 CV 1
ASSI { 865}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 19 and name HH21))
3.500 1.600 1.600 peak 865 spectrum 1 weight 0.10000E+01 volume 0.48834E-03 ppm1 6.838 ppm2 8.025 CV 1
ASSI { 868}
(( segid " " and resid 17 and name HZ ))
(( segid " " and resid 15 and name HD1 ))
4.200 2.200 2.100 peak 868 spectrum 1 weight 0.10000E+01 volume 0.17415E-03 ppm1 6.460 ppm2 7.783 CV 1
ASSI { 871}
( segid " " and resid 17 and name HE% )
(( segid " " and resid 15 and name HD1 ))
3.800 1.800 1.800 peak 871 spectrum 1 weight 0.10000E+01 volume 0.31902E-03 ppm1 6.960 ppm2 7.785 CV 1
ASSI { 873}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 29 and name HN ))
3.800 1.800 1.800 peak 873 spectrum 1 weight 0.10000E+01 volume 0.29425E-03 ppm1 6.790 ppm2 7.661 CV 1
ASSI { 877}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HN ))
2.400 0.700 0.700 peak 877 spectrum 1 weight 0.10000E+01 volume 0.53538E-02 ppm1 7.127 ppm2 7.966 CV 1
ASSI { 879}
( segid " " and resid 8 and name HD% )
(( segid " " and resid 8 and name HN ))
2.400 0.700 0.700 peak 879 spectrum 1 weight 0.10000E+01 volume 0.47650E-02 ppm1 7.177 ppm2 8.227 CV 1
ASSI { 880}
( segid " " and resid 8 and name HE% )
(( segid " " and resid 8 and name HN ))
3.100 3.100 2.900 peak 880 spectrum 1 weight 0.10000E+01 volume 0.98723E-03 ppm1 7.401 ppm2 8.225 CV 1
ASSI { 881}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 32 and name HN ))
3.500 1.600 1.600 peak 881 spectrum 1 weight 0.10000E+01 volume 0.47074E-03 ppm1 7.395 ppm2 8.283 CV 1
ASSI { 882}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 32 and name HN ))
2.700 0.900 0.900 peak 882 spectrum 1 weight 0.10000E+01 volume 0.26036E-02 ppm1 7.579 ppm2 8.287 CV 1
ASSI { 883}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HN ))
3.200 1.300 1.300 peak 883 spectrum 1 weight 0.10000E+01 volume 0.92227E-03 ppm1 7.736 ppm2 8.289 CV 1
ASSI { 884}
(( segid " " and resid 15 and name HD1 ))
(( segid " " and resid 14 and name HN ))
3.300 1.400 1.400 peak 884 spectrum 1 weight 0.10000E+01 volume 0.67746E-03 ppm1 7.777 ppm2 8.304 CV 1
ASSI { 885}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 14 and name HN ))
2.700 0.900 0.900 peak 885 spectrum 1 weight 0.10000E+01 volume 0.23898E-02 ppm1 7.896 ppm2 8.304 CV 1
ASSI { 886}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HN ))
2.400 0.700 0.700 peak 886 spectrum 1 weight 0.10000E+01 volume 0.49378E-02 ppm1 7.500 ppm2 7.965 CV 1
ASSI { 887}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 24 and name HN ))
3.400 1.400 1.400 peak 887 spectrum 1 weight 0.10000E+01 volume 0.61442E-03 ppm1 7.313 ppm2 7.962 CV 1
ASSI { 888}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 19 and name HH21))
4.200 2.200 2.100 peak 888 spectrum 1 weight 0.10000E+01 volume 0.16881E-03 ppm1 7.317 ppm2 8.027 CV 1
ASSI { 889}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 19 and name HE ))
3.400 1.400 1.400 peak 889 spectrum 1 weight 0.10000E+01 volume 0.61762E-03 ppm1 7.311 ppm2 8.121 CV 1
ASSI { 890}
(( segid " " and resid 15 and name HE3 ))
(( segid " " and resid 15 and name HD1 ))
2.600 2.600 3.400 peak 890 spectrum 1 weight 0.10000E+01 volume 0.32545E-02 ppm1 7.444 ppm2 7.782 CV 1
ASSI { 893}
(( segid " " and resid 15 and name HZ3 ))
(( segid " " and resid 16 and name HN ))
2.800 2.800 3.200 peak 893 spectrum 1 weight 0.10000E+01 volume 0.19607E-02 ppm1 7.229 ppm2 7.712 CV 1
ASSI { 894}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HN ))
2.300 0.700 0.700 peak 894 spectrum 1 weight 0.10000E+01 volume 0.63394E-02 ppm1 7.392 ppm2 7.664 CV 1
ASSI { 895}
(( segid " " and resid 15 and name HZ2 ))
(( segid " " and resid 15 and name HD1 ))
3.200 3.200 2.800 peak 895 spectrum 1 weight 0.10000E+01 volume 0.83331E-03 ppm1 7.570 ppm2 7.780 CV 1
ASSI { 897}
(( segid " " and resid 17 and name HZ ))
(( segid " " and resid 26 and name HN ))
3.500 1.600 1.600 peak 897 spectrum 1 weight 0.10000E+01 volume 0.48194E-03 ppm1 6.458 ppm2 7.498 CV 1
ASSI { 898}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 25 and name HN ))
3.600 3.600 2.400 peak 898 spectrum 1 weight 0.10000E+01 volume 0.45666E-03 ppm1 6.832 ppm2 7.500 CV 1
ASSI { 899}
(( segid " " and resid 22 and name HD2 ))
( segid " " and resid 17 and name HD% )
5.100 3.200 1.200 peak 899 spectrum 1 weight 0.10000E+01 volume 0.56162E-04 ppm1 6.825 ppm2 7.448 CV 1
ASSI { 900}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 30 and name HN ))
2.900 2.900 3.100 peak 900 spectrum 1 weight 0.10000E+01 volume 0.15485E-02 ppm1 6.789 ppm2 7.392 CV 1
ASSI { 902}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 26 and name HD2 ))
2.600 2.600 3.400 peak 902 spectrum 1 weight 0.10000E+01 volume 0.28484E-02 ppm1 6.789 ppm2 7.228 CV 1
ASSI { 904}
(( segid " " and resid 22 and name HD2 ))
(( segid " " and resid 22 and name HN ))
2.700 0.900 0.900 peak 904 spectrum 1 weight 0.10000E+01 volume 0.26807E-02 ppm1 6.835 ppm2 7.319 CV 1
ASSI { 905}
( segid " " and resid 17 and name HE% )
(( segid " " and resid 26 and name HN ))
3.800 1.800 1.800 peak 905 spectrum 1 weight 0.10000E+01 volume 0.32225E-03 ppm1 6.962 ppm2 7.502 CV 1
ASSI { 910}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HN ))
2.400 0.700 0.700 peak 910 spectrum 1 weight 0.10000E+01 volume 0.44258E-02 ppm1 7.125 ppm2 7.317 CV 1
ASSI { 911}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 25 and name HN ))
3.200 1.200 1.200 peak 911 spectrum 1 weight 0.10000E+01 volume 0.95715E-03 ppm1 7.126 ppm2 7.501 CV 1
ASSI { 913}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HN ))
2.400 0.700 0.700 peak 913 spectrum 1 weight 0.10000E+01 volume 0.43906E-02 ppm1 7.391 ppm2 7.583 CV 1
ASSI { 914}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 6 and name HA ))
3.200 1.300 1.300 peak 914 spectrum 1 weight 0.10000E+01 volume 0.80131E-03 ppm1 4.748 ppm2 4.497 CV 1
ASSI { 915}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HD2 ))
2.400 0.700 0.700 peak 915 spectrum 1 weight 0.10000E+01 volume 0.46466E-02 ppm1 4.789 ppm2 4.328 CV 1
OR { 915}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HD3 ))
ASSI { 916}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 9 and name HA ))
2.700 0.900 0.900 peak 916 spectrum 1 weight 0.10000E+01 volume 0.26526E-02 ppm1 5.164 ppm2 4.308 CV 1
ASSI { 917}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 7 and name HA ))
3.500 3.500 2.500 peak 917 spectrum 1 weight 0.10000E+01 volume 0.47650E-03 ppm1 4.754 ppm2 4.232 CV 1
ASSI { 918}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 27 and name HD2 ))
2.000 0.500 0.500 peak 918 spectrum 1 weight 0.10000E+01 volume 0.13888E-01 ppm1 4.331 ppm2 4.119 CV 1
ASSI { 919}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 5 and name HA ))
3.400 1.400 1.400 peak 919 spectrum 1 weight 0.10000E+01 volume 0.62402E-03 ppm1 4.489 ppm2 4.043 CV 1
ASSI { 920}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 16 and name HB2 ))
2.600 2.600 3.400 peak 920 spectrum 1 weight 0.10000E+01 volume 0.32161E-02 ppm1 4.309 ppm2 3.794 CV 1
ASSI { 921}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 10 and name HB3 ))
3.100 1.200 1.200 peak 921 spectrum 1 weight 0.10000E+01 volume 0.10836E-02 ppm1 4.320 ppm2 3.650 CV 1
OR { 921}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 10 and name HB3 ))
ASSI { 922}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 16 and name HB3 ))
2.800 2.800 3.200 peak 922 spectrum 1 weight 0.10000E+01 volume 0.20500E-02 ppm1 4.308 ppm2 3.596 CV 1
ASSI { 923}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HD3 ))
2.200 0.600 0.600 peak 923 spectrum 1 weight 0.10000E+01 volume 0.78723E-02 ppm1 4.499 ppm2 3.668 CV 1
ASSI { 924}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HD2 ))
2.200 0.600 0.600 peak 924 spectrum 1 weight 0.10000E+01 volume 0.94627E-02 ppm1 4.498 ppm2 3.724 CV 1
ASSI { 925}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 7 and name HD2 ))
2.600 0.800 0.800 peak 925 spectrum 1 weight 0.10000E+01 volume 0.33057E-02 ppm1 4.751 ppm2 3.723 CV 1
ASSI { 927}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 7 and name HD3 ))
2.400 2.400 3.600 peak 927 spectrum 1 weight 0.10000E+01 volume 0.45410E-02 ppm1 4.751 ppm2 3.667 CV 1
ASSI { 931}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 27 and name HD3 ))
2.800 1.000 1.000 peak 931 spectrum 1 weight 0.10000E+01 volume 0.20206E-02 ppm1 4.124 ppm2 3.320 CV 1
ASSI { 933}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 23 and name HA ))
3.600 3.600 2.400 peak 933 spectrum 1 weight 0.10000E+01 volume 0.40993E-03 ppm1 4.023 ppm2 3.466 CV 1
ASSI { 935}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HB2 ))
3.500 1.600 1.600 peak 935 spectrum 1 weight 0.10000E+01 volume 0.48578E-03 ppm1 4.613 ppm2 3.476 CV 1
ASSI { 937}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HB3 ))
3.100 1.200 1.200 peak 937 spectrum 1 weight 0.10000E+01 volume 0.10874E-02 ppm1 4.615 ppm2 3.174 CV 1
ASSI { 938}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HA ))
3.000 3.000 3.000 peak 938 spectrum 1 weight 0.10000E+01 volume 0.12304E-02 ppm1 4.607 ppm2 3.112 CV 1
ASSI { 939}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 26 and name HB2 ))
3.900 1.900 1.900 peak 939 spectrum 1 weight 0.10000E+01 volume 0.27572E-03 ppm1 4.331 ppm2 3.187 CV 1
ASSI { 940}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HB2 ))
3.500 3.500 2.500 peak 940 spectrum 1 weight 0.10000E+01 volume 0.47778E-03 ppm1 4.233 ppm2 3.034 CV 1
OR { 940}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HB3 ))
ASSI { 943}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 10 and name HB2 ))
2.700 2.700 3.300 peak 943 spectrum 1 weight 0.10000E+01 volume 0.26558E-02 ppm1 4.321 ppm2 2.828 CV 1
OR { 943}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 945}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HD2 ))
3.000 3.000 3.000 peak 945 spectrum 1 weight 0.10000E+01 volume 0.13815E-02 ppm1 4.041 ppm2 2.868 CV 1
OR { 945}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HD3 ))
ASSI { 946}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 8 and name HB2 ))
2.900 1.000 1.000 peak 946 spectrum 1 weight 0.10000E+01 volume 0.16900E-02 ppm1 3.747 ppm2 3.028 CV 1
ASSI { 950}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 22 and name HB2 ))
2.900 1.100 1.100 peak 950 spectrum 1 weight 0.10000E+01 volume 0.15101E-02 ppm1 3.746 ppm2 3.280 CV 1
ASSI { 951}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 15 and name HB2 ))
3.300 1.400 1.400 peak 951 spectrum 1 weight 0.10000E+01 volume 0.71395E-03 ppm1 3.646 ppm2 2.720 CV 1
ASSI { 954}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 27 and name HG2 ))
2.900 1.000 1.000 peak 954 spectrum 1 weight 0.10000E+01 volume 0.17335E-02 ppm1 4.115 ppm2 2.363 CV 1
ASSI { 955}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 11 and name HB2 ))
3.200 1.300 1.300 peak 955 spectrum 1 weight 0.10000E+01 volume 0.85315E-03 ppm1 4.797 ppm2 2.362 CV 1
ASSI { 956}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 14 and name HB2 ))
3.100 1.200 1.200 peak 956 spectrum 1 weight 0.10000E+01 volume 0.96739E-03 ppm1 4.930 ppm2 2.703 CV 1
ASSI { 957}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HG2 ))
3.200 1.300 1.300 peak 957 spectrum 1 weight 0.10000E+01 volume 0.91555E-03 ppm1 4.498 ppm2 1.875 CV 1
ASSI { 958}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HG3 ))
3.200 1.300 1.300 peak 958 spectrum 1 weight 0.10000E+01 volume 0.81507E-03 ppm1 4.501 ppm2 1.791 CV 1
ASSI { 959}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 7 and name HG3 ))
3.300 1.400 1.400 peak 959 spectrum 1 weight 0.10000E+01 volume 0.67618E-03 ppm1 4.748 ppm2 1.792 CV 1
ASSI { 960}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 7 and name HG2 ))
3.500 1.500 1.500 peak 960 spectrum 1 weight 0.10000E+01 volume 0.49826E-03 ppm1 4.749 ppm2 1.874 CV 1
ASSI { 961}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 31 and name HB2 ))
3.000 3.000 3.000 peak 961 spectrum 1 weight 0.10000E+01 volume 0.12826E-02 ppm1 4.034 ppm2 2.036 CV 1
ASSI { 963}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 27 and name HB2 ))
3.400 1.500 1.500 peak 963 spectrum 1 weight 0.10000E+01 volume 0.57666E-03 ppm1 4.037 ppm2 2.177 CV 1
ASSI { 968}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 6 and name HB2 ))
3.600 1.700 1.700 peak 968 spectrum 1 weight 0.10000E+01 volume 0.40129E-03 ppm1 5.154 ppm2 1.533 CV 1
ASSI { 969}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 23 and name HD1%)
2.300 0.600 0.600 peak 969 spectrum 1 weight 0.10000E+01 volume 0.69058E-02 ppm1 4.792 ppm2 1.197 CV 1
ASSI { 970}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 23 and name HD2%)
3.100 1.200 1.200 peak 970 spectrum 1 weight 0.10000E+01 volume 0.10986E-02 ppm1 4.792 ppm2 1.098 CV 1
ASSI { 971}
(( segid " " and resid 8 and name HA ))
( segid " " and resid 23 and name HD2%)
2.800 1.000 1.000 peak 971 spectrum 1 weight 0.10000E+01 volume 0.18705E-02 ppm1 4.696 ppm2 1.098 CV 1
ASSI { 972}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 23 and name HD2%)
3.100 1.200 1.200 peak 972 spectrum 1 weight 0.10000E+01 volume 0.10874E-02 ppm1 4.307 ppm2 1.097 CV 1
ASSI { 973}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 24 and name HB% )
2.200 0.600 0.600 peak 973 spectrum 1 weight 0.10000E+01 volume 0.91811E-02 ppm1 4.305 ppm2 1.436 CV 1
ASSI { 974}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HB3 ))
2.900 1.100 1.100 peak 974 spectrum 1 weight 0.10000E+01 volume 0.15594E-02 ppm1 4.337 ppm2 1.555 CV 1
ASSI { 975}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HB2 ))
2.500 0.800 0.800 peak 975 spectrum 1 weight 0.10000E+01 volume 0.35937E-02 ppm1 4.334 ppm2 1.645 CV 1
ASSI { 976}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HD2 ))
5.200 3.400 1.100 peak 976 spectrum 1 weight 0.10000E+01 volume 0.45570E-04 ppm1 4.496 ppm2 1.618 CV 1
ASSI { 977}
(( segid " " and resid 27 and name HD2 ))
( segid " " and resid 23 and name HD2%)
3.300 1.300 1.300 peak 977 spectrum 1 weight 0.10000E+01 volume 0.77123E-03 ppm1 4.121 ppm2 1.102 CV 1
ASSI { 978}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 23 and name HD2%)
4.100 2.100 2.100 peak 978 spectrum 1 weight 0.10000E+01 volume 0.19191E-03 ppm1 3.965 ppm2 1.099 CV 1
ASSI { 979}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HG3 ))
2.800 1.000 1.000 peak 979 spectrum 1 weight 0.10000E+01 volume 0.19117E-02 ppm1 4.043 ppm2 1.099 CV 1
ASSI { 980}
(( segid " " and resid 27 and name HD2 ))
( segid " " and resid 23 and name HD1%)
2.900 1.100 1.100 peak 980 spectrum 1 weight 0.10000E+01 volume 0.14676E-02 ppm1 4.115 ppm2 1.199 CV 1
ASSI { 981}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HG2 ))
2.400 2.400 3.600 peak 981 spectrum 1 weight 0.10000E+01 volume 0.48802E-02 ppm1 4.043 ppm2 1.299 CV 1
ASSI { 982}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB2 ))
2.200 0.600 0.600 peak 982 spectrum 1 weight 0.10000E+01 volume 0.76835E-02 ppm1 4.041 ppm2 1.470 CV 1
ASSI { 983}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HG2 ))
2.200 2.200 3.800 peak 983 spectrum 1 weight 0.10000E+01 volume 0.80803E-02 ppm1 4.037 ppm2 1.700 CV 1
ASSI { 984}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 23 and name HG ))
3.000 1.100 1.100 peak 984 spectrum 1 weight 0.10000E+01 volume 0.13568E-02 ppm1 3.962 ppm2 1.650 CV 1
ASSI { 986}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 23 and name HB3 ))
3.800 1.800 1.800 peak 986 spectrum 1 weight 0.10000E+01 volume 0.29767E-03 ppm1 3.962 ppm2 1.979 CV 1
ASSI { 987}
(( segid " " and resid 4 and name HA2 ))
(( segid " " and resid 5 and name HB ))
3.600 1.600 1.600 peak 987 spectrum 1 weight 0.10000E+01 volume 0.45570E-03 ppm1 3.931 ppm2 1.791 CV 1
OR { 987}
(( segid " " and resid 4 and name HA1 ))
(( segid " " and resid 5 and name HB ))
ASSI { 988}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 6 and name HB2 ))
3.300 1.400 1.400 peak 988 spectrum 1 weight 0.10000E+01 volume 0.71939E-03 ppm1 3.791 ppm2 1.535 CV 1
ASSI { 989}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 6 and name HB2 ))
2.700 0.900 0.900 peak 989 spectrum 1 weight 0.10000E+01 volume 0.22698E-02 ppm1 3.600 ppm2 1.538 CV 1
ASSI { 990}
(( segid " " and resid 7 and name HD2 ))
(( segid " " and resid 6 and name HG2 ))
3.700 1.800 1.800 peak 990 spectrum 1 weight 0.10000E+01 volume 0.34113E-03 ppm1 3.726 ppm2 1.330 CV 1
ASSI { 993}
(( segid " " and resid 10 and name HB3 ))
( segid " " and resid 23 and name HD1%)
3.200 1.300 1.300 peak 993 spectrum 1 weight 0.10000E+01 volume 0.86819E-03 ppm1 3.643 ppm2 1.196 CV 1
ASSI { 995}
(( segid " " and resid 7 and name HD3 ))
(( segid " " and resid 6 and name HG2 ))
3.500 1.600 1.600 peak 995 spectrum 1 weight 0.10000E+01 volume 0.47906E-03 ppm1 3.670 ppm2 1.331 CV 1
ASSI { 996}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB2 ))
2.300 0.600 0.600 peak 996 spectrum 1 weight 0.10000E+01 volume 0.70082E-02 ppm1 4.033 ppm2 1.874 CV 1
ASSI { 997}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 6 and name HG3 ))
3.500 1.600 1.600 peak 997 spectrum 1 weight 0.10000E+01 volume 0.47874E-03 ppm1 4.749 ppm2 1.264 CV 1
ASSI { 998}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 8 and name HB3 ))
3.400 1.500 1.500 peak 998 spectrum 1 weight 0.10000E+01 volume 0.56130E-03 ppm1 3.465 ppm2 3.031 CV 1
OR { 998}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 8 and name HB2 ))
ASSI { 1000}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 26 and name HB3 ))
2.700 0.900 0.900 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.24241E-02 ppm1 3.463 ppm2 2.822 CV 1
ASSI { 1001}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 17 and name HB2 ))
3.200 1.300 1.300 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.88419E-03 ppm1 3.458 ppm2 2.858 CV 1
ASSI { 1002}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 17 and name HB2 ))
3.100 1.200 1.200 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.11136E-02 ppm1 3.286 ppm2 2.864 CV 1
ASSI { 1003}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 17 and name HB2 ))
2.300 2.300 3.700 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.65378E-02 ppm1 3.030 ppm2 2.864 CV 1
ASSI { 1004}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 14 and name HB2 ))
3.300 1.300 1.300 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.77539E-03 ppm1 3.398 ppm2 2.705 CV 1
OR { 1004}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 14 and name HB3 ))
ASSI { 1005}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 23 and name HB3 ))
3.000 1.100 1.100 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.13732E-02 ppm1 3.109 ppm2 1.980 CV 1
ASSI { 1006}
(( segid " " and resid 8 and name HB3 ))
(( segid " " and resid 23 and name HB3 ))
2.900 1.100 1.100 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.14311E-02 ppm1 3.029 ppm2 1.980 CV 1
OR { 1006}
(( segid " " and resid 8 and name HB2 ))
(( segid " " and resid 23 and name HB3 ))
ASSI { 1007}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 23 and name HB3 ))
3.300 1.300 1.300 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.78467E-03 ppm1 2.860 ppm2 1.982 CV 1
ASSI { 1014}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 19 and name HG3 ))
3.300 1.400 1.400 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.73315E-03 ppm1 3.288 ppm2 1.385 CV 1
OR { 1014}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 12 and name HB3 ))
ASSI { 1016}
(( segid " " and resid 26 and name HB2 ))
( segid " " and resid 23 and name HD1%)
2.900 2.900 3.100 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.14698E-02 ppm1 3.187 ppm2 1.196 CV 1
ASSI { 1017}
(( segid " " and resid 8 and name HB3 ))
( segid " " and resid 23 and name HD1%)
3.100 1.200 1.200 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.10679E-02 ppm1 3.029 ppm2 1.196 CV 1
OR { 1017}
(( segid " " and resid 8 and name HB2 ))
( segid " " and resid 23 and name HD1%)
ASSI { 1018}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 23 and name HD1%)
2.500 0.800 0.800 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.34753E-02 ppm1 2.829 ppm2 1.198 CV 1
ASSI { 1023}
(( segid " " and resid 29 and name HD2 ))
(( segid " " and resid 29 and name HG3 ))
2.200 0.600 0.600 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.78211E-02 ppm1 2.871 ppm2 1.099 CV 1
OR { 1023}
(( segid " " and resid 29 and name HD3 ))
(( segid " " and resid 29 and name HG3 ))
ASSI { 1024}
(( segid " " and resid 8 and name HB3 ))
( segid " " and resid 23 and name HD2%)
2.100 0.600 0.600 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.97827E-02 ppm1 3.029 ppm2 1.100 CV 1
ASSI { 1025}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 23 and name HD2%)
3.100 1.200 1.200 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.10916E-02 ppm1 3.114 ppm2 1.099 CV 1
ASSI { 1027}
(( segid " " and resid 21 and name HB3 ))
( segid " " and resid 24 and name HB% )
2.700 2.700 3.300 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.22289E-02 ppm1 2.602 ppm2 1.431 CV 1
ASSI { 1028}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 24 and name HB% )
3.600 1.600 1.600 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.41825E-03 ppm1 2.736 ppm2 1.434 CV 1
ASSI { 1029}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 19 and name HB3 ))
3.100 1.200 1.200 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.10884E-02 ppm1 3.276 ppm2 1.049 CV 1
ASSI { 1032}
(( segid " " and resid 29 and name HG2 ))
(( segid " " and resid 29 and name HG3 ))
1.900 0.400 0.400 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.22087E-01 ppm1 1.295 ppm2 1.097 CV 1
ASSI { 1033}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HG3 ))
2.500 0.800 0.800 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.35873E-02 ppm1 1.871 ppm2 1.486 CV 1
ASSI { 1035}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HB2 ))
1.800 0.400 0.400 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.28331E-01 ppm1 2.168 ppm2 2.030 CV 1
ASSI { 1040}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 27 and name HN ))
6.000 4.500 0.300 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.499 ppm2 8.528 CV 1
ASSI { 1045}
(( segid " " and resid 3 and name HB ))
(( segid " " and resid 3 and name HN ))
3.200 1.300 1.300 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.86755E-03 ppm1 4.259 ppm2 8.422 CV 1
ASSI { 1046}
(( segid " " and resid 3 and name HB ))
( segid " " and resid 3 and name HG2%)
2.400 0.700 0.700 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.48674E-02 ppm1 4.262 ppm2 1.201 CV 1
ASSI { 1047}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB3 ))
2.500 0.800 0.800 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.37057E-02 ppm1 4.033 ppm2 1.829 CV 1
ASSI { 1048}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 26 and name HD2 ))
3.700 1.700 1.700 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.39009E-03 ppm1 1.094 ppm2 7.232 CV 1
ASSI { 1049}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 26 and name HD2 ))
2.300 0.600 0.600 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.69026E-02 ppm1 1.196 ppm2 7.230 CV 1
ASSI { 1050}
(( segid " " and resid 23 and name HG ))
(( segid " " and resid 26 and name HD2 ))
3.900 1.900 1.900 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.25691E-03 ppm1 1.635 ppm2 7.231 CV 1
ASSI { 1051}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 26 and name HD2 ))
3.800 1.800 1.800 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.31121E-03 ppm1 2.182 ppm2 7.233 CV 1
ASSI { 1052}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 28 and name HN ))
3.300 1.400 1.400 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.74115E-03 ppm1 2.179 ppm2 7.253 CV 1
ASSI { 1053}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 26 and name HD2 ))
2.600 2.600 3.400 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.32929E-02 ppm1 2.632 ppm2 7.230 CV 1
ASSI { 1054}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 26 and name HD2 ))
3.000 1.100 1.100 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.12669E-02 ppm1 2.722 ppm2 7.231 CV 1
ASSI { 1055}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 26 and name HD2 ))
2.300 0.700 0.700 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.62946E-02 ppm1 2.827 ppm2 7.230 CV 1
ASSI { 1056}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HD2 ))
2.500 2.500 3.500 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.35041E-02 ppm1 3.187 ppm2 7.231 CV 1
ASSI { 1059}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 26 and name HD2 ))
3.300 1.300 1.300 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.77635E-03 ppm1 3.462 ppm2 7.230 CV 1
ASSI { 1060}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 26 and name HD2 ))
2.800 1.000 1.000 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.19994E-02 ppm1 3.644 ppm2 7.230 CV 1
ASSI { 1061}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 26 and name HD2 ))
2.700 2.700 3.300 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.26039E-02 ppm1 3.777 ppm2 7.229 CV 1
ASSI { 1062}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HD2 ))
3.600 1.600 1.600 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.45474E-03 ppm1 4.032 ppm2 7.230 CV 1
ASSI { 1063}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 26 and name HN ))
4.200 2.200 2.100 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.17178E-03 ppm1 3.774 ppm2 7.497 CV 1
ASSI { 1066}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 26 and name HD2 ))
3.200 1.300 1.300 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.93507E-03 ppm1 4.791 ppm2 7.229 CV 1
ASSI { 1067}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 26 and name HD2 ))
3.600 1.700 1.700 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.40705E-03 ppm1 4.323 ppm2 7.230 CV 1
OR { 1067}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 26 and name HD2 ))
ASSI { 1069}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 30 and name HD2 ))
3.100 1.200 1.200 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.11210E-02 ppm1 2.184 ppm2 6.794 CV 1
ASSI { 1071}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 26 and name HN ))
4.100 2.100 2.100 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.20913E-03 ppm1 2.187 ppm2 7.502 CV 1
ASSI { 1074}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HE ))
2.700 0.900 0.900 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.26948E-02 ppm1 2.184 ppm2 8.077 CV 1
ASSI { 1075}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 27 and name HE ))
3.700 1.700 1.700 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.36737E-03 ppm1 2.068 ppm2 8.077 CV 1
ASSI { 1079}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 27 and name HE ))
3.100 1.200 1.200 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.11335E-02 ppm1 4.327 ppm2 8.075 CV 1
ASSI { 1081}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 27 and name HE ))
4.000 2.000 2.000 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.22919E-03 ppm1 4.792 ppm2 8.078 CV 1
ASSI { 1087}
( segid " " and resid 17 and name HE% )
(( segid " " and resid 15 and name HZ3 ))
2.400 2.400 3.600 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.52290E-02 ppm1 6.959 ppm2 7.228 CV 1
ASSI { 1088}
(( segid " " and resid 17 and name HZ ))
(( segid " " and resid 26 and name HD2 ))
2.600 2.600 3.400 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.27246E-02 ppm1 6.457 ppm2 7.230 CV 1
ASSI { 1089}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 15 and name HD1 ))
3.400 1.500 1.500 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.57218E-03 ppm1 7.234 ppm2 7.782 CV 1
ASSI { 1090}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 29 and name HN ))
2.500 0.800 0.800 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.42497E-02 ppm1 7.246 ppm2 7.663 CV 1
ASSI { 1100}
(( segid " " and resid 27 and name HB2 ))
( segid " " and resid 23 and name HD2%)
4.000 2.000 2.000 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.22890E-03 ppm1 2.174 ppm2 1.107 CV 1
OR { 1100}
(( segid " " and resid 9 and name HG3 ))
( segid " " and resid 23 and name HD2%)
OR { 1100}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 29 and name HG3 ))
ASSI { 1101}
(( segid " " and resid 27 and name HB2 ))
( segid " " and resid 23 and name HD1%)
3.600 1.600 1.600 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.42690E-03 ppm1 2.175 ppm2 1.207 CV 1
ASSI { 1113}
(( segid " " and resid 27 and name HD3 ))
( segid " " and resid 24 and name HB% )
4.100 2.100 2.100 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.20516E-03 ppm1 3.312 ppm2 1.439 CV 1
ASSI { 1119}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 27 and name HD3 ))
3.200 1.300 1.300 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.91715E-03 ppm1 4.788 ppm2 3.323 CV 1
ASSI { 1120}
(( segid " " and resid 11 and name HD2 ))
(( segid " " and resid 27 and name HD3 ))
2.700 0.900 0.900 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.22612E-02 ppm1 4.334 ppm2 3.319 CV 1
OR { 1120}
(( segid " " and resid 11 and name HD3 ))
(( segid " " and resid 27 and name HD3 ))
ASSI { 1124}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 27 and name HN ))
4.800 2.900 1.500 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.77347E-04 ppm1 1.099 ppm2 8.532 CV 1
ASSI { 1125}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 27 and name HN ))
3.300 1.300 1.300 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.75843E-03 ppm1 1.198 ppm2 8.528 CV 1
ASSI { 1127}
(( segid " " and resid 23 and name HG ))
(( segid " " and resid 27 and name HN ))
3.400 1.500 1.500 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.57538E-03 ppm1 1.646 ppm2 8.528 CV 1
ASSI { 1128}
( segid " " and resid 24 and name HB% )
(( segid " " and resid 27 and name HN ))
3.700 1.700 1.700 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.36577E-03 ppm1 1.438 ppm2 8.529 CV 1
ASSI { 1129}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 27 and name HN ))
2.400 2.400 3.600 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.53506E-02 ppm1 1.877 ppm2 8.530 CV 1
ASSI { 1130}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HN ))
2.600 0.800 0.800 peak 1130 spectrum 1 weight 0.10000E+01 volume 0.33441E-02 ppm1 2.188 ppm2 8.529 CV 1
ASSI { 1131}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 27 and name HN ))
2.800 1.000 1.000 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.19578E-02 ppm1 2.350 ppm2 8.529 CV 1
ASSI { 1132}
(( segid " " and resid 27 and name HG3 ))
(( segid " " and resid 27 and name HN ))
2.800 1.000 1.000 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.19508E-02 ppm1 2.299 ppm2 8.531 CV 1
ASSI { 1133}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 27 and name HE ))
2.900 1.100 1.100 peak 1133 spectrum 1 weight 0.10000E+01 volume 0.15418E-02 ppm1 1.883 ppm2 8.076 CV 1
ASSI { 1134}
(( segid " " and resid 23 and name HG ))
(( segid " " and resid 27 and name HE ))
4.800 2.800 1.500 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.81283E-04 ppm1 1.637 ppm2 8.073 CV 1
ASSI { 1135}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 27 and name HE ))
2.800 1.000 1.000 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.19217E-02 ppm1 2.346 ppm2 8.076 CV 1
ASSI { 1136}
(( segid " " and resid 27 and name HG3 ))
(( segid " " and resid 27 and name HE ))
2.700 2.700 3.300 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.25082E-02 ppm1 2.300 ppm2 8.076 CV 1
ASSI { 1138}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 27 and name HN ))
3.400 1.400 1.400 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.60674E-03 ppm1 3.462 ppm2 8.529 CV 1
ASSI { 1139}
(( segid " " and resid 27 and name HD3 ))
(( segid " " and resid 27 and name HN ))
2.900 2.900 3.100 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.14650E-02 ppm1 3.316 ppm2 8.528 CV 1
ASSI { 1140}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HN ))
2.500 2.500 3.500 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.36001E-02 ppm1 3.187 ppm2 8.529 CV 1
ASSI { 1141}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HN ))
2.500 0.800 0.800 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.36577E-02 ppm1 3.777 ppm2 8.528 CV 1
ASSI { 1142}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HE ))
3.300 1.400 1.400 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.68258E-03 ppm1 3.780 ppm2 8.076 CV 1
ASSI { 1143}
(( segid " " and resid 27 and name HD3 ))
(( segid " " and resid 27 and name HE ))
2.300 0.700 0.700 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.60450E-02 ppm1 3.313 ppm2 8.077 CV 1
ASSI { 1144}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 27 and name HN ))
3.800 1.800 1.800 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.32385E-03 ppm1 7.667 ppm2 8.529 CV 1
ASSI { 1145}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 27 and name HN ))
4.300 2.300 2.000 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.15357E-03 ppm1 7.406 ppm2 8.532 CV 1
ASSI { 1146}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HN ))
2.300 0.700 0.700 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.63074E-02 ppm1 7.247 ppm2 8.529 CV 1
ASSI { 1148}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 27 and name HN ))
3.700 1.700 1.700 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.36065E-03 ppm1 6.783 ppm2 8.529 CV 1
ASSI { 1149}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 27 and name HE ))
3.500 1.500 1.500 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.54690E-03 ppm1 7.231 ppm2 8.077 CV 1
ASSI { 1150}
(( segid " " and resid 27 and name HE ))
(( segid " " and resid 27 and name HN ))
3.200 3.200 2.800 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.95523E-03 ppm1 8.080 ppm2 8.538 CV 1
ASSI { 1151}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 26 and name HN ))
3.200 3.200 2.800 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.82787E-03 ppm1 1.875 ppm2 7.502 CV 1
ASSI { 1152}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 30 and name HD2 ))
3.200 1.300 1.300 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.88899E-03 ppm1 1.879 ppm2 6.794 CV 1
ASSI { 1154}
(( segid " " and resid 27 and name HD3 ))
(( segid " " and resid 26 and name HD2 ))
2.900 2.900 3.100 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.16125E-02 ppm1 3.316 ppm2 7.232 CV 1
ASSI { 1156}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 30 and name HN ))
3.200 1.300 1.300 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.88195E-03 ppm1 3.775 ppm2 7.393 CV 1
ASSI { 1157}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HN ))
3.200 1.300 1.300 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.92643E-03 ppm1 3.779 ppm2 7.257 CV 1
ASSI { 1158}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 30 and name HD2 ))
2.100 0.600 0.600 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.10432E-01 ppm1 3.779 ppm2 6.794 CV 1
ASSI { 1159}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 29 and name HN ))
3.300 1.300 1.300 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.76227E-03 ppm1 3.778 ppm2 7.662 CV 1
ASSI { 1160}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HB3 ))
1.900 0.400 0.400 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.21444E-01 ppm1 2.183 ppm2 1.876 CV 1
ASSI { 1161}
(( segid " " and resid 27 and name HG3 ))
(( segid " " and resid 27 and name HB3 ))
2.600 0.800 0.800 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.32001E-02 ppm1 2.305 ppm2 1.874 CV 1
ASSI { 1162}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 27 and name HB3 ))
2.600 0.800 0.800 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.33537E-02 ppm1 2.352 ppm2 1.874 CV 1
ASSI { 1163}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 23 and name HG ))
3.000 1.100 1.100 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.13607E-02 ppm1 2.348 ppm2 1.644 CV 1
ASSI { 1165}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 27 and name HB2 ))
2.200 2.200 3.800 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.78691E-02 ppm1 2.351 ppm2 2.184 CV 1
ASSI { 1166}
(( segid " " and resid 27 and name HG2 ))
( segid " " and resid 23 and name HD2%)
3.300 1.400 1.400 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.72835E-03 ppm1 2.346 ppm2 1.101 CV 1
ASSI { 1167}
(( segid " " and resid 27 and name HG2 ))
( segid " " and resid 23 and name HD1%)
3.400 1.400 1.400 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.63106E-03 ppm1 2.346 ppm2 1.200 CV 1
ASSI { 1168}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 27 and name HB2 ))
3.300 1.400 1.400 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.67778E-03 ppm1 3.969 ppm2 2.187 CV 1
ASSI { 1169}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 27 and name HG3 ))
3.400 1.500 1.500 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.57218E-03 ppm1 3.966 ppm2 2.299 CV 1
ASSI { 1170}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 27 and name HG2 ))
3.500 1.500 1.500 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.55330E-03 ppm1 3.966 ppm2 2.351 CV 1
ASSI { 1171}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HG2 ))
2.700 0.900 0.900 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.23793E-02 ppm1 3.778 ppm2 2.349 CV 1
ASSI { 1172}
(( segid " " and resid 27 and name HD3 ))
(( segid " " and resid 27 and name HG2 ))
2.300 0.600 0.600 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.67074E-02 ppm1 3.318 ppm2 2.348 CV 1
ASSI { 1173}
(( segid " " and resid 27 and name HD3 ))
(( segid " " and resid 27 and name HG3 ))
2.400 0.700 0.700 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.48482E-02 ppm1 3.319 ppm2 2.300 CV 1
ASSI { 1174}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HG3 ))
2.800 1.000 1.000 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.18596E-02 ppm1 3.778 ppm2 2.301 CV 1
ASSI { 1175}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB2 ))
2.400 0.700 0.700 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.52450E-02 ppm1 3.783 ppm2 2.186 CV 1
ASSI { 1176}
(( segid " " and resid 27 and name HD3 ))
(( segid " " and resid 27 and name HB2 ))
2.400 2.400 3.600 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.48258E-02 ppm1 3.320 ppm2 2.186 CV 1
ASSI { 1177}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB3 ))
2.700 0.900 0.900 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.23844E-02 ppm1 3.788 ppm2 1.875 CV 1
ASSI { 1178}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 27 and name HB3 ))
3.200 3.200 2.800 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.91459E-03 ppm1 3.967 ppm2 1.879 CV 1
ASSI { 1179}
(( segid " " and resid 27 and name HD3 ))
(( segid " " and resid 23 and name HG ))
2.400 0.700 0.700 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.47458E-02 ppm1 3.318 ppm2 1.648 CV 1
ASSI { 1180}
(( segid " " and resid 27 and name HD3 ))
(( segid " " and resid 27 and name HB3 ))
2.400 0.700 0.700 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.49954E-02 ppm1 3.318 ppm2 1.877 CV 1
ASSI { 1181}
(( segid " " and resid 27 and name HD3 ))
( segid " " and resid 23 and name HD1%)
2.500 0.800 0.800 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.43170E-02 ppm1 3.318 ppm2 1.195 CV 1
ASSI { 1183}
(( segid " " and resid 27 and name HD3 ))
( segid " " and resid 23 and name HD2%)
2.700 0.900 0.900 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.25031E-02 ppm1 3.320 ppm2 1.098 CV 1
ASSI { 1184}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 30 and name HB3 ))
3.800 1.800 1.800 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.29534E-03 ppm1 3.779 ppm2 3.159 CV 1
ASSI { 1185}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HD3 ))
2.900 2.900 3.100 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.15805E-02 ppm1 3.781 ppm2 3.318 CV 1
ASSI { 1186}
(( segid " " and resid 27 and name HG3 ))
(( segid " " and resid 30 and name HD2 ))
3.000 1.100 1.100 peak 1186 spectrum 1 weight 0.10000E+01 volume 0.13850E-02 ppm1 2.298 ppm2 6.795 CV 1
ASSI { 1187}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 30 and name HD2 ))
3.000 1.100 1.100 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.13668E-02 ppm1 2.347 ppm2 6.794 CV 1
ASSI { 1188}
(( segid " " and resid 27 and name HG3 ))
(( segid " " and resid 26 and name HD2 ))
3.000 1.100 1.100 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.13341E-02 ppm1 2.301 ppm2 7.230 CV 1
ASSI { 1189}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 26 and name HD2 ))
2.800 1.000 1.000 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.20020E-02 ppm1 2.352 ppm2 7.230 CV 1
ASSI { 1190}
(( segid " " and resid 27 and name HG3 ))
(( segid " " and resid 28 and name HN ))
4.800 2.800 1.500 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.80099E-04 ppm1 2.301 ppm2 7.255 CV 1
ASSI { 1191}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 28 and name HN ))
4.500 2.500 1.800 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.11975E-03 ppm1 2.352 ppm2 7.254 CV 1
ASSI { 1193}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 26 and name HD2 ))
4.700 2.700 1.600 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.89475E-04 ppm1 1.454 ppm2 7.231 CV 1
ASSI { 1194}
(( segid " " and resid 27 and name HG3 ))
(( segid " " and resid 26 and name HN ))
4.300 2.300 2.000 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.14202E-03 ppm1 2.302 ppm2 7.499 CV 1
ASSI { 1195}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 26 and name HN ))
4.300 2.300 2.000 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.14148E-03 ppm1 2.349 ppm2 7.499 CV 1
ASSI { 1196}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HN ))
2.300 0.700 0.700 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.59746E-02 ppm1 4.025 ppm2 7.501 CV 1
OR { 1196}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HN ))
ASSI { 1197}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 27 and name HD2 ))
3.000 1.100 1.100 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.12218E-02 ppm1 4.795 ppm2 4.121 CV 1
ASSI { 1198}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 5 and name HD1%)
3.800 1.800 1.800 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.33345E-03 ppm1 4.614 ppm2 1.420 CV 1
ASSI { 1200}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 27 and name HD3 ))
3.000 3.000 3.000 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.13021E-02 ppm1 3.971 ppm2 3.320 CV 1
ASSI { 1202}
(( segid " " and resid 29 and name HD3 ))
(( segid " " and resid 29 and name HG2 ))
2.600 0.800 0.800 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.30609E-02 ppm1 2.873 ppm2 1.299 CV 1
OR { 1202}
(( segid " " and resid 29 and name HD2 ))
(( segid " " and resid 29 and name HG2 ))
ASSI { 1203}
(( segid " " and resid 9 and name HB2 ))
( segid " " and resid 23 and name HD2%)
3.500 1.500 1.500 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.53922E-03 ppm1 2.084 ppm2 1.106 CV 1
OR { 1203}
(( segid " " and resid 9 and name HB3 ))
( segid " " and resid 23 and name HD2%)
OR { 1203}
(( segid " " and resid 11 and name HG2 ))
( segid " " and resid 23 and name HD2%)
ASSI { 1204}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 5 and name HG13))
2.500 0.800 0.800 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.41249E-02 ppm1 1.423 ppm2 0.832 CV 1
ASSI { 1205}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 5 and name HG13))
2.900 1.100 1.100 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.15050E-02 ppm1 1.785 ppm2 0.832 CV 1
ASSI { 1206}
(( segid " " and resid 5 and name HG12))
(( segid " " and resid 5 and name HG13))
2.600 0.800 0.800 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.33185E-02 ppm1 1.139 ppm2 0.832 CV 1
ASSI { 1207}
(( segid " " and resid 5 and name HG13))
(( segid " " and resid 6 and name HN ))
3.600 1.600 1.600 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.43394E-03 ppm1 0.834 ppm2 8.506 CV 1
ASSI { 1208}
(( segid " " and resid 5 and name HG13))
(( segid " " and resid 5 and name HN ))
3.600 1.600 1.600 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.43170E-03 ppm1 0.833 ppm2 8.087 CV 1
ASSI { 1210}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HD3 ))
4.200 2.200 2.100 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.16637E-03 ppm1 4.496 ppm2 1.477 CV 1
ASSI { 1211}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 17 and name HD% )
3.800 1.800 1.800 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.30279E-03 ppm1 4.329 ppm2 7.452 CV 1
ASSI { 1212}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 17 and name HE% )
4.000 2.000 2.000 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.23918E-03 ppm1 4.324 ppm2 6.958 CV 1
OR { 1212}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 17 and name HE% )
ASSI { 1213}
(( segid " " and resid 9 and name HG2 ))
(( segid " " and resid 9 and name HG3 ))
1.900 0.500 0.500 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.17921E-01 ppm1 2.319 ppm2 2.184 CV 1
ASSI { 1215}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 10 and name HB3 ))
4.600 2.700 1.700 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.97699E-04 ppm1 4.108 ppm2 3.658 CV 1
ASSI { 1216}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 10 and name HB3 ))
4.400 2.400 1.900 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.12746E-03 ppm1 5.167 ppm2 3.659 CV 1
ASSI { 1217}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HE3 ))
4.100 2.100 2.100 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.18804E-03 ppm1 4.111 ppm2 7.445 CV 1
ASSI { 1218}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 17 and name HN ))
4.000 2.000 2.000 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.22590E-03 ppm1 7.712 ppm2 8.664 CV 1
ASSI { 1219}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 22 and name HB3 ))
4.100 2.100 2.100 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.21278E-03 ppm1 3.747 ppm2 3.118 CV 1
ASSI { 1221}
( segid " " and resid 23 and name HD1%)
(( segid " " and resid 27 and name HE ))
4.500 2.500 1.800 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.11076E-03 ppm1 1.202 ppm2 8.076 CV 1
OR { 1221}
( segid " " and resid 3 and name HG2%)
(( segid " " and resid 5 and name HN ))
ASSI { 1222}
(( segid " " and resid 29 and name HG3 ))
(( segid " " and resid 27 and name HE ))
5.700 4.000 0.600 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.28545E-04 ppm1 1.098 ppm2 8.077 CV 1
OR { 1222}
( segid " " and resid 23 and name HD2%)
(( segid " " and resid 27 and name HE ))
ASSI { 1224}
( segid " " and resid 25 and name HD1%)
(( segid " " and resid 28 and name HN ))
5.200 3.300 1.100 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.49986E-04 ppm1 0.849 ppm2 7.252 CV 1
OR { 1224}
( segid " " and resid 25 and name HD2%)
(( segid " " and resid 28 and name HN ))
ASSI { 1225}
( segid " " and resid 25 and name HD2%)
(( segid " " and resid 25 and name HN ))
2.600 0.900 0.900 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.29767E-02 ppm1 0.852 ppm2 7.502 CV 1
OR { 1225}
( segid " " and resid 25 and name HD1%)
(( segid " " and resid 25 and name HN ))
OR { 1225}
( segid " " and resid 25 and name HD1%)
(( segid " " and resid 26 and name HN ))
ASSI { 1226}
( segid " " and resid 25 and name HD2%)
(( segid " " and resid 22 and name HN ))
4.500 2.600 1.800 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.10618E-03 ppm1 0.852 ppm2 7.319 CV 1
OR { 1226}
( segid " " and resid 25 and name HD1%)
(( segid " " and resid 22 and name HN ))
ASSI { 1227}
( segid " " and resid 25 and name HD2%)
(( segid " " and resid 22 and name HD2 ))
2.700 0.900 0.900 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.22321E-02 ppm1 0.852 ppm2 6.837 CV 1
OR { 1227}
( segid " " and resid 25 and name HD1%)
(( segid " " and resid 22 and name HD2 ))
ASSI { 1228}
(( segid " " and resid 25 and name HG ))
( segid " " and resid 25 and name HD2%)
2.600 0.900 0.900 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.28679E-02 ppm1 1.647 ppm2 0.849 CV 1
OR { 1228}
(( segid " " and resid 25 and name HG ))
( segid " " and resid 25 and name HD1%)
Contact the webmaster for help, if required. Saturday, May 11, 2024 4:09:13 AM GMT (wattos1)