NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
22111 |
2jm3   |
cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
#Unambiguous NOEs for CtBP THAP domain
ASSI { 1}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 62 and name HD2 ))
2.700 0.900 0.900 peak 1 spectrum 1 weight 0.10000E+01 volume 0.14802E-02 ppm1 10.741 ppm2 7.965 CV 1
ASSI { 2}
(( segid " " and resid 59 and name HN ))
( segid " " and resid 9 and name HE% )
4.500 2.500 1.500 peak 2 spectrum 1 weight 0.10000E+01 volume 0.53710E-03 ppm1 10.740 ppm2 6.900 CV 1
ASSI { 3}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 58 and name HA ))
2.300 0.700 0.700 peak 3 spectrum 1 weight 0.10000E+01 volume 0.43701E-02 ppm1 10.741 ppm2 5.366 CV 1
ASSI { 4}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 59 and name HA ))
3.000 1.100 1.100 peak 4 spectrum 1 weight 0.10000E+01 volume 0.11644E-02 ppm1 10.741 ppm2 4.944 CV 1
ASSI { 5}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 27 and name HA ))
3.900 1.900 1.900 peak 5 spectrum 1 weight 0.10000E+01 volume 0.67242E-03 ppm1 10.741 ppm2 4.633 CV 1
ASSI { 6}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 7 and name HB2 ))
3.400 3.400 2.600 peak 6 spectrum 1 weight 0.10000E+01 volume 0.46520E-03 ppm1 10.741 ppm2 3.410 CV 1
ASSI { 7}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 62 and name HB2 ))
3.900 1.900 1.900 peak 7 spectrum 1 weight 0.10000E+01 volume 0.10643E-02 ppm1 10.741 ppm2 3.125 CV 1
ASSI { 8}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 59 and name HB2 ))
2.900 1.000 1.000 peak 8 spectrum 1 weight 0.10000E+01 volume 0.21146E-02 ppm1 10.742 ppm2 2.853 CV 1
ASSI { 9}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 59 and name HB3 ))
3.600 1.700 1.700 peak 9 spectrum 1 weight 0.10000E+01 volume 0.15084E-02 ppm1 10.741 ppm2 2.540 CV 1
ASSI { 10}
(( segid " " and resid 59 and name HN ))
( segid " " and resid 58 and name HG2%)
3.000 1.100 1.100 peak 10 spectrum 1 weight 0.10000E+01 volume 0.14661E-02 ppm1 10.741 ppm2 1.257 CV 1
ASSI { 11}
(( segid " " and resid 59 and name HN ))
( segid " " and resid 58 and name HD1%)
4.300 2.300 1.700 peak 11 spectrum 1 weight 0.10000E+01 volume 0.78805E-03 ppm1 10.740 ppm2 1.059 CV 1
ASSI { 12}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 41 and name HD1 ))
2.600 0.900 0.900 peak 12 spectrum 1 weight 0.10000E+01 volume 0.35665E-02 ppm1 10.351 ppm2 7.618 CV 1
ASSI { 13}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 41 and name HZ2 ))
2.900 1.000 1.000 peak 13 spectrum 1 weight 0.10000E+01 volume 0.18185E-02 ppm1 10.351 ppm2 7.456 CV 1
ASSI { 14}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 73 and name HA ))
2.700 0.900 0.900 peak 14 spectrum 1 weight 0.10000E+01 volume 0.25374E-02 ppm1 10.352 ppm2 4.074 CV 1
ASSI { 15}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 74 and name HD2 ))
3.900 1.900 1.900 peak 15 spectrum 1 weight 0.10000E+01 volume 0.63578E-03 ppm1 10.350 ppm2 2.404 CV 1
ASSI { 16}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 73 and name HG12))
4.100 2.100 1.900 peak 16 spectrum 1 weight 0.10000E+01 volume 0.67664E-03 ppm1 10.354 ppm2 1.564 CV 1
ASSI { 18}
(( segid " " and resid 41 and name HE1 ))
( segid " " and resid 37 and name HD1%)
2.700 0.900 0.900 peak 18 spectrum 1 weight 0.10000E+01 volume 0.29040E-02 ppm1 10.352 ppm2 1.149 CV 1
ASSI { 19}
(( segid " " and resid 41 and name HE1 ))
( segid " " and resid 37 and name HD2%)
2.700 0.900 0.900 peak 19 spectrum 1 weight 0.10000E+01 volume 0.46379E-02 ppm1 10.351 ppm2 1.015 CV 1
ASSI { 20}
(( segid " " and resid 41 and name HE1 ))
( segid " " and resid 73 and name HD1%)
3.500 1.500 1.500 peak 20 spectrum 1 weight 0.10000E+01 volume 0.15930E-02 ppm1 10.352 ppm2 0.871 CV 1
ASSI { 22}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 9 and name HD% )
3.800 1.800 1.800 peak 22 spectrum 1 weight 0.10000E+01 volume 0.82183E-03 ppm1 10.077 ppm2 6.655 CV 1
ASSI { 23}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 58 and name HA ))
3.900 1.900 1.900 peak 23 spectrum 1 weight 0.10000E+01 volume 0.48917E-03 ppm1 10.077 ppm2 5.373 CV 1
ASSI { 24}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 7 and name HA ))
3.500 1.500 1.500 peak 24 spectrum 1 weight 0.10000E+01 volume 0.14238E-02 ppm1 10.078 ppm2 4.604 CV 1
ASSI { 25}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HA ))
2.900 1.000 1.000 peak 25 spectrum 1 weight 0.10000E+01 volume 0.16634E-02 ppm1 10.078 ppm2 4.058 CV 1
ASSI { 27}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 7 and name HB2 ))
4.000 2.000 2.000 peak 27 spectrum 1 weight 0.10000E+01 volume 0.74010E-03 ppm1 10.077 ppm2 3.399 CV 1
ASSI { 28}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HB2 ))
2.400 0.700 0.700 peak 28 spectrum 1 weight 0.10000E+01 volume 0.34820E-02 ppm1 10.078 ppm2 3.165 CV 1
ASSI { 29}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 9 and name HB3 ))
3.300 1.400 1.400 peak 29 spectrum 1 weight 0.10000E+01 volume 0.33692E-02 ppm1 10.078 ppm2 2.405 CV 1
ASSI { 30}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 10 and name HD3 ))
4.200 2.300 1.800 peak 30 spectrum 1 weight 0.10000E+01 volume 0.79227E-03 ppm1 10.077 ppm2 1.845 CV 1
ASSI { 31}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 58 and name HG2%)
3.800 1.800 1.800 peak 31 spectrum 1 weight 0.10000E+01 volume 0.71892E-03 ppm1 10.077 ppm2 1.250 CV 1
ASSI { 32}
(( segid " " and resid 9 and name HN ))
( segid " " and resid 58 and name HD1%)
3.200 1.200 1.200 peak 32 spectrum 1 weight 0.10000E+01 volume 0.15648E-02 ppm1 10.078 ppm2 1.048 CV 1
ASSI { 33}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HN ))
3.500 1.500 1.500 peak 33 spectrum 1 weight 0.10000E+01 volume 0.10841E-02 ppm1 9.433 ppm2 8.990 CV 1
ASSI { 35}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HN ))
4.100 2.100 1.900 peak 35 spectrum 1 weight 0.10000E+01 volume 0.66536E-03 ppm1 9.420 ppm2 7.040 CV 1
ASSI { 36}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HA ))
2.300 0.700 0.700 peak 36 spectrum 1 weight 0.10000E+01 volume 0.61745E-02 ppm1 9.421 ppm2 5.029 CV 1
ASSI { 37}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HA ))
2.800 1.000 1.000 peak 37 spectrum 1 weight 0.10000E+01 volume 0.26502E-02 ppm1 9.421 ppm2 3.931 CV 1
ASSI { 38}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HB2 ))
3.800 1.800 1.800 peak 38 spectrum 1 weight 0.10000E+01 volume 0.13646E-02 ppm1 9.421 ppm2 2.955 CV 1
ASSI { 39}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HB3 ))
2.700 0.900 0.900 peak 39 spectrum 1 weight 0.10000E+01 volume 0.18749E-02 ppm1 9.419 ppm2 2.407 CV 1
ASSI { 40}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HB3 ))
2.300 0.700 0.700 peak 40 spectrum 1 weight 0.10000E+01 volume 0.70626E-02 ppm1 9.421 ppm2 2.160 CV 1
OR { 40}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HB2 ))
ASSI { 41}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 78 and name HG3 ))
3.800 1.800 1.800 peak 41 spectrum 1 weight 0.10000E+01 volume 0.49622E-03 ppm1 9.422 ppm2 1.506 CV 1
ASSI { 43}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HN ))
3.500 1.500 1.500 peak 43 spectrum 1 weight 0.10000E+01 volume 0.15789E-02 ppm1 9.288 ppm2 7.244 CV 1
ASSI { 44}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HA ))
2.200 0.600 0.600 peak 44 spectrum 1 weight 0.10000E+01 volume 0.75560E-02 ppm1 9.289 ppm2 3.862 CV 1
ASSI { 45}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 72 and name HB2 ))
2.900 1.000 1.000 peak 45 spectrum 1 weight 0.10000E+01 volume 0.16353E-02 ppm1 9.290 ppm2 2.945 CV 1
ASSI { 46}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 72 and name HB3 ))
4.400 2.400 1.600 peak 46 spectrum 1 weight 0.10000E+01 volume 0.75276E-03 ppm1 9.289 ppm2 2.809 CV 1
ASSI { 47}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HB2 ))
2.500 0.800 0.800 peak 47 spectrum 1 weight 0.10000E+01 volume 0.41727E-02 ppm1 9.289 ppm2 1.878 CV 1
OR { 47}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HB3 ))
ASSI { 48}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HD3 ))
4.600 2.700 1.400 peak 48 spectrum 1 weight 0.10000E+01 volume 0.34256E-03 ppm1 9.287 ppm2 1.698 CV 1
OR { 48}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HD2 ))
ASSI { 49}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HG2 ))
3.200 1.300 1.300 peak 49 spectrum 1 weight 0.10000E+01 volume 0.21851E-02 ppm1 9.290 ppm2 1.517 CV 1
ASSI { 50}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HG2 ))
3.200 1.300 1.300 peak 50 spectrum 1 weight 0.10000E+01 volume 0.15366E-02 ppm1 9.289 ppm2 0.713 CV 1
ASSI { 52}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 62 and name HE1 ))
3.700 1.700 1.700 peak 52 spectrum 1 weight 0.10000E+01 volume 0.10065E-02 ppm1 8.930 ppm2 8.193 CV 1
ASSI { 54}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 14 and name HD% )
3.700 1.700 1.700 peak 54 spectrum 1 weight 0.10000E+01 volume 0.64423E-03 ppm1 8.930 ppm2 7.107 CV 1
ASSI { 55}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HA ))
2.200 0.600 0.600 peak 55 spectrum 1 weight 0.10000E+01 volume 0.77394E-02 ppm1 8.931 ppm2 4.379 CV 1
ASSI { 56}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HB2 ))
4.500 2.500 1.500 peak 56 spectrum 1 weight 0.10000E+01 volume 0.61322E-03 ppm1 8.931 ppm2 3.615 CV 1
ASSI { 58}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HB2 ))
3.100 1.200 1.200 peak 58 spectrum 1 weight 0.10000E+01 volume 0.42996E-02 ppm1 8.929 ppm2 1.485 CV 1
ASSI { 60}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HG2 ))
2.800 1.000 1.000 peak 60 spectrum 1 weight 0.10000E+01 volume 0.16776E-02 ppm1 8.931 ppm2 1.107 CV 1
ASSI { 61}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HG3 ))
3.300 1.400 1.400 peak 61 spectrum 1 weight 0.10000E+01 volume 0.11475E-02 ppm1 8.932 ppm2 0.747 CV 1
ASSI { 62}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HA ))
2.600 0.900 0.900 peak 62 spectrum 1 weight 0.10000E+01 volume 0.31578E-02 ppm1 9.091 ppm2 4.480 CV 1
ASSI { 63}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 32 and name HA ))
3.500 3.500 2.500 peak 63 spectrum 1 weight 0.10000E+01 volume 0.11024E-02 ppm1 9.090 ppm2 4.116 CV 1
ASSI { 64}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HB2 ))
2.900 1.100 1.100 peak 64 spectrum 1 weight 0.10000E+01 volume 0.16353E-02 ppm1 9.091 ppm2 3.409 CV 1
ASSI { 65}
(( segid " " and resid 7 and name HN ))
( segid " " and resid 6 and name HG2%)
4.100 2.100 1.900 peak 65 spectrum 1 weight 0.10000E+01 volume 0.59912E-03 ppm1 9.090 ppm2 1.166 CV 1
ASSI { 66}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 8 and name HN ))
3.100 1.200 1.200 peak 66 spectrum 1 weight 0.10000E+01 volume 0.12010E-02 ppm1 9.111 ppm2 9.902 CV 1
ASSI { 67}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HA ))
2.900 1.100 1.100 peak 67 spectrum 1 weight 0.10000E+01 volume 0.16917E-02 ppm1 9.117 ppm2 5.348 CV 1
ASSI { 68}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HA ))
2.100 0.500 0.500 peak 68 spectrum 1 weight 0.10000E+01 volume 0.11109E-01 ppm1 9.116 ppm2 4.310 CV 1
ASSI { 69}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HB2 ))
2.800 0.900 0.900 peak 69 spectrum 1 weight 0.10000E+01 volume 0.17904E-02 ppm1 9.115 ppm2 1.935 CV 1
ASSI { 70}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HG2 ))
3.000 3.000 3.000 peak 70 spectrum 1 weight 0.10000E+01 volume 0.22837E-02 ppm1 9.116 ppm2 1.766 CV 1
ASSI { 71}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HB3 ))
3.200 1.200 1.200 peak 71 spectrum 1 weight 0.10000E+01 volume 0.27771E-02 ppm1 9.115 ppm2 1.701 CV 1
ASSI { 73}
(( segid " " and resid 57 and name HN ))
( segid " " and resid 58 and name HD1%)
2.900 1.000 1.000 peak 73 spectrum 1 weight 0.10000E+01 volume 0.23401E-02 ppm1 9.117 ppm2 1.040 CV 1
ASSI { 74}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HA ))
2.900 1.000 1.000 peak 74 spectrum 1 weight 0.10000E+01 volume 0.17762E-02 ppm1 8.362 ppm2 5.034 CV 1
ASSI { 75}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 84 and name HA ))
2.100 0.600 0.600 peak 75 spectrum 1 weight 0.10000E+01 volume 0.93607E-02 ppm1 8.362 ppm2 4.296 CV 1
ASSI { 76}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HB2 ))
3.700 1.700 1.700 peak 76 spectrum 1 weight 0.10000E+01 volume 0.94306E-03 ppm1 8.359 ppm2 1.898 CV 1
ASSI { 78}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 84 and name HG2%)
2.800 1.000 1.000 peak 78 spectrum 1 weight 0.10000E+01 volume 0.29745E-02 ppm1 8.361 ppm2 0.898 CV 1
ASSI { 80}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HA ))
2.700 0.900 0.900 peak 80 spectrum 1 weight 0.10000E+01 volume 0.25093E-02 ppm1 8.378 ppm2 4.321 CV 1
ASSI { 83}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 21 and name HA ))
3.000 1.100 1.100 peak 83 spectrum 1 weight 0.10000E+01 volume 0.23401E-02 ppm1 8.297 ppm2 4.484 CV 1
ASSI { 84}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA ))
2.400 0.700 0.700 peak 84 spectrum 1 weight 0.10000E+01 volume 0.72460E-02 ppm1 8.298 ppm2 4.253 CV 1
ASSI { 85}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HB2 ))
2.800 1.000 1.000 peak 85 spectrum 1 weight 0.10000E+01 volume 0.33974E-02 ppm1 8.298 ppm2 2.949 CV 1
ASSI { 86}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HB3 ))
3.000 1.100 1.100 peak 86 spectrum 1 weight 0.10000E+01 volume 0.34256E-02 ppm1 8.299 ppm2 2.557 CV 1
ASSI { 87}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HB2 ))
3.400 1.400 1.400 peak 87 spectrum 1 weight 0.10000E+01 volume 0.15506E-02 ppm1 8.299 ppm2 2.031 CV 1
ASSI { 88}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 83 and name HE21))
2.900 1.000 1.000 peak 88 spectrum 1 weight 0.10000E+01 volume 0.20300E-02 ppm1 8.248 ppm2 7.718 CV 1
ASSI { 89}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 83 and name HE22))
3.100 1.200 1.200 peak 89 spectrum 1 weight 0.10000E+01 volume 0.14238E-02 ppm1 8.243 ppm2 6.685 CV 1
ASSI { 90}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HA ))
2.200 0.600 0.600 peak 90 spectrum 1 weight 0.10000E+01 volume 0.67381E-02 ppm1 8.245 ppm2 4.932 CV 1
ASSI { 91}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HA ))
3.000 1.100 1.100 peak 91 spectrum 1 weight 0.10000E+01 volume 0.11644E-02 ppm1 8.246 ppm2 4.072 CV 1
ASSI { 92}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HB ))
2.300 0.700 0.700 peak 92 spectrum 1 weight 0.10000E+01 volume 0.45815E-02 ppm1 8.246 ppm2 1.549 CV 1
OR { 92}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HG12))
ASSI { 93}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HG13))
2.900 1.000 1.000 peak 93 spectrum 1 weight 0.10000E+01 volume 0.15789E-02 ppm1 8.241 ppm2 1.237 CV 1
ASSI { 95}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HA ))
3.000 1.100 1.100 peak 95 spectrum 1 weight 0.10000E+01 volume 0.16776E-02 ppm1 8.134 ppm2 4.781 CV 1
ASSI { 96}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 21 and name HA ))
2.200 2.200 3.800 peak 96 spectrum 1 weight 0.10000E+01 volume 0.49480E-02 ppm1 8.125 ppm2 4.482 CV 1
ASSI { 97}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HB3 ))
3.100 1.200 1.200 peak 97 spectrum 1 weight 0.10000E+01 volume 0.20440E-02 ppm1 8.124 ppm2 2.818 CV 1
OR { 97}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HB2 ))
ASSI { 98}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 18 and name HA ))
2.700 0.900 0.900 peak 98 spectrum 1 weight 0.10000E+01 volume 0.34678E-02 ppm1 8.042 ppm2 4.605 CV 1
ASSI { 99}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HN ))
2.600 0.900 0.900 peak 99 spectrum 1 weight 0.10000E+01 volume 0.36652E-02 ppm1 8.076 ppm2 8.457 CV 1
ASSI { 100}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HA ))
2.800 1.000 1.000 peak 100 spectrum 1 weight 0.10000E+01 volume 0.23965E-02 ppm1 8.075 ppm2 4.497 CV 1
ASSI { 101}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA1 ))
2.700 0.900 0.900 peak 101 spectrum 1 weight 0.10000E+01 volume 0.33974E-02 ppm1 8.075 ppm2 4.072 CV 1
ASSI { 102}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HA2 ))
3.100 1.200 1.200 peak 102 spectrum 1 weight 0.10000E+01 volume 0.19031E-02 ppm1 8.074 ppm2 3.874 CV 1
ASSI { 103}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HB3 ))
2.500 0.800 0.800 peak 103 spectrum 1 weight 0.10000E+01 volume 0.62027E-02 ppm1 8.075 ppm2 1.651 CV 1
OR { 103}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HB2 ))
ASSI { 104}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 21 and name HD2%)
3.800 1.800 1.800 peak 104 spectrum 1 weight 0.10000E+01 volume 0.10235E-02 ppm1 8.075 ppm2 0.904 CV 1
OR { 104}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 21 and name HD1%)
ASSI { 105}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HN ))
3.300 1.300 1.300 peak 105 spectrum 1 weight 0.10000E+01 volume 0.25938E-02 ppm1 8.117 ppm2 8.610 CV 1
ASSI { 106}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HA ))
2.300 0.600 0.600 peak 106 spectrum 1 weight 0.10000E+01 volume 0.88390E-02 ppm1 8.115 ppm2 4.667 CV 1
ASSI { 107}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 82 and name HA ))
2.700 0.900 0.900 peak 107 spectrum 1 weight 0.10000E+01 volume 0.30027E-02 ppm1 8.115 ppm2 4.132 CV 1
ASSI { 108}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HB2 ))
3.600 1.600 1.600 peak 108 spectrum 1 weight 0.10000E+01 volume 0.13646E-02 ppm1 8.113 ppm2 2.555 CV 1
ASSI { 109}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HB3 ))
3.300 1.300 1.300 peak 109 spectrum 1 weight 0.10000E+01 volume 0.79788E-03 ppm1 8.115 ppm2 2.233 CV 1
ASSI { 110}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 82 and name HB2 ))
2.300 0.700 0.700 peak 110 spectrum 1 weight 0.10000E+01 volume 0.74148E-02 ppm1 8.115 ppm2 1.740 CV 1
OR { 110}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 82 and name HB3 ))
ASSI { 111}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 82 and name HG2 ))
3.200 1.300 1.300 peak 111 spectrum 1 weight 0.10000E+01 volume 0.18608E-02 ppm1 8.115 ppm2 1.466 CV 1
ASSI { 112}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
2.600 0.900 0.900 peak 112 spectrum 1 weight 0.10000E+01 volume 0.29745E-02 ppm1 7.864 ppm2 8.378 CV 1
ASSI { 113}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 45 and name HN ))
2.600 0.800 0.800 peak 113 spectrum 1 weight 0.10000E+01 volume 0.26080E-02 ppm1 7.863 ppm2 7.584 CV 1
ASSI { 114}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 44 and name HB% )
2.300 0.600 0.600 peak 114 spectrum 1 weight 0.10000E+01 volume 0.74432E-02 ppm1 7.864 ppm2 1.500 CV 1
ASSI { 115}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 43 and name HG2%)
3.100 1.200 1.200 peak 115 spectrum 1 weight 0.10000E+01 volume 0.15366E-02 ppm1 7.862 ppm2 1.298 CV 1
ASSI { 116}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 73 and name HG2%)
3.100 1.200 1.200 peak 116 spectrum 1 weight 0.10000E+01 volume 0.12109E-02 ppm1 7.864 ppm2 0.809 CV 1
ASSI { 118}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HA ))
3.600 1.600 1.600 peak 118 spectrum 1 weight 0.10000E+01 volume 0.58080E-03 ppm1 7.808 ppm2 4.249 CV 1
ASSI { 119}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HA ))
2.800 1.000 1.000 peak 119 spectrum 1 weight 0.10000E+01 volume 0.25938E-02 ppm1 7.809 ppm2 3.918 CV 1
ASSI { 120}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 25 and name HG3 ))
3.000 3.000 3.000 peak 120 spectrum 1 weight 0.10000E+01 volume 0.89095E-03 ppm1 7.808 ppm2 1.322 CV 1
ASSI { 121}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 61 and name HB% )
2.300 0.700 0.700 peak 121 spectrum 1 weight 0.10000E+01 volume 0.63155E-02 ppm1 7.810 ppm2 0.154 CV 1
ASSI { 122}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HA ))
2.700 0.900 0.900 peak 122 spectrum 1 weight 0.10000E+01 volume 0.30872E-02 ppm1 7.842 ppm2 4.431 CV 1
ASSI { 123}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HB2 ))
3.500 1.500 1.500 peak 123 spectrum 1 weight 0.10000E+01 volume 0.82888E-03 ppm1 7.842 ppm2 2.306 CV 1
ASSI { 125}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HA ))
2.900 1.000 1.000 peak 125 spectrum 1 weight 0.10000E+01 volume 0.19313E-02 ppm1 8.449 ppm2 4.667 CV 1
ASSI { 126}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HA ))
2.200 0.600 0.600 peak 126 spectrum 1 weight 0.10000E+01 volume 0.80210E-02 ppm1 8.449 ppm2 4.330 CV 1
ASSI { 127}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HB2 ))
3.800 1.800 1.800 peak 127 spectrum 1 weight 0.10000E+01 volume 0.14026E-02 ppm1 8.447 ppm2 1.955 CV 1
ASSI { 128}
(( segid " " and resid 88 and name HN ))
( segid " " and resid 88 and name HD1%)
3.800 1.800 1.800 peak 128 spectrum 1 weight 0.10000E+01 volume 0.98680E-03 ppm1 8.448 ppm2 0.915 CV 1
ASSI { 129}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HA ))
2.800 1.000 1.000 peak 129 spectrum 1 weight 0.10000E+01 volume 0.27489E-02 ppm1 7.840 ppm2 4.410 CV 1
ASSI { 130}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HA ))
3.000 1.100 1.100 peak 130 spectrum 1 weight 0.10000E+01 volume 0.18185E-02 ppm1 7.842 ppm2 4.202 CV 1
ASSI { 131}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HB2 ))
2.800 1.000 1.000 peak 131 spectrum 1 weight 0.10000E+01 volume 0.23965E-02 ppm1 7.841 ppm2 1.675 CV 1
OR { 131}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HB3 ))
ASSI { 132}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 13 and name HB2 ))
2.800 2.800 3.200 peak 132 spectrum 1 weight 0.10000E+01 volume 0.14238E-02 ppm1 7.841 ppm2 1.478 CV 1
ASSI { 133}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HA ))
3.000 1.100 1.100 peak 133 spectrum 1 weight 0.10000E+01 volume 0.18608E-02 ppm1 7.667 ppm2 4.505 CV 1
ASSI { 134}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HA ))
2.600 0.900 0.900 peak 134 spectrum 1 weight 0.10000E+01 volume 0.31859E-02 ppm1 7.668 ppm2 4.067 CV 1
ASSI { 135}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HB ))
2.500 0.800 0.800 peak 135 spectrum 1 weight 0.10000E+01 volume 0.38626E-02 ppm1 7.667 ppm2 2.136 CV 1
ASSI { 138}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA ))
2.500 0.800 0.800 peak 138 spectrum 1 weight 0.10000E+01 volume 0.52159E-02 ppm1 7.817 ppm2 4.365 CV 1
ASSI { 139}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HB2 ))
3.100 1.200 1.200 peak 139 spectrum 1 weight 0.10000E+01 volume 0.11855E-02 ppm1 7.817 ppm2 3.173 CV 1
ASSI { 140}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HB3 ))
3.600 1.700 1.700 peak 140 spectrum 1 weight 0.10000E+01 volume 0.91773E-03 ppm1 7.816 ppm2 2.705 CV 1
ASSI { 141}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HB2 ))
2.800 1.000 1.000 peak 141 spectrum 1 weight 0.10000E+01 volume 0.29463E-02 ppm1 7.817 ppm2 2.120 CV 1
ASSI { 142}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HG3 ))
2.800 1.000 1.000 peak 142 spectrum 1 weight 0.10000E+01 volume 0.23683E-02 ppm1 7.817 ppm2 1.883 CV 1
OR { 142}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HG2 ))
ASSI { 143}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 58 and name HN ))
3.000 1.100 1.100 peak 143 spectrum 1 weight 0.10000E+01 volume 0.14661E-02 ppm1 9.323 ppm2 9.665 CV 1
ASSI { 144}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 28 and name HD% )
3.200 1.300 1.300 peak 144 spectrum 1 weight 0.10000E+01 volume 0.17340E-02 ppm1 9.323 ppm2 7.222 CV 1
ASSI { 145}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 27 and name HD% )
3.600 1.600 1.600 peak 145 spectrum 1 weight 0.10000E+01 volume 0.11348E-02 ppm1 9.322 ppm2 6.882 CV 1
ASSI { 146}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA ))
3.000 1.100 1.100 peak 146 spectrum 1 weight 0.10000E+01 volume 0.12899E-02 ppm1 9.323 ppm2 5.093 CV 1
ASSI { 147}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 59 and name HA ))
3.600 1.600 1.600 peak 147 spectrum 1 weight 0.10000E+01 volume 0.83310E-03 ppm1 9.322 ppm2 4.938 CV 1
ASSI { 148}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
2.300 0.700 0.700 peak 148 spectrum 1 weight 0.10000E+01 volume 0.60617E-02 ppm1 9.323 ppm2 4.667 CV 1
ASSI { 149}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HB2 ))
2.800 1.000 1.000 peak 149 spectrum 1 weight 0.10000E+01 volume 0.13970E-02 ppm1 9.322 ppm2 3.496 CV 1
ASSI { 150}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HB3 ))
3.500 1.500 1.500 peak 150 spectrum 1 weight 0.10000E+01 volume 0.25374E-02 ppm1 9.323 ppm2 3.040 CV 1
ASSI { 151}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 59 and name HB2 ))
4.000 2.000 2.000 peak 151 spectrum 1 weight 0.10000E+01 volume 0.10685E-02 ppm1 9.322 ppm2 2.853 CV 1
ASSI { 152}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HB3 ))
3.100 1.200 1.200 peak 152 spectrum 1 weight 0.10000E+01 volume 0.18608E-02 ppm1 9.323 ppm2 2.587 CV 1
ASSI { 153}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 57 and name HB3 ))
3.400 1.500 1.500 peak 153 spectrum 1 weight 0.10000E+01 volume 0.80916E-03 ppm1 9.324 ppm2 1.705 CV 1
ASSI { 155}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HA ))
2.300 0.700 0.700 peak 155 spectrum 1 weight 0.10000E+01 volume 0.65976E-02 ppm1 9.647 ppm2 5.349 CV 1
ASSI { 156}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HB ))
2.600 0.900 0.900 peak 156 spectrum 1 weight 0.10000E+01 volume 0.29886E-02 ppm1 9.647 ppm2 2.490 CV 1
ASSI { 159}
(( segid " " and resid 58 and name HN ))
( segid " " and resid 58 and name HG2%)
3.800 1.800 1.800 peak 159 spectrum 1 weight 0.10000E+01 volume 0.11729E-02 ppm1 9.650 ppm2 1.253 CV 1
ASSI { 160}
(( segid " " and resid 58 and name HN ))
( segid " " and resid 58 and name HD1%)
3.700 1.700 1.700 peak 160 spectrum 1 weight 0.10000E+01 volume 0.10503E-02 ppm1 9.647 ppm2 1.037 CV 1
ASSI { 161}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HA ))
2.200 0.600 0.600 peak 161 spectrum 1 weight 0.10000E+01 volume 0.83739E-02 ppm1 8.555 ppm2 4.130 CV 1
ASSI { 162}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 76 and name HD2 ))
3.200 3.200 2.800 peak 162 spectrum 1 weight 0.10000E+01 volume 0.21568E-02 ppm1 8.555 ppm2 3.901 CV 1
ASSI { 163}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HG2 ))
4.000 2.000 2.000 peak 163 spectrum 1 weight 0.10000E+01 volume 0.11545E-02 ppm1 8.555 ppm2 2.479 CV 1
ASSI { 164}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HB2 ))
2.400 0.700 0.700 peak 164 spectrum 1 weight 0.10000E+01 volume 0.44688E-02 ppm1 8.555 ppm2 2.164 CV 1
ASSI { 165}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HB3 ))
3.500 1.500 1.500 peak 165 spectrum 1 weight 0.10000E+01 volume 0.20300E-02 ppm1 8.555 ppm2 1.739 CV 1
OR { 165}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HB2 ))
ASSI { 166}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HG2 ))
3.900 1.900 1.900 peak 166 spectrum 1 weight 0.10000E+01 volume 0.10333E-02 ppm1 8.556 ppm2 1.461 CV 1
ASSI { 167}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 79 and name HN ))
3.700 1.700 1.700 peak 167 spectrum 1 weight 0.10000E+01 volume 0.16493E-02 ppm1 8.626 ppm2 8.308 CV 1
ASSI { 169}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HN ))
2.200 0.600 0.600 peak 169 spectrum 1 weight 0.10000E+01 volume 0.72743E-02 ppm1 8.624 ppm2 7.578 CV 1
ASSI { 170}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HA ))
2.800 1.000 1.000 peak 170 spectrum 1 weight 0.10000E+01 volume 0.22837E-02 ppm1 8.625 ppm2 4.666 CV 1
ASSI { 171}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HA ))
3.100 1.200 1.200 peak 171 spectrum 1 weight 0.10000E+01 volume 0.20018E-02 ppm1 8.625 ppm2 4.237 CV 1
ASSI { 172}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HB2 ))
2.600 0.800 0.800 peak 172 spectrum 1 weight 0.10000E+01 volume 0.19736E-02 ppm1 8.625 ppm2 2.555 CV 1
ASSI { 173}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HB3 ))
3.000 1.100 1.100 peak 173 spectrum 1 weight 0.10000E+01 volume 0.30731E-02 ppm1 8.625 ppm2 2.236 CV 1
ASSI { 174}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HB ))
2.700 0.900 0.900 peak 174 spectrum 1 weight 0.10000E+01 volume 0.20864E-02 ppm1 8.624 ppm2 2.038 CV 1
ASSI { 175}
(( segid " " and resid 81 and name HN ))
( segid " " and resid 80 and name HG1%)
3.100 1.200 1.200 peak 175 spectrum 1 weight 0.10000E+01 volume 0.24388E-02 ppm1 8.625 ppm2 0.871 CV 1
ASSI { 176}
(( segid " " and resid 81 and name HN ))
( segid " " and resid 75 and name HG2%)
3.900 1.900 1.900 peak 176 spectrum 1 weight 0.10000E+01 volume 0.65833E-03 ppm1 8.622 ppm2 0.505 CV 1
ASSI { 178}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HD1 ))
2.700 0.900 0.900 peak 178 spectrum 1 weight 0.10000E+01 volume 0.29040E-02 ppm1 8.884 ppm2 7.612 CV 1
ASSI { 180}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HA ))
2.700 0.900 0.900 peak 180 spectrum 1 weight 0.10000E+01 volume 0.23683E-02 ppm1 8.884 ppm2 4.146 CV 1
ASSI { 181}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB2 ))
2.200 0.600 0.600 peak 181 spectrum 1 weight 0.10000E+01 volume 0.49340E-02 ppm1 8.884 ppm2 3.581 CV 1
ASSI { 182}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB2 ))
2.900 1.000 1.000 peak 182 spectrum 1 weight 0.10000E+01 volume 0.15506E-02 ppm1 8.884 ppm2 2.283 CV 1
ASSI { 183}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB3 ))
3.300 1.400 1.400 peak 183 spectrum 1 weight 0.10000E+01 volume 0.15366E-02 ppm1 8.884 ppm2 2.043 CV 1
ASSI { 184}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HG3 ))
4.200 2.200 1.800 peak 184 spectrum 1 weight 0.10000E+01 volume 0.84016E-03 ppm1 8.884 ppm2 1.878 CV 1
ASSI { 186}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 73 and name HG2%)
4.500 2.500 1.500 peak 186 spectrum 1 weight 0.10000E+01 volume 0.46238E-03 ppm1 8.888 ppm2 0.798 CV 1
ASSI { 187}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HN ))
2.600 0.800 0.800 peak 187 spectrum 1 weight 0.10000E+01 volume 0.33128E-02 ppm1 8.952 ppm2 7.830 CV 1
ASSI { 188}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 14 and name HD% )
2.500 0.800 0.800 peak 188 spectrum 1 weight 0.10000E+01 volume 0.37780E-02 ppm1 8.952 ppm2 7.113 CV 1
ASSI { 190}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HB2 ))
2.500 0.800 0.800 peak 190 spectrum 1 weight 0.10000E+01 volume 0.26361E-02 ppm1 8.952 ppm2 3.181 CV 1
ASSI { 191}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HB3 ))
3.500 1.500 1.500 peak 191 spectrum 1 weight 0.10000E+01 volume 0.32705E-02 ppm1 8.952 ppm2 2.702 CV 1
ASSI { 192}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HD2 ))
3.400 1.400 1.400 peak 192 spectrum 1 weight 0.10000E+01 volume 0.12687E-02 ppm1 8.949 ppm2 1.451 CV 1
OR { 192}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HD3 ))
ASSI { 193}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 28 and name HD% )
4.100 2.100 1.900 peak 193 spectrum 1 weight 0.10000E+01 volume 0.10404E-02 ppm1 8.807 ppm2 7.224 CV 1
ASSI { 194}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA ))
2.200 0.600 0.600 peak 194 spectrum 1 weight 0.10000E+01 volume 0.69920E-02 ppm1 8.807 ppm2 5.090 CV 1
ASSI { 195}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
3.000 1.100 1.100 peak 195 spectrum 1 weight 0.10000E+01 volume 0.15506E-02 ppm1 8.807 ppm2 4.579 CV 1
ASSI { 196}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB2 ))
3.800 1.800 1.800 peak 196 spectrum 1 weight 0.10000E+01 volume 0.16212E-02 ppm1 8.807 ppm2 3.500 CV 1
ASSI { 197}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB3 ))
3.000 1.100 1.100 peak 197 spectrum 1 weight 0.10000E+01 volume 0.11094E-02 ppm1 8.809 ppm2 3.044 CV 1
ASSI { 198}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
2.400 0.700 0.700 peak 198 spectrum 1 weight 0.10000E+01 volume 0.53005E-02 ppm1 8.701 ppm2 4.578 CV 1
ASSI { 201}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HG12))
3.100 1.200 1.200 peak 201 spectrum 1 weight 0.10000E+01 volume 0.35948E-02 ppm1 8.701 ppm2 1.659 CV 1
ASSI { 204}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HA ))
2.200 0.600 0.600 peak 204 spectrum 1 weight 0.10000E+01 volume 0.79504E-02 ppm1 8.647 ppm2 4.067 CV 1
ASSI { 205}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HB2 ))
3.700 1.700 1.700 peak 205 spectrum 1 weight 0.10000E+01 volume 0.90784E-03 ppm1 8.646 ppm2 2.011 CV 1
ASSI { 206}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HB3 ))
3.500 1.500 1.500 peak 206 spectrum 1 weight 0.10000E+01 volume 0.92479E-03 ppm1 8.647 ppm2 1.191 CV 1
ASSI { 207}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HG2 ))
4.000 2.000 2.000 peak 207 spectrum 1 weight 0.10000E+01 volume 0.13110E-02 ppm1 8.650 ppm2 0.982 CV 1
ASSI { 208}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HA ))
2.700 0.900 0.900 peak 208 spectrum 1 weight 0.10000E+01 volume 0.41304E-02 ppm1 8.567 ppm2 4.535 CV 1
ASSI { 209}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HA ))
2.900 1.100 1.100 peak 209 spectrum 1 weight 0.10000E+01 volume 0.19736E-02 ppm1 8.568 ppm2 3.961 CV 1
ASSI { 211}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HN ))
3.100 1.200 1.200 peak 211 spectrum 1 weight 0.10000E+01 volume 0.11151E-02 ppm1 8.926 ppm2 8.196 CV 1
ASSI { 212}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HA ))
2.400 0.700 0.700 peak 212 spectrum 1 weight 0.10000E+01 volume 0.59912E-02 ppm1 8.927 ppm2 4.615 CV 1
OR { 212}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HB ))
ASSI { 215}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HB3 ))
2.900 1.000 1.000 peak 215 spectrum 1 weight 0.10000E+01 volume 0.21287E-02 ppm1 8.927 ppm2 1.931 CV 1
ASSI { 217}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HN ))
2.800 1.000 1.000 peak 217 spectrum 1 weight 0.10000E+01 volume 0.29745E-02 ppm1 8.351 ppm2 8.072 CV 1
ASSI { 218}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HA ))
2.500 0.800 0.800 peak 218 spectrum 1 weight 0.10000E+01 volume 0.45393E-02 ppm1 8.353 ppm2 4.509 CV 1
ASSI { 219}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 22 and name HA ))
2.900 1.000 1.000 peak 219 spectrum 1 weight 0.10000E+01 volume 0.22274E-02 ppm1 8.352 ppm2 4.252 CV 1
ASSI { 220}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 22 and name HG3 ))
3.400 1.400 1.400 peak 220 spectrum 1 weight 0.10000E+01 volume 0.12180E-02 ppm1 8.352 ppm2 2.254 CV 1
OR { 220}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 22 and name HG2 ))
ASSI { 221}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 15 and name HB3 ))
2.300 2.300 3.700 peak 221 spectrum 1 weight 0.10000E+01 volume 0.45815E-02 ppm1 8.352 ppm2 2.009 CV 1
ASSI { 222}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB3 ))
2.900 1.100 1.100 peak 222 spectrum 1 weight 0.10000E+01 volume 0.34538E-02 ppm1 8.353 ppm2 1.668 CV 1
OR { 222}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB2 ))
ASSI { 223}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 21 and name HD1%)
2.900 2.900 3.100 peak 223 spectrum 1 weight 0.10000E+01 volume 0.95157E-03 ppm1 8.353 ppm2 0.908 CV 1
OR { 223}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 21 and name HD2%)
ASSI { 224}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HA ))
2.300 0.600 0.600 peak 224 spectrum 1 weight 0.10000E+01 volume 0.62732E-02 ppm1 8.543 ppm2 5.032 CV 1
ASSI { 225}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HA ))
2.900 1.000 1.000 peak 225 spectrum 1 weight 0.10000E+01 volume 0.18467E-02 ppm1 8.542 ppm2 4.499 CV 1
ASSI { 226}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 71 and name HA1 ))
3.400 1.400 1.400 peak 226 spectrum 1 weight 0.10000E+01 volume 0.10756E-02 ppm1 8.542 ppm2 4.317 CV 1
ASSI { 228}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HB3 ))
3.500 1.600 1.600 peak 228 spectrum 1 weight 0.10000E+01 volume 0.20864E-02 ppm1 8.543 ppm2 1.637 CV 1
ASSI { 229}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HG12))
3.900 1.900 1.900 peak 229 spectrum 1 weight 0.10000E+01 volume 0.14802E-02 ppm1 8.542 ppm2 1.423 CV 1
ASSI { 230}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HG13))
2.500 2.500 3.500 peak 230 spectrum 1 weight 0.10000E+01 volume 0.28053E-02 ppm1 8.543 ppm2 1.228 CV 1
ASSI { 231}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 86 and name HG2%)
3.400 1.500 1.500 peak 231 spectrum 1 weight 0.10000E+01 volume 0.25093E-02 ppm1 8.542 ppm2 0.910 CV 1
ASSI { 232}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 27 and name HD% )
3.000 1.100 1.100 peak 232 spectrum 1 weight 0.10000E+01 volume 0.19736E-02 ppm1 8.388 ppm2 6.895 CV 1
ASSI { 233}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HA ))
2.500 0.800 0.800 peak 233 spectrum 1 weight 0.10000E+01 volume 0.47648E-02 ppm1 8.389 ppm2 4.728 CV 1
ASSI { 234}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.200 1.300 1.300 peak 234 spectrum 1 weight 0.10000E+01 volume 0.36229E-02 ppm1 8.388 ppm2 2.876 CV 1
ASSI { 235}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HB3 ))
2.800 1.000 1.000 peak 235 spectrum 1 weight 0.10000E+01 volume 0.24811E-02 ppm1 8.390 ppm2 2.625 CV 1
ASSI { 238}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HA ))
3.200 1.300 1.300 peak 238 spectrum 1 weight 0.10000E+01 volume 0.92479E-03 ppm1 8.604 ppm2 4.149 CV 1
ASSI { 241}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HA ))
2.400 0.700 0.700 peak 241 spectrum 1 weight 0.10000E+01 volume 0.75698E-02 ppm1 9.084 ppm2 4.299 CV 1
ASSI { 243}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HB2 ))
3.700 1.700 1.700 peak 243 spectrum 1 weight 0.10000E+01 volume 0.57657E-03 ppm1 9.084 ppm2 2.987 CV 1
ASSI { 244}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HB3 ))
3.800 1.800 1.800 peak 244 spectrum 1 weight 0.10000E+01 volume 0.69782E-03 ppm1 9.085 ppm2 2.808 CV 1
ASSI { 245}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HB2 ))
3.400 1.500 1.500 peak 245 spectrum 1 weight 0.10000E+01 volume 0.96424E-03 ppm1 9.084 ppm2 2.083 CV 1
ASSI { 248}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 58 and name HA ))
3.000 1.100 1.100 peak 248 spectrum 1 weight 0.10000E+01 volume 0.16634E-02 ppm1 9.885 ppm2 5.360 CV 1
ASSI { 249}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HA ))
2.100 0.600 0.600 peak 249 spectrum 1 weight 0.10000E+01 volume 0.93607E-02 ppm1 9.886 ppm2 4.627 CV 1
ASSI { 250}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HA2 ))
2.400 0.700 0.700 peak 250 spectrum 1 weight 0.10000E+01 volume 0.37780E-02 ppm1 9.887 ppm2 3.617 CV 1
ASSI { 251}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 12 and name HB3 ))
4.200 2.200 1.800 peak 251 spectrum 1 weight 0.10000E+01 volume 0.92618E-03 ppm1 9.888 ppm2 3.140 CV 1
ASSI { 252}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 58 and name HD1%)
2.800 1.000 1.000 peak 252 spectrum 1 weight 0.10000E+01 volume 0.19172E-02 ppm1 9.885 ppm2 1.048 CV 1
ASSI { 253}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HN ))
2.900 1.100 1.100 peak 253 spectrum 1 weight 0.10000E+01 volume 0.18608E-02 ppm1 7.757 ppm2 8.708 CV 1
ASSI { 254}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HA1 ))
3.000 1.100 1.100 peak 254 spectrum 1 weight 0.10000E+01 volume 0.12603E-02 ppm1 7.756 ppm2 4.304 CV 1
ASSI { 258}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HN ))
2.700 0.900 0.900 peak 258 spectrum 1 weight 0.10000E+01 volume 0.21851E-02 ppm1 7.525 ppm2 8.838 CV 1
ASSI { 259}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
2.400 0.700 0.700 peak 259 spectrum 1 weight 0.10000E+01 volume 0.45533E-02 ppm1 7.524 ppm2 6.611 CV 1
ASSI { 260}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 35 and name HA ))
3.000 1.100 1.100 peak 260 spectrum 1 weight 0.10000E+01 volume 0.18890E-02 ppm1 7.524 ppm2 4.049 CV 1
ASSI { 261}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HA ))
2.500 0.800 0.800 peak 261 spectrum 1 weight 0.10000E+01 volume 0.41445E-02 ppm1 7.524 ppm2 3.494 CV 1
ASSI { 263}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB3 ))
2.300 0.600 0.600 peak 263 spectrum 1 weight 0.10000E+01 volume 0.59631E-02 ppm1 7.524 ppm2 1.381 CV 1
ASSI { 264}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HN ))
3.000 1.100 1.100 peak 264 spectrum 1 weight 0.10000E+01 volume 0.20582E-02 ppm1 7.552 ppm2 9.099 CV 1
ASSI { 266}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HN ))
2.300 0.600 0.600 peak 266 spectrum 1 weight 0.10000E+01 volume 0.52441E-02 ppm1 7.566 ppm2 8.342 CV 1
ASSI { 267}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HA ))
2.500 0.800 0.800 peak 267 spectrum 1 weight 0.10000E+01 volume 0.43278E-02 ppm1 7.567 ppm2 4.232 CV 1
ASSI { 268}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HB ))
2.900 1.000 1.000 peak 268 spectrum 1 weight 0.10000E+01 volume 0.18326E-02 ppm1 7.567 ppm2 2.044 CV 1
ASSI { 270}
(( segid " " and resid 80 and name HN ))
( segid " " and resid 80 and name HG1%)
3.100 1.200 1.200 peak 270 spectrum 1 weight 0.10000E+01 volume 0.38908E-02 ppm1 7.566 ppm2 0.869 CV 1
ASSI { 271}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 18 and name HD% )
3.000 1.100 1.100 peak 271 spectrum 1 weight 0.10000E+01 volume 0.17480E-02 ppm1 7.886 ppm2 7.173 CV 1
ASSI { 272}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HA ))
2.800 1.000 1.000 peak 272 spectrum 1 weight 0.10000E+01 volume 0.25657E-02 ppm1 7.885 ppm2 4.608 CV 1
ASSI { 273}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 16 and name HA ))
3.200 1.300 1.300 peak 273 spectrum 1 weight 0.10000E+01 volume 0.13280E-02 ppm1 7.882 ppm2 4.396 CV 1
ASSI { 274}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA ))
3.000 1.100 1.100 peak 274 spectrum 1 weight 0.10000E+01 volume 0.23260E-02 ppm1 7.886 ppm2 4.208 CV 1
ASSI { 275}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HB2 ))
2.800 1.000 1.000 peak 275 spectrum 1 weight 0.10000E+01 volume 0.19454E-02 ppm1 7.885 ppm2 3.163 CV 1
ASSI { 276}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 18 and name HB3 ))
3.300 1.400 1.400 peak 276 spectrum 1 weight 0.10000E+01 volume 0.31859E-02 ppm1 7.884 ppm2 2.812 CV 1
ASSI { 278}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HA ))
2.900 1.100 1.100 peak 278 spectrum 1 weight 0.10000E+01 volume 0.18608E-02 ppm1 7.927 ppm2 4.476 CV 1
ASSI { 279}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 6 and name HB ))
2.900 1.000 1.000 peak 279 spectrum 1 weight 0.10000E+01 volume 0.29322E-02 ppm1 7.926 ppm2 4.102 CV 1
ASSI { 280}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HA ))
2.400 0.700 0.700 peak 280 spectrum 1 weight 0.10000E+01 volume 0.58926E-02 ppm1 7.927 ppm2 3.932 CV 1
ASSI { 281}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HB ))
3.600 1.600 1.600 peak 281 spectrum 1 weight 0.10000E+01 volume 0.10023E-02 ppm1 7.932 ppm2 3.407 CV 1
ASSI { 282}
(( segid " " and resid 6 and name HN ))
( segid " " and resid 6 and name HG2%)
3.400 1.500 1.500 peak 282 spectrum 1 weight 0.10000E+01 volume 0.85144E-03 ppm1 7.927 ppm2 1.169 CV 1
ASSI { 283}
(( segid " " and resid 6 and name HN ))
( segid " " and resid 5 and name HG2%)
3.400 1.500 1.500 peak 283 spectrum 1 weight 0.10000E+01 volume 0.15789E-02 ppm1 7.928 ppm2 0.647 CV 1
ASSI { 284}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 41 and name HN ))
2.400 0.700 0.700 peak 284 spectrum 1 weight 0.10000E+01 volume 0.36793E-02 ppm1 8.063 ppm2 8.869 CV 1
ASSI { 285}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 37 and name HA ))
3.100 1.200 1.200 peak 285 spectrum 1 weight 0.10000E+01 volume 0.13674E-02 ppm1 8.062 ppm2 4.191 CV 1
ASSI { 286}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HB2 ))
2.300 0.700 0.700 peak 286 spectrum 1 weight 0.10000E+01 volume 0.36793E-02 ppm1 8.062 ppm2 2.278 CV 1
ASSI { 287}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HB3 ))
3.000 1.100 1.100 peak 287 spectrum 1 weight 0.10000E+01 volume 0.55119E-02 ppm1 8.063 ppm2 2.042 CV 1
ASSI { 289}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 73 and name HD1%)
3.800 1.800 1.800 peak 289 spectrum 1 weight 0.10000E+01 volume 0.19595E-02 ppm1 8.065 ppm2 0.889 CV 1
ASSI { 290}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
2.600 0.800 0.800 peak 290 spectrum 1 weight 0.10000E+01 volume 0.45533E-02 ppm1 8.026 ppm2 4.438 CV 1
ASSI { 291}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HA ))
3.100 1.200 1.200 peak 291 spectrum 1 weight 0.10000E+01 volume 0.13900E-02 ppm1 8.025 ppm2 3.937 CV 1
ASSI { 292}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 5 and name HB ))
3.000 1.200 1.200 peak 292 spectrum 1 weight 0.10000E+01 volume 0.19031E-02 ppm1 8.026 ppm2 3.401 CV 1
ASSI { 293}
(( segid " " and resid 5 and name HN ))
( segid " " and resid 5 and name HG2%)
3.700 1.700 1.700 peak 293 spectrum 1 weight 0.10000E+01 volume 0.86134E-03 ppm1 8.024 ppm2 0.650 CV 1
ASSI { 295}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 51 and name HN ))
2.400 0.700 0.700 peak 295 spectrum 1 weight 0.10000E+01 volume 0.33974E-02 ppm1 8.191 ppm2 7.800 CV 1
ASSI { 296}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 48 and name HB ))
2.900 1.000 1.000 peak 296 spectrum 1 weight 0.10000E+01 volume 0.16070E-02 ppm1 8.189 ppm2 4.600 CV 1
ASSI { 298}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HG2 ))
3.200 1.300 1.300 peak 298 spectrum 1 weight 0.10000E+01 volume 0.14379E-02 ppm1 8.190 ppm2 2.328 CV 1
OR { 298}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HG3 ))
ASSI { 299}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HN ))
2.900 1.000 1.000 peak 299 spectrum 1 weight 0.10000E+01 volume 0.15648E-02 ppm1 7.350 ppm2 8.439 CV 1
ASSI { 300}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HA ))
2.500 0.800 0.800 peak 300 spectrum 1 weight 0.10000E+01 volume 0.46802E-02 ppm1 7.351 ppm2 4.294 CV 1
ASSI { 301}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HB2 ))
2.200 0.600 0.600 peak 301 spectrum 1 weight 0.10000E+01 volume 0.61040E-02 ppm1 7.352 ppm2 1.811 CV 1
ASSI { 302}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HB3 ))
3.000 1.100 1.100 peak 302 spectrum 1 weight 0.10000E+01 volume 0.35242E-02 ppm1 7.351 ppm2 1.672 CV 1
ASSI { 303}
(( segid " " and resid 56 and name HN ))
( segid " " and resid 56 and name HD2%)
3.300 1.400 1.400 peak 303 spectrum 1 weight 0.10000E+01 volume 0.39895E-02 ppm1 7.352 ppm2 0.967 CV 1
ASSI { 304}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HN ))
2.400 0.700 0.700 peak 304 spectrum 1 weight 0.10000E+01 volume 0.59912E-02 ppm1 7.478 ppm2 8.657 CV 1
ASSI { 305}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HA ))
2.700 0.900 0.900 peak 305 spectrum 1 weight 0.10000E+01 volume 0.24106E-02 ppm1 7.479 ppm2 4.218 CV 1
ASSI { 306}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HA ))
4.000 2.000 2.000 peak 306 spectrum 1 weight 0.10000E+01 volume 0.96285E-03 ppm1 7.479 ppm2 4.061 CV 1
ASSI { 308}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HB3 ))
3.100 1.200 1.200 peak 308 spectrum 1 weight 0.10000E+01 volume 0.13716E-02 ppm1 7.479 ppm2 1.192 CV 1
ASSI { 309}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 37 and name HD2%)
3.400 1.500 1.500 peak 309 spectrum 1 weight 0.10000E+01 volume 0.77249E-03 ppm1 7.481 ppm2 1.001 CV 1
ASSI { 310}
(( segid " " and resid 11 and name HD21))
(( segid " " and resid 11 and name HD22))
1.800 0.400 0.400 peak 310 spectrum 1 weight 0.10000E+01 volume 0.15648E-01 ppm1 7.626 ppm2 6.957 CV 1
ASSI { 311}
(( segid " " and resid 11 and name HD21))
(( segid " " and resid 11 and name HB2 ))
3.300 1.400 1.400 peak 311 spectrum 1 weight 0.10000E+01 volume 0.10023E-02 ppm1 7.622 ppm2 2.987 CV 1
ASSI { 314}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 83 and name HG2 ))
3.400 1.400 1.400 peak 314 spectrum 1 weight 0.10000E+01 volume 0.95157E-03 ppm1 7.708 ppm2 2.478 CV 1
ASSI { 316}
(( segid " " and resid 24 and name HD21))
(( segid " " and resid 24 and name HB3 ))
3.000 1.100 1.100 peak 316 spectrum 1 weight 0.10000E+01 volume 0.16776E-02 ppm1 7.529 ppm2 2.821 CV 1
OR { 316}
(( segid " " and resid 24 and name HD21))
(( segid " " and resid 24 and name HB2 ))
ASSI { 317}
(( segid " " and resid 55 and name HE21))
(( segid " " and resid 55 and name HG3 ))
3.100 1.200 1.200 peak 317 spectrum 1 weight 0.10000E+01 volume 0.12194E-02 ppm1 7.541 ppm2 2.440 CV 1
OR { 317}
(( segid " " and resid 55 and name HE21))
(( segid " " and resid 55 and name HG2 ))
ASSI { 318}
(( segid " " and resid 39 and name HE21))
(( segid " " and resid 39 and name HE22))
1.800 0.400 0.400 peak 318 spectrum 1 weight 0.10000E+01 volume 0.17621E-01 ppm1 7.430 ppm2 6.834 CV 1
ASSI { 320}
(( segid " " and resid 39 and name HE21))
( segid " " and resid 36 and name HD1%)
3.300 1.400 1.400 peak 320 spectrum 1 weight 0.10000E+01 volume 0.75844E-03 ppm1 7.431 ppm2 0.992 CV 1
ASSI { 321}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HN ))
2.600 0.900 0.900 peak 321 spectrum 1 weight 0.10000E+01 volume 0.32564E-02 ppm1 7.701 ppm2 8.145 CV 1
ASSI { 323}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HA1 ))
2.200 0.600 0.600 peak 323 spectrum 1 weight 0.10000E+01 volume 0.85006E-02 ppm1 7.701 ppm2 3.917 CV 1
ASSI { 327}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 62 and name HA ))
3.600 1.600 1.600 peak 327 spectrum 1 weight 0.10000E+01 volume 0.93607E-03 ppm1 7.949 ppm2 3.965 CV 1
ASSI { 328}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HA ))
2.200 0.600 0.600 peak 328 spectrum 1 weight 0.10000E+01 volume 0.73588E-02 ppm1 7.946 ppm2 3.111 CV 1
ASSI { 329}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 62 and name HB3 ))
2.800 1.000 1.000 peak 329 spectrum 1 weight 0.10000E+01 volume 0.15225E-02 ppm1 7.945 ppm2 1.873 CV 1
ASSI { 330}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HB2 ))
3.300 1.400 1.400 peak 330 spectrum 1 weight 0.10000E+01 volume 0.15648E-02 ppm1 7.946 ppm2 1.229 CV 1
OR { 330}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HB3 ))
ASSI { 331}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 75 and name HG1%)
3.100 1.200 1.200 peak 331 spectrum 1 weight 0.10000E+01 volume 0.18326E-02 ppm1 7.947 ppm2 0.964 CV 1
ASSI { 333}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 61 and name HN ))
2.900 1.000 1.000 peak 333 spectrum 1 weight 0.10000E+01 volume 0.14379E-02 ppm1 7.986 ppm2 7.817 CV 1
ASSI { 334}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HA ))
2.400 0.700 0.700 peak 334 spectrum 1 weight 0.10000E+01 volume 0.48212E-02 ppm1 7.988 ppm2 4.944 CV 1
ASSI { 335}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 27 and name HA ))
3.500 1.500 1.500 peak 335 spectrum 1 weight 0.10000E+01 volume 0.96002E-03 ppm1 7.989 ppm2 4.659 CV 1
ASSI { 336}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HB2 ))
3.600 1.600 1.600 peak 336 spectrum 1 weight 0.10000E+01 volume 0.13125E-02 ppm1 7.987 ppm2 4.393 CV 1
ASSI { 338}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HB3 ))
2.500 0.800 0.800 peak 338 spectrum 1 weight 0.10000E+01 volume 0.32141E-02 ppm1 7.988 ppm2 3.326 CV 1
ASSI { 339}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HB2 ))
3.700 1.700 1.700 peak 339 spectrum 1 weight 0.10000E+01 volume 0.11855E-02 ppm1 7.988 ppm2 2.856 CV 1
ASSI { 340}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HB3 ))
2.600 0.900 0.900 peak 340 spectrum 1 weight 0.10000E+01 volume 0.24247E-02 ppm1 7.988 ppm2 2.546 CV 1
ASSI { 342}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HA ))
2.400 0.700 0.700 peak 342 spectrum 1 weight 0.10000E+01 volume 0.50044E-02 ppm1 7.759 ppm2 4.827 CV 1
ASSI { 343}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HA ))
2.700 0.900 0.900 peak 343 spectrum 1 weight 0.10000E+01 volume 0.24811E-02 ppm1 7.760 ppm2 4.621 CV 1
ASSI { 344}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HB2 ))
3.200 1.200 1.200 peak 344 spectrum 1 weight 0.10000E+01 volume 0.45674E-02 ppm1 7.758 ppm2 1.925 CV 1
ASSI { 345}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HB3 ))
2.700 0.900 0.900 peak 345 spectrum 1 weight 0.10000E+01 volume 0.17340E-02 ppm1 7.759 ppm2 1.360 CV 1
ASSI { 346}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 51 and name HG2%)
3.200 1.200 1.200 peak 346 spectrum 1 weight 0.10000E+01 volume 0.24388E-02 ppm1 7.758 ppm2 1.183 CV 1
ASSI { 349}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HA1 ))
2.800 1.000 1.000 peak 349 spectrum 1 weight 0.10000E+01 volume 0.20864E-02 ppm1 8.985 ppm2 4.174 CV 1
ASSI { 350}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HA ))
2.400 0.700 0.700 peak 350 spectrum 1 weight 0.10000E+01 volume 0.56529E-02 ppm1 8.985 ppm2 3.932 CV 1
ASSI { 351}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HA2 ))
3.000 1.100 1.100 peak 351 spectrum 1 weight 0.10000E+01 volume 0.28335E-02 ppm1 8.985 ppm2 3.779 CV 1
ASSI { 353}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 40 and name HN ))
2.700 0.900 0.900 peak 353 spectrum 1 weight 0.10000E+01 volume 0.20159E-02 ppm1 8.823 ppm2 8.079 CV 1
ASSI { 355}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 37 and name HA ))
3.200 1.300 1.300 peak 355 spectrum 1 weight 0.10000E+01 volume 0.13012E-02 ppm1 8.823 ppm2 4.176 CV 1
ASSI { 356}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HA ))
2.700 0.900 0.900 peak 356 spectrum 1 weight 0.10000E+01 volume 0.30450E-02 ppm1 8.823 ppm2 4.005 CV 1
ASSI { 357}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HA ))
3.600 1.600 1.600 peak 357 spectrum 1 weight 0.10000E+01 volume 0.60335E-03 ppm1 8.824 ppm2 3.498 CV 1
ASSI { 358}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HG2 ))
3.400 1.500 1.500 peak 358 spectrum 1 weight 0.10000E+01 volume 0.26925E-02 ppm1 8.823 ppm2 2.592 CV 1
ASSI { 359}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB2 ))
2.300 0.700 0.700 peak 359 spectrum 1 weight 0.10000E+01 volume 0.48071E-02 ppm1 8.823 ppm2 2.313 CV 1
ASSI { 360}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB3 ))
2.900 1.100 1.100 peak 360 spectrum 1 weight 0.10000E+01 volume 0.23401E-02 ppm1 8.822 ppm2 2.134 CV 1
ASSI { 361}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HB2 ))
3.200 1.300 1.300 peak 361 spectrum 1 weight 0.10000E+01 volume 0.29604E-02 ppm1 8.824 ppm2 1.840 CV 1
ASSI { 362}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HB3 ))
2.600 0.900 0.900 peak 362 spectrum 1 weight 0.10000E+01 volume 0.25657E-02 ppm1 8.824 ppm2 1.378 CV 1
ASSI { 364}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 37 and name HN ))
2.900 1.000 1.000 peak 364 spectrum 1 weight 0.10000E+01 volume 0.14379E-02 ppm1 8.629 ppm2 6.610 CV 1
ASSI { 365}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 37 and name HA ))
3.500 3.500 2.500 peak 365 spectrum 1 weight 0.10000E+01 volume 0.19595E-02 ppm1 8.629 ppm2 4.178 CV 1
ASSI { 366}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HA ))
3.600 1.600 1.600 peak 366 spectrum 1 weight 0.10000E+01 volume 0.62168E-03 ppm1 8.629 ppm2 4.040 CV 1
ASSI { 367}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 34 and name HB3 ))
4.500 2.500 1.500 peak 367 spectrum 1 weight 0.10000E+01 volume 0.88950E-03 ppm1 8.630 ppm2 2.229 CV 1
ASSI { 368}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HB ))
2.600 0.800 0.800 peak 368 spectrum 1 weight 0.10000E+01 volume 0.35242E-02 ppm1 8.629 ppm2 1.908 CV 1
ASSI { 369}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HB2 ))
2.900 1.100 1.100 peak 369 spectrum 1 weight 0.10000E+01 volume 0.23542E-02 ppm1 8.630 ppm2 1.748 CV 1
OR { 369}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HB3 ))
ASSI { 370}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HG12))
3.200 1.200 1.200 peak 370 spectrum 1 weight 0.10000E+01 volume 0.68370E-03 ppm1 8.631 ppm2 1.487 CV 1
ASSI { 371}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HG13))
3.700 1.700 1.700 peak 371 spectrum 1 weight 0.10000E+01 volume 0.14520E-02 ppm1 8.630 ppm2 1.322 CV 1
ASSI { 372}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 36 and name HD1%)
2.900 1.000 1.000 peak 372 spectrum 1 weight 0.10000E+01 volume 0.37639E-02 ppm1 8.629 ppm2 0.977 CV 1
OR { 372}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 36 and name HG2%)
ASSI { 375}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 40 and name HA ))
3.200 1.300 1.300 peak 375 spectrum 1 weight 0.10000E+01 volume 0.98963E-03 ppm1 8.359 ppm2 4.336 CV 1
ASSI { 376}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB ))
2.400 0.700 0.700 peak 376 spectrum 1 weight 0.10000E+01 volume 0.49622E-02 ppm1 8.361 ppm2 4.219 CV 1
ASSI { 377}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
2.800 1.000 1.000 peak 377 spectrum 1 weight 0.10000E+01 volume 0.25093E-02 ppm1 8.361 ppm2 4.063 CV 1
ASSI { 378}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 46 and name HA1 ))
3.400 3.400 2.600 peak 378 spectrum 1 weight 0.10000E+01 volume 0.14238E-02 ppm1 8.359 ppm2 3.940 CV 1
ASSI { 379}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HB2 ))
2.700 0.900 0.900 peak 379 spectrum 1 weight 0.10000E+01 volume 0.28194E-02 ppm1 8.361 ppm2 1.993 CV 1
ASSI { 380}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HG ))
4.800 2.800 1.200 peak 380 spectrum 1 weight 0.10000E+01 volume 0.36793E-03 ppm1 8.357 ppm2 1.846 CV 1
ASSI { 386}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HA ))
3.000 1.200 1.200 peak 386 spectrum 1 weight 0.10000E+01 volume 0.14041E-02 ppm1 8.327 ppm2 4.791 CV 1
ASSI { 387}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HA ))
2.600 0.900 0.900 peak 387 spectrum 1 weight 0.10000E+01 volume 0.44829E-02 ppm1 8.326 ppm2 4.226 CV 1
OR { 387}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HB ))
ASSI { 389}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HG2 ))
3.600 1.600 1.600 peak 389 spectrum 1 weight 0.10000E+01 volume 0.72743E-03 ppm1 8.328 ppm2 1.738 CV 1
ASSI { 390}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 79 and name HG2%)
2.700 0.900 0.900 peak 390 spectrum 1 weight 0.10000E+01 volume 0.32282E-02 ppm1 8.325 ppm2 1.294 CV 1
ASSI { 391}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 80 and name HG1%)
4.600 2.700 1.400 peak 391 spectrum 1 weight 0.10000E+01 volume 0.79650E-03 ppm1 8.326 ppm2 0.880 CV 1
ASSI { 392}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HA ))
2.900 1.100 1.100 peak 392 spectrum 1 weight 0.10000E+01 volume 0.21004E-02 ppm1 8.471 ppm2 4.318 CV 1
ASSI { 394}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HA2 ))
3.200 1.300 1.300 peak 394 spectrum 1 weight 0.10000E+01 volume 0.14097E-02 ppm1 8.469 ppm2 3.871 CV 1
ASSI { 395}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 71 and name HA1 ))
3.100 1.200 1.200 peak 395 spectrum 1 weight 0.10000E+01 volume 0.12010E-02 ppm1 8.694 ppm2 4.313 CV 1
ASSI { 396}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HA ))
2.600 0.900 0.900 peak 396 spectrum 1 weight 0.10000E+01 volume 0.35525E-02 ppm1 8.694 ppm2 3.958 CV 1
ASSI { 397}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HA ))
2.900 1.100 1.100 peak 397 spectrum 1 weight 0.10000E+01 volume 0.15648E-02 ppm1 8.280 ppm2 5.040 CV 1
ASSI { 398}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 78 and name HD2 ))
3.800 1.800 1.800 peak 398 spectrum 1 weight 0.10000E+01 volume 0.10658E-02 ppm1 8.280 ppm2 3.949 CV 1
ASSI { 399}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HD3 ))
3.600 1.600 1.600 peak 399 spectrum 1 weight 0.10000E+01 volume 0.19736E-02 ppm1 8.279 ppm2 3.720 CV 1
ASSI { 400}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HB2 ))
2.700 0.900 0.900 peak 400 spectrum 1 weight 0.10000E+01 volume 0.22132E-02 ppm1 8.279 ppm2 2.912 CV 1
ASSI { 402}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HB3 ))
3.100 1.200 1.200 peak 402 spectrum 1 weight 0.10000E+01 volume 0.44124E-02 ppm1 8.279 ppm2 2.238 CV 1
OR { 402}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HG3 ))
ASSI { 403}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 75 and name HB ))
3.000 1.100 1.100 peak 403 spectrum 1 weight 0.10000E+01 volume 0.14097E-02 ppm1 8.279 ppm2 2.101 CV 1
ASSI { 404}
(( segid " " and resid 77 and name HN ))
( segid " " and resid 75 and name HG2%)
2.900 1.100 1.100 peak 404 spectrum 1 weight 0.10000E+01 volume 0.24106E-02 ppm1 8.278 ppm2 0.498 CV 1
ASSI { 405}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HN ))
2.800 1.000 1.000 peak 405 spectrum 1 weight 0.10000E+01 volume 0.21146E-02 ppm1 8.515 ppm2 9.000 CV 1
ASSI { 406}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HN ))
2.700 0.900 0.900 peak 406 spectrum 1 weight 0.10000E+01 volume 0.35948E-02 ppm1 8.515 ppm2 6.987 CV 1
ASSI { 407}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HA1 ))
2.200 0.600 0.600 peak 407 spectrum 1 weight 0.10000E+01 volume 0.67381E-02 ppm1 8.514 ppm2 4.086 CV 1
ASSI { 408}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HA2 ))
2.800 1.000 1.000 peak 408 spectrum 1 weight 0.10000E+01 volume 0.44406E-02 ppm1 8.515 ppm2 3.923 CV 1
ASSI { 409}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HA2 ))
3.200 1.300 1.300 peak 409 spectrum 1 weight 0.10000E+01 volume 0.11799E-02 ppm1 8.516 ppm2 3.781 CV 1
ASSI { 412}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
3.000 1.100 1.100 peak 412 spectrum 1 weight 0.10000E+01 volume 0.18749E-02 ppm1 7.575 ppm2 4.155 CV 1
ASSI { 413}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HG12))
2.200 0.600 0.600 peak 413 spectrum 1 weight 0.10000E+01 volume 0.50890E-02 ppm1 7.573 ppm2 1.934 CV 1
ASSI { 414}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 44 and name HB% )
2.700 0.900 0.900 peak 414 spectrum 1 weight 0.10000E+01 volume 0.26080E-02 ppm1 7.572 ppm2 1.509 CV 1
ASSI { 415}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HG13))
2.600 0.800 0.800 peak 415 spectrum 1 weight 0.10000E+01 volume 0.20300E-02 ppm1 7.573 ppm2 1.219 CV 1
ASSI { 416}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 45 and name HG2%)
3.000 1.100 1.100 peak 416 spectrum 1 weight 0.10000E+01 volume 0.33551E-02 ppm1 7.573 ppm2 0.789 CV 1
ASSI { 419}
(( segid " " and resid 39 and name HE22))
( segid " " and resid 36 and name HD1%)
3.100 1.200 1.200 peak 419 spectrum 1 weight 0.10000E+01 volume 0.63437E-03 ppm1 6.824 ppm2 0.984 CV 1
OR { 419}
(( segid " " and resid 39 and name HE22))
( segid " " and resid 36 and name HG2%)
ASSI { 423}
(( segid " " and resid 24 and name HD22))
(( segid " " and resid 24 and name HB3 ))
3.300 1.400 1.400 peak 423 spectrum 1 weight 0.10000E+01 volume 0.29604E-02 ppm1 6.918 ppm2 2.824 CV 1
OR { 423}
(( segid " " and resid 24 and name HD22))
(( segid " " and resid 24 and name HB2 ))
ASSI { 424}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HD2 ))
2.800 1.000 1.000 peak 424 spectrum 1 weight 0.10000E+01 volume 0.23260E-02 ppm1 6.362 ppm2 7.959 CV 1
ASSI { 425}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HN ))
2.600 0.800 0.800 peak 425 spectrum 1 weight 0.10000E+01 volume 0.29040E-02 ppm1 6.363 ppm2 7.820 CV 1
ASSI { 426}
(( segid " " and resid 62 and name HN ))
( segid " " and resid 63 and name HD% )
3.000 1.100 1.100 peak 426 spectrum 1 weight 0.10000E+01 volume 0.13533E-02 ppm1 6.361 ppm2 7.303 CV 1
ASSI { 427}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HN ))
2.800 1.000 1.000 peak 427 spectrum 1 weight 0.10000E+01 volume 0.24952E-02 ppm1 6.362 ppm2 7.063 CV 1
ASSI { 428}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HA ))
2.800 1.000 1.000 peak 428 spectrum 1 weight 0.10000E+01 volume 0.26361E-02 ppm1 6.364 ppm2 3.949 CV 1
ASSI { 429}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB2 ))
2.700 0.900 0.900 peak 429 spectrum 1 weight 0.10000E+01 volume 0.17904E-02 ppm1 6.362 ppm2 3.119 CV 1
ASSI { 430}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB3 ))
3.500 1.500 1.500 peak 430 spectrum 1 weight 0.10000E+01 volume 0.23542E-02 ppm1 6.362 ppm2 1.870 CV 1
ASSI { 431}
(( segid " " and resid 62 and name HN ))
( segid " " and resid 61 and name HB% )
3.300 1.300 1.300 peak 431 spectrum 1 weight 0.10000E+01 volume 0.14802E-02 ppm1 6.362 ppm2 0.142 CV 1
ASSI { 436}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HA ))
2.900 1.100 1.100 peak 436 spectrum 1 weight 0.10000E+01 volume 0.20440E-02 ppm1 7.050 ppm2 5.030 CV 1
ASSI { 437}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 64 and name HA ))
2.900 2.900 3.100 peak 437 spectrum 1 weight 0.10000E+01 volume 0.27912E-02 ppm1 7.051 ppm2 3.934 CV 1
ASSI { 438}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB2 ))
2.800 1.000 1.000 peak 438 spectrum 1 weight 0.10000E+01 volume 0.15930E-02 ppm1 7.051 ppm2 2.952 CV 1
ASSI { 439}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB3 ))
3.500 1.500 1.500 peak 439 spectrum 1 weight 0.10000E+01 volume 0.23119E-02 ppm1 7.051 ppm2 2.413 CV 1
ASSI { 442}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HA ))
2.700 0.900 0.900 peak 442 spectrum 1 weight 0.10000E+01 volume 0.30731E-02 ppm1 6.981 ppm2 4.608 CV 1
ASSI { 443}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HA1 ))
2.800 1.000 1.000 peak 443 spectrum 1 weight 0.10000E+01 volume 0.17057E-02 ppm1 6.981 ppm2 4.074 CV 1
ASSI { 444}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HA2 ))
3.700 1.700 1.700 peak 444 spectrum 1 weight 0.10000E+01 volume 0.14379E-02 ppm1 6.980 ppm2 3.910 CV 1
ASSI { 445}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 65 and name HA2 ))
3.600 1.600 1.600 peak 445 spectrum 1 weight 0.10000E+01 volume 0.75560E-03 ppm1 6.980 ppm2 3.776 CV 1
ASSI { 446}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 63 and name HB2 ))
3.600 1.600 1.600 peak 446 spectrum 1 weight 0.10000E+01 volume 0.78944E-03 ppm1 6.979 ppm2 2.957 CV 1
ASSI { 447}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 63 and name HB3 ))
3.000 1.200 1.200 peak 447 spectrum 1 weight 0.10000E+01 volume 0.13167E-02 ppm1 6.981 ppm2 2.403 CV 1
ASSI { 448}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB3 ))
3.200 1.300 1.300 peak 448 spectrum 1 weight 0.10000E+01 volume 0.18185E-02 ppm1 6.981 ppm2 1.774 CV 1
ASSI { 450}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HA ))
2.500 0.800 0.800 peak 450 spectrum 1 weight 0.10000E+01 volume 0.50327E-02 ppm1 6.917 ppm2 4.061 CV 1
ASSI { 451}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB ))
3.800 1.800 1.800 peak 451 spectrum 1 weight 0.10000E+01 volume 0.58362E-03 ppm1 6.921 ppm2 2.440 CV 1
ASSI { 452}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HB ))
3.600 1.600 1.600 peak 452 spectrum 1 weight 0.10000E+01 volume 0.97974E-03 ppm1 6.923 ppm2 2.138 CV 1
ASSI { 453}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 53 and name HG1%)
2.900 1.000 1.000 peak 453 spectrum 1 weight 0.10000E+01 volume 0.52159E-02 ppm1 6.918 ppm2 0.969 CV 1
ASSI { 456}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HA ))
2.700 0.900 0.900 peak 456 spectrum 1 weight 0.10000E+01 volume 0.25798E-02 ppm1 6.602 ppm2 4.188 CV 1
ASSI { 457}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 34 and name HB3 ))
4.000 2.000 2.000 peak 457 spectrum 1 weight 0.10000E+01 volume 0.14520E-02 ppm1 6.599 ppm2 2.223 CV 1
ASSI { 458}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 39 and name HB3 ))
4.300 2.300 1.700 peak 458 spectrum 1 weight 0.10000E+01 volume 0.35384E-03 ppm1 6.598 ppm2 2.106 CV 1
ASSI { 461}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 36 and name HG2%)
3.000 1.100 1.100 peak 461 spectrum 1 weight 0.10000E+01 volume 0.36511E-02 ppm1 6.601 ppm2 0.983 CV 1
OR { 461}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 36 and name HD1%)
ASSI { 462}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HE21))
2.800 1.000 1.000 peak 462 spectrum 1 weight 0.10000E+01 volume 0.12561E-02 ppm1 6.950 ppm2 7.713 CV 1
ASSI { 463}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 84 and name HA ))
2.800 1.000 1.000 peak 463 spectrum 1 weight 0.10000E+01 volume 0.16070E-02 ppm1 6.951 ppm2 4.289 CV 1
ASSI { 464}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 76 and name HD2 ))
3.300 3.300 2.700 peak 464 spectrum 1 weight 0.10000E+01 volume 0.69920E-02 ppm1 6.948 ppm2 3.897 CV 1
ASSI { 465}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HB2 ))
3.600 1.600 1.600 peak 465 spectrum 1 weight 0.10000E+01 volume 0.17904E-02 ppm1 6.949 ppm2 2.164 CV 1
ASSI { 466}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 84 and name HB ))
2.300 0.700 0.700 peak 466 spectrum 1 weight 0.10000E+01 volume 0.36229E-02 ppm1 6.949 ppm2 1.610 CV 1
ASSI { 468}
(( segid " " and resid 68 and name HN ))
( segid " " and resid 28 and name HE% )
3.200 1.300 1.300 peak 468 spectrum 1 weight 0.10000E+01 volume 0.13392E-02 ppm1 7.220 ppm2 6.499 CV 1
ASSI { 469}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HA ))
2.000 0.500 0.500 peak 469 spectrum 1 weight 0.10000E+01 volume 0.14238E-01 ppm1 7.220 ppm2 4.609 CV 1
ASSI { 470}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HA ))
2.900 1.100 1.100 peak 470 spectrum 1 weight 0.10000E+01 volume 0.16917E-02 ppm1 7.220 ppm2 3.862 CV 1
ASSI { 471}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB3 ))
3.900 1.900 1.900 peak 471 spectrum 1 weight 0.10000E+01 volume 0.90223E-03 ppm1 7.217 ppm2 1.778 CV 1
ASSI { 472}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HG3 ))
4.100 2.100 1.900 peak 472 spectrum 1 weight 0.10000E+01 volume 0.97974E-03 ppm1 7.220 ppm2 0.675 CV 1
ASSI { 473}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HB2 ))
2.600 0.800 0.800 peak 473 spectrum 1 weight 0.10000E+01 volume 0.53287E-02 ppm1 7.220 ppm2 0.118 CV 1
ASSI { 474}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HA ))
2.900 1.000 1.000 peak 474 spectrum 1 weight 0.10000E+01 volume 0.21568E-02 ppm1 8.078 ppm2 4.725 CV 1
ASSI { 475}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HA ))
2.400 0.700 0.700 peak 475 spectrum 1 weight 0.10000E+01 volume 0.59208E-02 ppm1 8.085 ppm2 3.805 CV 1
ASSI { 476}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 60 and name HB3 ))
2.000 2.000 4.000 peak 476 spectrum 1 weight 0.10000E+01 volume 0.12264E-01 ppm1 8.089 ppm2 3.328 CV 1
ASSI { 478}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB3 ))
3.400 1.400 1.400 peak 478 spectrum 1 weight 0.10000E+01 volume 0.20159E-02 ppm1 8.085 ppm2 2.639 CV 1
ASSI { 479}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HG3 ))
3.200 1.300 1.300 peak 479 spectrum 1 weight 0.10000E+01 volume 0.36511E-02 ppm1 8.088 ppm2 1.314 CV 1
ASSI { 480}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HA ))
3.100 1.200 1.200 peak 480 spectrum 1 weight 0.10000E+01 volume 0.14520E-02 ppm1 7.839 ppm2 4.124 CV 1
ASSI { 481}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HG2 ))
3.300 1.400 1.400 peak 481 spectrum 1 weight 0.10000E+01 volume 0.79227E-03 ppm1 8.362 ppm2 1.504 CV 1
ASSI { 482}
(( segid " " and resid 87 and name HN ))
( segid " " and resid 86 and name HG2%)
1.700 0.400 0.500 peak 482 spectrum 1 weight 0.10000E+01 volume 0.36934E-01 ppm1 8.382 ppm2 0.907 CV 1
ASSI { 484}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB3 ))
3.500 1.600 1.600 peak 484 spectrum 1 weight 0.10000E+01 volume 0.26785E-02 ppm1 8.886 ppm2 3.128 CV 1
ASSI { 485}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 86 and name HD1%)
3.100 1.200 1.200 peak 485 spectrum 1 weight 0.10000E+01 volume 0.25374E-02 ppm1 8.242 ppm2 0.854 CV 1
ASSI { 486}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HB3 ))
2.500 0.800 0.800 peak 486 spectrum 1 weight 0.10000E+01 volume 0.53428E-02 ppm1 8.567 ppm2 1.958 CV 1
OR { 486}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HB2 ))
ASSI { 487}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HG3 ))
3.600 1.700 1.700 peak 487 spectrum 1 weight 0.10000E+01 volume 0.80632E-03 ppm1 8.567 ppm2 2.279 CV 1
OR { 487}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HG2 ))
ASSI { 488}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 51 and name HG2%)
3.700 3.700 2.300 peak 488 spectrum 1 weight 0.10000E+01 volume 0.15366E-02 ppm1 8.927 ppm2 1.180 CV 1
ASSI { 489}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HA ))
2.800 1.000 1.000 peak 489 spectrum 1 weight 0.10000E+01 volume 0.21991E-02 ppm1 8.928 ppm2 4.127 CV 1
ASSI { 490}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HG3 ))
2.700 2.700 3.300 peak 490 spectrum 1 weight 0.10000E+01 volume 0.37921E-02 ppm1 7.762 ppm2 1.332 CV 1
ASSI { 491}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 70 and name HA ))
3.500 1.500 1.500 peak 491 spectrum 1 weight 0.10000E+01 volume 0.15366E-02 ppm1 7.757 ppm2 3.954 CV 1
ASSI { 492}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 23 and name HA ))
3.300 1.400 1.400 peak 492 spectrum 1 weight 0.10000E+01 volume 0.14097E-02 ppm1 7.764 ppm2 4.480 CV 1
ASSI { 493}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HA ))
2.900 1.100 1.100 peak 493 spectrum 1 weight 0.10000E+01 volume 0.20864E-02 ppm1 7.764 ppm2 4.782 CV 1
ASSI { 494}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HA ))
2.900 1.000 1.000 peak 494 spectrum 1 weight 0.10000E+01 volume 0.20582E-02 ppm1 7.757 ppm2 4.925 CV 1
ASSI { 495}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HN ))
2.600 0.800 0.800 peak 495 spectrum 1 weight 0.10000E+01 volume 0.38767E-02 ppm1 7.764 ppm2 8.131 CV 1
ASSI { 496}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 69 and name HN ))
3.000 1.100 1.100 peak 496 spectrum 1 weight 0.10000E+01 volume 0.20440E-02 ppm1 7.757 ppm2 9.303 CV 1
ASSI { 497}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB3 ))
2.500 0.800 0.800 peak 497 spectrum 1 weight 0.10000E+01 volume 0.53850E-02 ppm1 7.550 ppm2 3.157 CV 1
ASSI { 498}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB2 ))
2.500 0.800 0.800 peak 498 spectrum 1 weight 0.10000E+01 volume 0.53710E-02 ppm1 7.550 ppm2 3.607 CV 1
ASSI { 500}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HB3 ))
3.000 1.100 1.100 peak 500 spectrum 1 weight 0.10000E+01 volume 0.20723E-02 ppm1 7.883 ppm2 1.684 CV 1
OR { 500}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HB2 ))
ASSI { 505}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 42 and name HD1%)
3.900 1.900 1.900 peak 505 spectrum 1 weight 0.10000E+01 volume 0.18749E-02 ppm1 8.602 ppm2 0.774 CV 1
ASSI { 507}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB3 ))
3.500 1.600 1.600 peak 507 spectrum 1 weight 0.10000E+01 volume 0.14379E-02 ppm1 8.602 ppm2 1.485 CV 1
ASSI { 509}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB2 ))
2.500 0.800 0.800 peak 509 spectrum 1 weight 0.10000E+01 volume 0.52018E-02 ppm1 8.601 ppm2 1.991 CV 1
ASSI { 510}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB3 ))
3.000 1.100 1.100 peak 510 spectrum 1 weight 0.10000E+01 volume 0.16493E-02 ppm1 8.602 ppm2 3.111 CV 1
ASSI { 511}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB2 ))
2.800 1.000 1.000 peak 511 spectrum 1 weight 0.10000E+01 volume 0.23119E-02 ppm1 8.601 ppm2 3.566 CV 1
ASSI { 512}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
2.400 0.700 0.700 peak 512 spectrum 1 weight 0.10000E+01 volume 0.44406E-02 ppm1 8.602 ppm2 3.921 CV 1
ASSI { 513}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HA ))
2.600 0.800 0.800 peak 513 spectrum 1 weight 0.10000E+01 volume 0.41304E-02 ppm1 8.061 ppm2 4.360 CV 1
ASSI { 514}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
3.100 1.200 1.200 peak 514 spectrum 1 weight 0.10000E+01 volume 0.14520E-02 ppm1 8.061 ppm2 3.996 CV 1
ASSI { 516}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 76 and name HB3 ))
4.100 2.100 1.900 peak 516 spectrum 1 weight 0.10000E+01 volume 0.12589E-02 ppm1 7.565 ppm2 2.240 CV 1
OR { 516}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 76 and name HG3 ))
ASSI { 517}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 45 and name HD1%)
3.400 1.400 1.400 peak 517 spectrum 1 weight 0.10000E+01 volume 0.19313E-02 ppm1 8.134 ppm2 0.858 CV 1
ASSI { 518}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 45 and name HG13))
2.700 0.900 0.900 peak 518 spectrum 1 weight 0.10000E+01 volume 0.14802E-02 ppm1 8.134 ppm2 1.210 CV 1
ASSI { 520}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 45 and name HG12))
3.500 1.500 1.500 peak 520 spectrum 1 weight 0.10000E+01 volume 0.31859E-02 ppm1 8.131 ppm2 1.941 CV 1
ASSI { 521}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HA1 ))
2.800 1.000 1.000 peak 521 spectrum 1 weight 0.10000E+01 volume 0.21851E-02 ppm1 8.134 ppm2 3.925 CV 1
ASSI { 525}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HB3 ))
3.600 1.600 1.600 peak 525 spectrum 1 weight 0.10000E+01 volume 0.13815E-02 ppm1 8.027 ppm2 1.844 CV 1
ASSI { 526}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB2 ))
2.900 1.000 1.000 peak 526 spectrum 1 weight 0.10000E+01 volume 0.20723E-02 ppm1 6.981 ppm2 1.871 CV 1
ASSI { 529}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HA ))
2.900 1.000 1.000 peak 529 spectrum 1 weight 0.10000E+01 volume 0.21568E-02 ppm1 9.287 ppm2 4.532 CV 1
ASSI { 530}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HB2 ))
4.200 2.200 1.800 peak 530 spectrum 1 weight 0.10000E+01 volume 0.96424E-03 ppm1 9.291 ppm2 0.120 CV 1
ASSI { 531}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HB2 ))
2.600 0.800 0.800 peak 531 spectrum 1 weight 0.10000E+01 volume 0.27208E-02 ppm1 8.379 ppm2 1.975 CV 1
ASSI { 532}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB ))
3.400 1.500 1.500 peak 532 spectrum 1 weight 0.10000E+01 volume 0.14097E-02 ppm1 7.667 ppm2 4.579 CV 1
ASSI { 533}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HB3 ))
2.800 1.000 1.000 peak 533 spectrum 1 weight 0.10000E+01 volume 0.28053E-02 ppm1 7.817 ppm2 2.013 CV 1
ASSI { 537}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HG2 ))
3.900 1.900 1.900 peak 537 spectrum 1 weight 0.10000E+01 volume 0.10164E-02 ppm1 7.220 ppm2 0.724 CV 1
ASSI { 538}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HB3 ))
3.200 1.300 1.300 peak 538 spectrum 1 weight 0.10000E+01 volume 0.12786E-02 ppm1 9.090 ppm2 3.117 CV 1
ASSI { 541}
(( segid " " and resid 62 and name HD1 ))
( segid " " and resid 14 and name HD% )
3.200 1.300 1.300 peak 541 spectrum 1 weight 0.10000E+01 volume 0.14661E-02 ppm1 10.205 ppm2 7.095 CV 1
ASSI { 542}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 25 and name HB3 ))
3.300 1.400 1.400 peak 542 spectrum 1 weight 0.10000E+01 volume 0.59771E-03 ppm1 7.988 ppm2 1.287 CV 1
ASSI { 543}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 65 and name HA1 ))
2.900 2.900 3.100 peak 543 spectrum 1 weight 0.10000E+01 volume 0.10813E-02 ppm1 6.981 ppm2 4.160 CV 1
ASSI { 544}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB2 ))
4.500 2.500 1.500 peak 544 spectrum 1 weight 0.10000E+01 volume 0.44829E-03 ppm1 7.217 ppm2 1.868 CV 1
ASSI { 1}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HG12))
2.600 0.800 0.800 peak 1 spectrum 1 weight 0.10000E+01 volume 0.25140E-02 ppm1 9.657 ppm2 1.884 CV 1
ASSI { 16}
(( segid " " and resid 41 and name HE1 ))
( segid " " and resid 73 and name HG2%)
4.700 2.800 1.300 peak 16 spectrum 1 weight 0.10000E+01 volume 0.56915E-03 ppm1 10.359 ppm2 0.794 CV 1
ASSI { 22}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HD2 ))
4.000 2.000 2.000 peak 22 spectrum 1 weight 0.10000E+01 volume 0.63307E-03 ppm1 9.654 ppm2 3.298 CV 1
ASSI { 25}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 7 and name HB3 ))
4.100 2.200 1.900 peak 25 spectrum 1 weight 0.10000E+01 volume 0.55393E-03 ppm1 9.895 ppm2 3.117 CV 1
ASSI { 26}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 28 and name HB3 ))
4.000 2.000 2.000 peak 26 spectrum 1 weight 0.10000E+01 volume 0.77611E-03 ppm1 9.655 ppm2 3.037 CV 1
ASSI { 32}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 75 and name HG2%)
4.500 2.500 1.500 peak 32 spectrum 1 weight 0.10000E+01 volume 0.29766E-03 ppm1 9.429 ppm2 0.489 CV 1
ASSI { 35}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 75 and name HG2%)
2.400 0.700 0.700 peak 35 spectrum 1 weight 0.10000E+01 volume 0.47784E-02 ppm1 7.953 ppm2 0.488 CV 1
ASSI { 36}
(( segid " " and resid 83 and name HE22))
( segid " " and resid 75 and name HG2%)
3.600 1.600 1.600 peak 36 spectrum 1 weight 0.10000E+01 volume 0.64220E-03 ppm1 6.683 ppm2 0.488 CV 1
ASSI { 37}
(( segid " " and resid 41 and name HZ2 ))
(( segid " " and resid 68 and name HD3 ))
3.100 1.200 1.200 peak 37 spectrum 1 weight 0.10000E+01 volume 0.17196E-02 ppm1 7.443 ppm2 0.360 CV 1
ASSI { 38}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 68 and name HD3 ))
2.800 1.000 1.000 peak 38 spectrum 1 weight 0.10000E+01 volume 0.15492E-02 ppm1 6.948 ppm2 0.360 CV 1
ASSI { 39}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 68 and name HD3 ))
4.100 2.100 1.900 peak 39 spectrum 1 weight 0.10000E+01 volume 0.52045E-03 ppm1 6.486 ppm2 0.359 CV 1
ASSI { 40}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 61 and name HB% )
5.400 3.700 0.600 peak 40 spectrum 1 weight 0.10000E+01 volume 0.41393E-03 ppm1 8.960 ppm2 0.146 CV 1
ASSI { 41}
(( segid " " and resid 62 and name HE1 ))
( segid " " and resid 61 and name HB% )
3.600 1.600 1.600 peak 41 spectrum 1 weight 0.10000E+01 volume 0.28122E-03 ppm1 8.187 ppm2 0.145 CV 1
ASSI { 42}
(( segid " " and resid 60 and name HN ))
( segid " " and resid 61 and name HB% )
4.900 3.100 1.100 peak 42 spectrum 1 weight 0.10000E+01 volume 0.45045E-03 ppm1 7.998 ppm2 0.145 CV 1
ASSI { 43}
(( segid " " and resid 62 and name HD2 ))
( segid " " and resid 61 and name HB% )
3.200 1.300 1.300 peak 43 spectrum 1 weight 0.10000E+01 volume 0.57219E-03 ppm1 7.949 ppm2 0.145 CV 1
ASSI { 45}
( segid " " and resid 14 and name HE% )
( segid " " and resid 61 and name HB% )
2.800 0.900 0.900 peak 45 spectrum 1 weight 0.10000E+01 volume 0.39262E-02 ppm1 7.260 ppm2 0.143 CV 1
ASSI { 46}
( segid " " and resid 14 and name HD% )
( segid " " and resid 61 and name HB% )
2.600 0.800 0.800 peak 46 spectrum 1 weight 0.10000E+01 volume 0.45045E-02 ppm1 7.101 ppm2 0.144 CV 1
ASSI { 50}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HB3 ))
4.200 2.200 1.800 peak 50 spectrum 1 weight 0.10000E+01 volume 0.10501E-02 ppm1 9.297 ppm2 0.053 CV 1
ASSI { 51}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 68 and name HB3 ))
4.200 2.200 1.800 peak 51 spectrum 1 weight 0.10000E+01 volume 0.86741E-03 ppm1 7.291 ppm2 0.053 CV 1
ASSI { 52}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HB3 ))
2.600 0.900 0.900 peak 52 spectrum 1 weight 0.10000E+01 volume 0.27636E-02 ppm1 7.232 ppm2 0.054 CV 1
ASSI { 53}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 68 and name HB3 ))
3.500 1.500 1.500 peak 53 spectrum 1 weight 0.10000E+01 volume 0.12783E-02 ppm1 6.487 ppm2 0.055 CV 1
ASSI { 61}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HB3 ))
3.100 1.200 1.200 peak 61 spectrum 1 weight 0.10000E+01 volume 0.12783E-02 ppm1 9.098 ppm2 1.748 CV 1
OR { 61}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HB2 ))
ASSI { 62}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 78 and name HG2 ))
5.100 3.200 0.900 peak 62 spectrum 1 weight 0.10000E+01 volume 0.24988E-03 ppm1 9.429 ppm2 1.733 CV 1
ASSI { 66}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HG ))
3.400 1.500 1.500 peak 66 spectrum 1 weight 0.10000E+01 volume 0.19570E-02 ppm1 8.455 ppm2 1.707 CV 1
ASSI { 68}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HB3 ))
3.000 1.100 1.100 peak 68 spectrum 1 weight 0.10000E+01 volume 0.31045E-02 ppm1 9.123 ppm2 1.671 CV 1
ASSI { 73}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HG3 ))
4.400 2.400 1.600 peak 73 spectrum 1 weight 0.10000E+01 volume 0.47176E-03 ppm1 9.124 ppm2 1.546 CV 1
ASSI { 75}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HB3 ))
3.200 1.300 1.300 peak 75 spectrum 1 weight 0.10000E+01 volume 0.10379E-02 ppm1 8.455 ppm2 1.528 CV 1
ASSI { 76}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HG13))
2.700 0.900 0.900 peak 76 spectrum 1 weight 0.10000E+01 volume 0.23223E-02 ppm1 8.708 ppm2 1.518 CV 1
ASSI { 80}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 44 and name HB% )
3.400 1.400 1.400 peak 80 spectrum 1 weight 0.10000E+01 volume 0.36219E-02 ppm1 8.369 ppm2 1.500 CV 1
ASSI { 85}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HG12))
5.900 4.300 0.100 peak 85 spectrum 1 weight 0.10000E+01 volume 0.20453E-03 ppm1 8.385 ppm2 1.415 CV 1
ASSI { 88}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HB3 ))
2.700 0.900 0.900 peak 88 spectrum 1 weight 0.10000E+01 volume 0.30740E-02 ppm1 8.939 ppm2 1.383 CV 1
ASSI { 91}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 43 and name HG2%)
3.300 1.300 1.300 peak 91 spectrum 1 weight 0.10000E+01 volume 0.32566E-02 ppm1 8.364 ppm2 1.292 CV 1
ASSI { 95}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 48 and name HG2%)
3.700 1.700 1.700 peak 95 spectrum 1 weight 0.10000E+01 volume 0.10257E-02 ppm1 8.936 ppm2 1.169 CV 1
ASSI { 97}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 37 and name HD1%)
4.600 2.700 1.400 peak 97 spectrum 1 weight 0.10000E+01 volume 0.36827E-03 ppm1 8.893 ppm2 1.150 CV 1
ASSI { 100}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 84 and name HG13))
5.400 3.600 0.600 peak 100 spectrum 1 weight 0.10000E+01 volume 0.30345E-03 ppm1 8.369 ppm2 1.092 CV 1
ASSI { 101}
(( segid " " and resid 57 and name HN ))
( segid " " and resid 56 and name HD1%)
3.900 1.900 1.900 peak 101 spectrum 1 weight 0.10000E+01 volume 0.16192E-02 ppm1 9.124 ppm2 1.065 CV 1
ASSI { 104}
(( segid " " and resid 57 and name HN ))
( segid " " and resid 56 and name HD2%)
3.900 1.900 1.900 peak 104 spectrum 1 weight 0.10000E+01 volume 0.11078E-02 ppm1 9.124 ppm2 0.988 CV 1
ASSI { 110}
(( segid " " and resid 81 and name HN ))
( segid " " and resid 80 and name HG2%)
3.400 1.400 1.400 peak 110 spectrum 1 weight 0.10000E+01 volume 0.33479E-02 ppm1 8.632 ppm2 0.861 CV 1
ASSI { 111}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 80 and name HG2%)
3.700 3.700 2.300 peak 111 spectrum 1 weight 0.10000E+01 volume 0.21183E-02 ppm1 8.334 ppm2 0.862 CV 1
ASSI { 114}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 42 and name HD1%)
2.900 1.000 1.000 peak 114 spectrum 1 weight 0.10000E+01 volume 0.25931E-02 ppm1 8.938 ppm2 0.764 CV 1
ASSI { 115}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 42 and name HD1%)
5.200 3.400 0.800 peak 115 spectrum 1 weight 0.10000E+01 volume 0.23953E-03 ppm1 8.829 ppm2 0.774 CV 1
ASSI { 117}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HG3 ))
3.800 1.800 1.800 peak 117 spectrum 1 weight 0.10000E+01 volume 0.61480E-03 ppm1 9.298 ppm2 0.681 CV 1
ASSI { 119}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 42 and name HD2%)
3.300 1.400 1.400 peak 119 spectrum 1 weight 0.10000E+01 volume 0.12113E-02 ppm1 8.610 ppm2 0.634 CV 1
ASSI { 130}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HB2 ))
4.500 2.500 1.500 peak 130 spectrum 1 weight 0.10000E+01 volume 0.81873E-03 ppm1 9.329 ppm2 2.840 CV 1
ASSI { 131}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HB2 ))
2.800 1.000 1.000 peak 131 spectrum 1 weight 0.10000E+01 volume 0.20423E-02 ppm1 8.388 ppm2 2.842 CV 1
ASSI { 134}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HB3 ))
4.500 2.600 1.500 peak 134 spectrum 1 weight 0.10000E+01 volume 0.37740E-03 ppm1 8.295 ppm2 2.812 CV 1
OR { 134}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HB2 ))
ASSI { 135}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HB3 ))
3.600 1.600 1.600 peak 135 spectrum 1 weight 0.10000E+01 volume 0.12813E-02 ppm1 8.253 ppm2 2.804 CV 1
ASSI { 140}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HB3 ))
3.400 1.500 1.500 peak 140 spectrum 1 weight 0.10000E+01 volume 0.35915E-02 ppm1 8.387 ppm2 2.584 CV 1
ASSI { 144}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 58 and name HB ))
3.800 1.800 1.800 peak 144 spectrum 1 weight 0.10000E+01 volume 0.51436E-03 ppm1 9.333 ppm2 2.483 CV 1
ASSI { 145}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 83 and name HG2 ))
4.700 2.700 1.300 peak 145 spectrum 1 weight 0.10000E+01 volume 0.13483E-03 ppm1 9.428 ppm2 2.469 CV 1
ASSI { 147}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HG3 ))
4.200 2.200 1.800 peak 147 spectrum 1 weight 0.10000E+01 volume 0.10805E-02 ppm1 8.830 ppm2 2.459 CV 1
ASSI { 148}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HG2 ))
3.700 1.700 1.700 peak 148 spectrum 1 weight 0.10000E+01 volume 0.85527E-03 ppm1 8.436 ppm2 2.443 CV 1
OR { 148}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HG3 ))
ASSI { 149}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 63 and name HB3 ))
4.100 2.100 1.900 peak 149 spectrum 1 weight 0.10000E+01 volume 0.36827E-03 ppm1 8.524 ppm2 2.409 CV 1
ASSI { 150}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HG2 ))
3.700 1.700 1.700 peak 150 spectrum 1 weight 0.10000E+01 volume 0.16161E-02 ppm1 8.194 ppm2 2.366 CV 1
ASSI { 151}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HG2 ))
4.600 2.600 1.400 peak 151 spectrum 1 weight 0.10000E+01 volume 0.42610E-03 ppm1 9.429 ppm2 2.360 CV 1
ASSI { 152}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HG2 ))
3.900 1.900 1.900 peak 152 spectrum 1 weight 0.10000E+01 volume 0.10805E-02 ppm1 8.991 ppm2 2.353 CV 1
ASSI { 153}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HG2 ))
2.700 0.900 0.900 peak 153 spectrum 1 weight 0.10000E+01 volume 0.40175E-02 ppm1 8.935 ppm2 2.343 CV 1
OR { 153}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HG3 ))
ASSI { 154}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HG2 ))
3.200 1.300 1.300 peak 154 spectrum 1 weight 0.10000E+01 volume 0.10013E-02 ppm1 8.287 ppm2 2.348 CV 1
ASSI { 158}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HG3 ))
4.000 2.000 2.000 peak 158 spectrum 1 weight 0.10000E+01 volume 0.83093E-03 ppm1 8.196 ppm2 2.283 CV 1
ASSI { 159}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HG2 ))
3.400 1.500 1.500 peak 159 spectrum 1 weight 0.10000E+01 volume 0.14244E-02 ppm1 8.703 ppm2 2.272 CV 1
OR { 159}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 70 and name HG3 ))
ASSI { 160}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HG2 ))
4.900 3.000 1.100 peak 160 spectrum 1 weight 0.10000E+01 volume 0.36827E-03 ppm1 8.455 ppm2 2.266 CV 1
ASSI { 161}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HG2 ))
3.500 1.500 1.500 peak 161 spectrum 1 weight 0.10000E+01 volume 0.23040E-02 ppm1 8.365 ppm2 2.261 CV 1
ASSI { 162}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HG3 ))
4.600 2.700 1.400 peak 162 spectrum 1 weight 0.10000E+01 volume 0.63611E-03 ppm1 8.994 ppm2 2.238 CV 1
ASSI { 163}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HG3 ))
3.800 1.800 1.800 peak 163 spectrum 1 weight 0.10000E+01 volume 0.11535E-02 ppm1 9.428 ppm2 2.228 CV 1
ASSI { 167}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HG3 ))
3.700 1.700 1.700 peak 167 spectrum 1 weight 0.10000E+01 volume 0.11353E-02 ppm1 8.385 ppm2 2.207 CV 1
ASSI { 170}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HB2 ))
3.900 1.900 1.900 peak 170 spectrum 1 weight 0.10000E+01 volume 0.12722E-02 ppm1 8.993 ppm2 2.157 CV 1
OR { 170}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HB3 ))
ASSI { 173}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HB2 ))
2.600 0.900 0.900 peak 173 spectrum 1 weight 0.10000E+01 volume 0.23649E-02 ppm1 8.196 ppm2 2.093 CV 1
ASSI { 175}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HB2 ))
3.200 1.200 1.200 peak 175 spectrum 1 weight 0.10000E+01 volume 0.18566E-02 ppm1 8.935 ppm2 2.074 CV 1
ASSI { 176}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HB3 ))
3.700 1.700 1.700 peak 176 spectrum 1 weight 0.10000E+01 volume 0.97697E-03 ppm1 8.436 ppm2 2.078 CV 1
ASSI { 179}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HD2 ))
2.500 2.500 3.500 peak 179 spectrum 1 weight 0.10000E+01 volume 0.25353E-01 ppm1 8.703 ppm2 2.021 CV 1
ASSI { 182}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HB3 ))
3.200 1.200 1.200 peak 182 spectrum 1 weight 0.10000E+01 volume 0.29127E-02 ppm1 8.196 ppm2 2.013 CV 1
ASSI { 189}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HB3 ))
3.800 1.800 1.800 peak 189 spectrum 1 weight 0.10000E+01 volume 0.92829E-03 ppm1 8.195 ppm2 1.927 CV 1
ASSI { 190}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 78 and name HB3 ))
3.800 1.800 1.800 peak 190 spectrum 1 weight 0.10000E+01 volume 0.42914E-03 ppm1 9.428 ppm2 1.906 CV 1
ASSI { 191}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 78 and name HB3 ))
4.500 2.600 1.500 peak 191 spectrum 1 weight 0.10000E+01 volume 0.53263E-03 ppm1 8.984 ppm2 1.913 CV 1
ASSI { 193}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HB3 ))
4.300 2.300 1.700 peak 193 spectrum 1 weight 0.10000E+01 volume 0.56610E-03 ppm1 8.456 ppm2 1.909 CV 1
ASSI { 195}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HB3 ))
3.900 1.900 1.900 peak 195 spectrum 1 weight 0.10000E+01 volume 0.10165E-02 ppm1 8.331 ppm2 1.911 CV 1
ASSI { 198}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HB3 ))
2.300 0.600 0.600 peak 198 spectrum 1 weight 0.10000E+01 volume 0.84307E-02 ppm1 8.574 ppm2 1.870 CV 1
OR { 198}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HB2 ))
ASSI { 199}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HG ))
3.900 1.900 1.900 peak 199 spectrum 1 weight 0.10000E+01 volume 0.88871E-03 ppm1 8.890 ppm2 1.850 CV 1
ASSI { 200}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HG ))
1.900 0.400 0.400 peak 200 spectrum 1 weight 0.10000E+01 volume 0.73047E-02 ppm1 8.609 ppm2 1.853 CV 1
ASSI { 202}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB ))
2.500 0.800 0.800 peak 202 spectrum 1 weight 0.10000E+01 volume 0.61784E-02 ppm1 8.708 ppm2 1.813 CV 1
ASSI { 203}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HG ))
3.200 1.300 1.300 peak 203 spectrum 1 weight 0.10000E+01 volume 0.21122E-02 ppm1 9.124 ppm2 1.802 CV 1
OR { 203}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HB2 ))
ASSI { 206}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 77 and name HA ))
3.000 1.100 1.100 peak 206 spectrum 1 weight 0.10000E+01 volume 0.25566E-02 ppm1 8.335 ppm2 5.039 CV 1
ASSI { 210}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 85 and name HA ))
2.900 1.000 1.000 peak 210 spectrum 1 weight 0.10000E+01 volume 0.18931E-02 ppm1 8.253 ppm2 5.036 CV 1
ASSI { 211}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 63 and name HA ))
4.300 2.300 1.700 peak 211 spectrum 1 weight 0.10000E+01 volume 0.43523E-03 ppm1 7.710 ppm2 5.025 CV 1
ASSI { 214}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 72 and name HA ))
3.800 1.800 1.800 peak 214 spectrum 1 weight 0.10000E+01 volume 0.76391E-03 ppm1 8.554 ppm2 4.922 CV 1
ASSI { 215}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 72 and name HA ))
4.000 2.000 2.000 peak 215 spectrum 1 weight 0.10000E+01 volume 0.11018E-02 ppm1 8.370 ppm2 4.925 CV 1
ASSI { 218}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 72 and name HA ))
4.100 2.100 1.900 peak 218 spectrum 1 weight 0.10000E+01 volume 0.47176E-03 ppm1 7.712 ppm2 4.926 CV 1
ASSI { 219}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
2.700 0.900 0.900 peak 219 spectrum 1 weight 0.10000E+01 volume 0.38349E-02 ppm1 8.136 ppm2 4.825 CV 1
ASSI { 220}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HA ))
2.800 1.000 1.000 peak 220 spectrum 1 weight 0.10000E+01 volume 0.21031E-02 ppm1 7.948 ppm2 4.831 CV 1
ASSI { 226}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 27 and name HA ))
3.200 1.200 1.200 peak 226 spectrum 1 weight 0.10000E+01 volume 0.13574E-02 ppm1 8.386 ppm2 4.653 CV 1
ASSI { 233}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HA ))
2.800 1.000 1.000 peak 233 spectrum 1 weight 0.10000E+01 volume 0.28853E-02 ppm1 7.766 ppm2 4.609 CV 1
OR { 233}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HB ))
ASSI { 239}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HA ))
2.100 0.500 0.500 peak 239 spectrum 1 weight 0.10000E+01 volume 0.11992E-01 ppm1 8.384 ppm2 4.495 CV 1
ASSI { 243}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HA ))
2.700 0.900 0.900 peak 243 spectrum 1 weight 0.10000E+01 volume 0.52654E-02 ppm1 8.135 ppm2 4.477 CV 1
ASSI { 248}
(( segid " " and resid 62 and name HE1 ))
(( segid " " and resid 12 and name HA ))
2.700 0.900 0.900 peak 248 spectrum 1 weight 0.10000E+01 volume 0.33175E-02 ppm1 8.187 ppm2 4.385 CV 1
ASSI { 250}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HA ))
3.700 1.700 1.700 peak 250 spectrum 1 weight 0.10000E+01 volume 0.56306E-03 ppm1 8.893 ppm2 4.348 CV 1
ASSI { 254}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 14 and name HA ))
2.400 0.700 0.700 peak 254 spectrum 1 weight 0.10000E+01 volume 0.65437E-02 ppm1 8.953 ppm2 4.326 CV 1
ASSI { 258}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA ))
3.500 1.500 1.500 peak 258 spectrum 1 weight 0.10000E+01 volume 0.91305E-03 ppm1 8.051 ppm2 4.313 CV 1
ASSI { 262}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HA ))
3.000 1.100 1.100 peak 262 spectrum 1 weight 0.10000E+01 volume 0.20361E-02 ppm1 8.195 ppm2 4.289 CV 1
ASSI { 264}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 56 and name HA ))
4.100 2.100 1.900 peak 264 spectrum 1 weight 0.10000E+01 volume 0.96787E-03 ppm1 8.431 ppm2 4.277 CV 1
ASSI { 267}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HA ))
2.800 1.000 1.000 peak 267 spectrum 1 weight 0.10000E+01 volume 0.25627E-02 ppm1 8.001 ppm2 4.232 CV 1
ASSI { 275}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 36 and name HA ))
3.200 1.300 1.300 peak 275 spectrum 1 weight 0.10000E+01 volume 0.13970E-02 ppm1 8.830 ppm2 4.170 CV 1
ASSI { 276}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HA1 ))
3.800 1.800 1.800 peak 276 spectrum 1 weight 0.10000E+01 volume 0.88264E-03 ppm1 8.523 ppm2 4.169 CV 1
ASSI { 277}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HA ))
2.400 0.700 0.700 peak 277 spectrum 1 weight 0.10000E+01 volume 0.54480E-02 ppm1 8.639 ppm2 4.163 CV 1
ASSI { 278}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HA ))
2.700 0.900 0.900 peak 278 spectrum 1 weight 0.10000E+01 volume 0.45958E-02 ppm1 7.870 ppm2 4.145 CV 1
ASSI { 279}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 44 and name HA ))
3.800 1.800 1.800 peak 279 spectrum 1 weight 0.10000E+01 volume 0.56002E-03 ppm1 7.705 ppm2 4.146 CV 1
ASSI { 280}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HA ))
2.500 0.800 0.800 peak 280 spectrum 1 weight 0.10000E+01 volume 0.76391E-02 ppm1 9.093 ppm2 4.138 CV 1
ASSI { 284}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HA ))
3.000 1.100 1.100 peak 284 spectrum 1 weight 0.10000E+01 volume 0.16892E-02 ppm1 8.195 ppm2 4.135 CV 1
ASSI { 294}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HA ))
3.700 1.800 1.800 peak 294 spectrum 1 weight 0.10000E+01 volume 0.71220E-03 ppm1 7.870 ppm2 4.052 CV 1
ASSI { 295}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 43 and name HA ))
3.100 1.200 1.200 peak 295 spectrum 1 weight 0.10000E+01 volume 0.21092E-02 ppm1 7.701 ppm2 4.056 CV 1
ASSI { 296}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 39 and name HA ))
3.800 1.800 1.800 peak 296 spectrum 1 weight 0.10000E+01 volume 0.59046E-03 ppm1 8.892 ppm2 3.997 CV 1
ASSI { 298}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 39 and name HA ))
3.700 1.700 1.700 peak 298 spectrum 1 weight 0.10000E+01 volume 0.15644E-02 ppm1 8.610 ppm2 3.994 CV 1
ASSI { 299}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 39 and name HA ))
3.500 3.500 2.500 peak 299 spectrum 1 weight 0.10000E+01 volume 0.36523E-03 ppm1 8.368 ppm2 3.991 CV 1
ASSI { 303}
(( segid " " and resid 62 and name HE1 ))
(( segid " " and resid 62 and name HA ))
5.300 3.600 0.700 peak 303 spectrum 1 weight 0.10000E+01 volume 0.24958E-03 ppm1 8.186 ppm2 3.965 CV 1
ASSI { 305}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HD2 ))
2.800 1.000 1.000 peak 305 spectrum 1 weight 0.10000E+01 volume 0.16344E-02 ppm1 8.330 ppm2 3.955 CV 1
ASSI { 315}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HA ))
3.500 1.500 1.500 peak 315 spectrum 1 weight 0.10000E+01 volume 0.73654E-03 ppm1 8.367 ppm2 3.908 CV 1
ASSI { 316}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HA ))
2.600 0.800 0.800 peak 316 spectrum 1 weight 0.10000E+01 volume 0.31957E-02 ppm1 8.561 ppm2 3.892 CV 1
ASSI { 317}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HA2 ))
2.900 1.100 1.100 peak 317 spectrum 1 weight 0.10000E+01 volume 0.59046E-02 ppm1 7.762 ppm2 3.890 CV 1
ASSI { 322}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
2.600 0.900 0.900 peak 322 spectrum 1 weight 0.10000E+01 volume 0.32870E-02 ppm1 8.708 ppm2 3.855 CV 1
ASSI { 323}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HA ))
3.600 1.600 1.600 peak 323 spectrum 1 weight 0.10000E+01 volume 0.73350E-03 ppm1 8.287 ppm2 3.801 CV 1
ASSI { 324}
(( segid " " and resid 62 and name HE1 ))
(( segid " " and resid 76 and name HA ))
3.700 1.700 1.700 peak 324 spectrum 1 weight 0.10000E+01 volume 0.87354E-03 ppm1 8.187 ppm2 3.802 CV 1
ASSI { 326}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HA ))
3.200 1.300 1.300 peak 326 spectrum 1 weight 0.10000E+01 volume 0.14305E-02 ppm1 7.770 ppm2 3.799 CV 1
ASSI { 330}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 8 and name HA2 ))
3.800 1.800 1.800 peak 330 spectrum 1 weight 0.10000E+01 volume 0.68786E-03 ppm1 9.119 ppm2 3.610 CV 1
ASSI { 332}
(( segid " " and resid 62 and name HE1 ))
(( segid " " and resid 12 and name HB2 ))
3.600 1.700 1.700 peak 332 spectrum 1 weight 0.10000E+01 volume 0.71826E-03 ppm1 8.187 ppm2 3.603 CV 1
ASSI { 336}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 38 and name HA ))
3.500 1.600 1.600 peak 336 spectrum 1 weight 0.10000E+01 volume 0.10287E-02 ppm1 8.891 ppm2 3.490 CV 1
ASSI { 338}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 38 and name HA ))
4.900 3.000 1.100 peak 338 spectrum 1 weight 0.10000E+01 volume 0.27088E-03 ppm1 8.609 ppm2 3.489 CV 1
ASSI { 340}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HD3 ))
4.200 2.200 1.800 peak 340 spectrum 1 weight 0.10000E+01 volume 0.57219E-03 ppm1 8.334 ppm2 3.402 CV 1
ASSI { 341}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 78 and name HD3 ))
3.900 1.900 1.900 peak 341 spectrum 1 weight 0.10000E+01 volume 0.50219E-03 ppm1 8.285 ppm2 3.403 CV 1
ASSI { 344}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HD2 ))
4.600 2.600 1.400 peak 344 spectrum 1 weight 0.10000E+01 volume 0.42914E-03 ppm1 7.825 ppm2 3.388 CV 1
OR { 344}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HD3 ))
ASSI { 353}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 28 and name HA ))
2.300 0.700 0.700 peak 353 spectrum 1 weight 0.10000E+01 volume 0.47784E-02 ppm1 7.216 ppm2 5.086 CV 1
ASSI { 354}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 77 and name HA ))
3.000 1.200 1.200 peak 354 spectrum 1 weight 0.10000E+01 volume 0.23314E-02 ppm1 7.268 ppm2 5.038 CV 1
ASSI { 355}
(( segid " " and resid 14 and name HZ ))
(( segid " " and resid 77 and name HA ))
2.700 0.900 0.900 peak 355 spectrum 1 weight 0.10000E+01 volume 0.35001E-02 ppm1 7.133 ppm2 5.039 CV 1
ASSI { 356}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 63 and name HA ))
3.000 1.100 1.100 peak 356 spectrum 1 weight 0.10000E+01 volume 0.24714E-02 ppm1 7.289 ppm2 5.026 CV 1
ASSI { 358}
(( segid " " and resid 83 and name HE22))
(( segid " " and resid 63 and name HA ))
3.400 1.400 1.400 peak 358 spectrum 1 weight 0.10000E+01 volume 0.82783E-03 ppm1 6.683 ppm2 5.026 CV 1
ASSI { 359}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 59 and name HA ))
4.000 2.000 2.000 peak 359 spectrum 1 weight 0.10000E+01 volume 0.45958E-03 ppm1 7.078 ppm2 4.943 CV 1
ASSI { 361}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 72 and name HA ))
4.600 2.600 1.400 peak 361 spectrum 1 weight 0.10000E+01 volume 0.62393E-03 ppm1 7.292 ppm2 4.926 CV 1
ASSI { 362}
(( segid " " and resid 9 and name HZ ))
(( segid " " and resid 75 and name HA ))
2.900 1.100 1.100 peak 362 spectrum 1 weight 0.10000E+01 volume 0.17927E-02 ppm1 6.982 ppm2 4.833 CV 1
ASSI { 363}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 75 and name HA ))
3.400 1.500 1.500 peak 363 spectrum 1 weight 0.10000E+01 volume 0.18535E-02 ppm1 6.891 ppm2 4.828 CV 1
ASSI { 364}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 27 and name HA ))
2.900 1.100 1.100 peak 364 spectrum 1 weight 0.10000E+01 volume 0.25688E-02 ppm1 6.880 ppm2 4.644 CV 1
ASSI { 365}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 7 and name HA ))
3.000 1.100 1.100 peak 365 spectrum 1 weight 0.10000E+01 volume 0.17896E-02 ppm1 7.077 ppm2 4.624 CV 1
ASSI { 367}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 18 and name HA ))
2.900 1.000 1.000 peak 367 spectrum 1 weight 0.10000E+01 volume 0.33479E-02 ppm1 7.162 ppm2 4.598 CV 1
ASSI { 369}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HA ))
2.800 1.000 1.000 peak 369 spectrum 1 weight 0.10000E+01 volume 0.28427E-02 ppm1 6.920 ppm2 4.602 CV 1
ASSI { 370}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 18 and name HA ))
3.500 1.600 1.600 peak 370 spectrum 1 weight 0.10000E+01 volume 0.31349E-03 ppm1 6.790 ppm2 4.596 CV 1
ASSI { 373}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 6 and name HA ))
3.800 1.800 1.800 peak 373 spectrum 1 weight 0.10000E+01 volume 0.66048E-03 ppm1 7.078 ppm2 4.477 CV 1
ASSI { 374}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 23 and name HA ))
4.300 2.300 1.700 peak 374 spectrum 1 weight 0.10000E+01 volume 0.31349E-03 ppm1 6.793 ppm2 4.480 CV 1
ASSI { 375}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HA ))
2.900 1.100 1.100 peak 375 spectrum 1 weight 0.10000E+01 volume 0.23101E-02 ppm1 7.558 ppm2 4.385 CV 1
ASSI { 377}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 60 and name HB2 ))
4.900 3.000 1.100 peak 377 spectrum 1 weight 0.10000E+01 volume 0.35001E-03 ppm1 7.288 ppm2 4.372 CV 1
ASSI { 378}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 60 and name HB2 ))
2.600 2.600 3.400 peak 378 spectrum 1 weight 0.10000E+01 volume 0.53871E-02 ppm1 7.220 ppm2 4.373 CV 1
ASSI { 380}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 60 and name HB2 ))
3.000 1.200 1.200 peak 380 spectrum 1 weight 0.10000E+01 volume 0.16131E-02 ppm1 6.486 ppm2 4.374 CV 1
ASSI { 381}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 14 and name HA ))
3.400 1.400 1.400 peak 381 spectrum 1 weight 0.10000E+01 volume 0.41393E-03 ppm1 7.265 ppm2 4.347 CV 1
ASSI { 382}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 15 and name HA ))
3.200 1.300 1.300 peak 382 spectrum 1 weight 0.10000E+01 volume 0.11535E-02 ppm1 7.161 ppm2 4.354 CV 1
ASSI { 383}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 14 and name HA ))
2.700 0.900 0.900 peak 383 spectrum 1 weight 0.10000E+01 volume 0.51132E-02 ppm1 7.101 ppm2 4.342 CV 1
ASSI { 384}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA ))
3.000 1.200 1.200 peak 384 spectrum 1 weight 0.10000E+01 volume 0.16861E-02 ppm1 7.558 ppm2 4.308 CV 1
ASSI { 387}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 60 and name HA ))
3.800 1.800 1.800 peak 387 spectrum 1 weight 0.10000E+01 volume 0.49306E-03 ppm1 6.369 ppm2 4.241 CV 1
ASSI { 388}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 60 and name HA ))
2.400 0.700 0.700 peak 388 spectrum 1 weight 0.10000E+01 volume 0.52654E-02 ppm1 7.292 ppm2 4.240 CV 1
ASSI { 389}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 60 and name HA ))
3.200 1.300 1.300 peak 389 spectrum 1 weight 0.10000E+01 volume 0.12844E-02 ppm1 7.217 ppm2 4.240 CV 1
ASSI { 390}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 60 and name HA ))
2.600 0.800 0.800 peak 390 spectrum 1 weight 0.10000E+01 volume 0.46871E-02 ppm1 6.486 ppm2 4.240 CV 1
ASSI { 393}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HA ))
2.500 2.500 3.500 peak 393 spectrum 1 weight 0.10000E+01 volume 0.66655E-02 ppm1 7.530 ppm2 4.197 CV 1
ASSI { 397}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HA ))
2.300 0.700 0.700 peak 397 spectrum 1 weight 0.10000E+01 volume 0.78832E-02 ppm1 7.485 ppm2 4.134 CV 1
ASSI { 400}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 73 and name HA ))
3.200 1.300 1.300 peak 400 spectrum 1 weight 0.10000E+01 volume 0.14244E-02 ppm1 7.601 ppm2 4.063 CV 1
ASSI { 403}
(( segid " " and resid 63 and name HZ ))
(( segid " " and resid 73 and name HA ))
4.000 2.000 2.000 peak 403 spectrum 1 weight 0.10000E+01 volume 0.84307E-03 ppm1 6.717 ppm2 4.063 CV 1
ASSI { 404}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 35 and name HA ))
4.400 2.400 1.600 peak 404 spectrum 1 weight 0.10000E+01 volume 0.26570E-03 ppm1 6.610 ppm2 4.051 CV 1
ASSI { 405}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 9 and name HA ))
3.000 1.100 1.100 peak 405 spectrum 1 weight 0.10000E+01 volume 0.20514E-02 ppm1 6.648 ppm2 4.050 CV 1
ASSI { 408}
(( segid " " and resid 14 and name HZ ))
(( segid " " and resid 78 and name HD2 ))
2.700 0.900 0.900 peak 408 spectrum 1 weight 0.10000E+01 volume 0.25566E-02 ppm1 7.133 ppm2 3.961 CV 1
ASSI { 412}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HA ))
3.400 1.400 1.400 peak 412 spectrum 1 weight 0.10000E+01 volume 0.12296E-02 ppm1 6.368 ppm2 3.918 CV 1
ASSI { 413}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HA ))
2.000 0.500 0.500 peak 413 spectrum 1 weight 0.10000E+01 volume 0.73350E-02 ppm1 6.957 ppm2 3.891 CV 1
ASSI { 414}
(( segid " " and resid 83 and name HE22))
(( segid " " and resid 83 and name HA ))
4.200 2.200 1.800 peak 414 spectrum 1 weight 0.10000E+01 volume 0.62089E-03 ppm1 6.682 ppm2 3.890 CV 1
ASSI { 416}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 45 and name HA ))
4.700 2.800 1.300 peak 416 spectrum 1 weight 0.10000E+01 volume 0.40784E-03 ppm1 6.650 ppm2 3.867 CV 1
ASSI { 417}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 30 and name HA ))
2.900 1.100 1.100 peak 417 spectrum 1 weight 0.10000E+01 volume 0.18475E-02 ppm1 7.523 ppm2 3.848 CV 1
ASSI { 418}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 68 and name HA ))
3.100 1.200 1.200 peak 418 spectrum 1 weight 0.10000E+01 volume 0.21609E-02 ppm1 7.292 ppm2 3.854 CV 1
ASSI { 422}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 76 and name HA ))
2.600 0.900 0.900 peak 422 spectrum 1 weight 0.10000E+01 volume 0.31653E-02 ppm1 6.893 ppm2 3.802 CV 1
ASSI { 424}
(( segid " " and resid 9 and name HZ ))
(( segid " " and resid 76 and name HD3 ))
3.000 1.100 1.100 peak 424 spectrum 1 weight 0.10000E+01 volume 0.12296E-02 ppm1 6.982 ppm2 3.715 CV 1
ASSI { 425}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 34 and name HD2 ))
3.900 1.900 1.900 peak 425 spectrum 1 weight 0.10000E+01 volume 0.70309E-03 ppm1 6.606 ppm2 3.653 CV 1
ASSI { 428}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 41 and name HB2 ))
2.900 1.100 1.100 peak 428 spectrum 1 weight 0.10000E+01 volume 0.14944E-02 ppm1 7.601 ppm2 3.583 CV 1
ASSI { 429}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 41 and name HB2 ))
3.700 1.700 1.700 peak 429 spectrum 1 weight 0.10000E+01 volume 0.26449E-02 ppm1 7.524 ppm2 3.580 CV 1
ASSI { 430}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 38 and name HA ))
3.900 1.900 1.900 peak 430 spectrum 1 weight 0.10000E+01 volume 0.43219E-03 ppm1 7.602 ppm2 3.488 CV 1
ASSI { 432}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 28 and name HB2 ))
2.500 0.800 0.800 peak 432 spectrum 1 weight 0.10000E+01 volume 0.39871E-02 ppm1 7.216 ppm2 3.492 CV 1
ASSI { 433}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 28 and name HB2 ))
3.700 1.700 1.700 peak 433 spectrum 1 weight 0.10000E+01 volume 0.61480E-03 ppm1 7.023 ppm2 3.491 CV 1
ASSI { 434}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 28 and name HB2 ))
3.200 1.300 1.300 peak 434 spectrum 1 weight 0.10000E+01 volume 0.12813E-02 ppm1 6.948 ppm2 3.491 CV 1
ASSI { 435}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 78 and name HD3 ))
4.000 2.000 2.000 peak 435 spectrum 1 weight 0.10000E+01 volume 0.72440E-03 ppm1 7.263 ppm2 3.407 CV 1
ASSI { 436}
(( segid " " and resid 14 and name HZ ))
(( segid " " and resid 78 and name HD3 ))
3.600 1.600 1.600 peak 436 spectrum 1 weight 0.10000E+01 volume 0.10865E-02 ppm1 7.133 ppm2 3.404 CV 1
ASSI { 439}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 10 and name HD2 ))
4.400 2.400 1.600 peak 439 spectrum 1 weight 0.10000E+01 volume 0.66958E-03 ppm1 7.577 ppm2 3.329 CV 1
ASSI { 440}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 10 and name HD2 ))
3.100 1.200 1.200 peak 440 spectrum 1 weight 0.10000E+01 volume 0.77308E-03 ppm1 6.648 ppm2 3.328 CV 1
ASSI { 441}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 60 and name HB3 ))
4.900 3.000 1.100 peak 441 spectrum 1 weight 0.10000E+01 volume 0.51741E-03 ppm1 7.292 ppm2 3.321 CV 1
ASSI { 443}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 60 and name HB3 ))
3.400 1.500 1.500 peak 443 spectrum 1 weight 0.10000E+01 volume 0.20544E-02 ppm1 6.486 ppm2 3.320 CV 1
ASSI { 445}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 14 and name HB2 ))
4.500 2.500 1.500 peak 445 spectrum 1 weight 0.10000E+01 volume 0.77004E-03 ppm1 7.264 ppm2 3.182 CV 1
ASSI { 448}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 18 and name HB2 ))
2.500 0.800 0.800 peak 448 spectrum 1 weight 0.10000E+01 volume 0.51436E-02 ppm1 7.162 ppm2 3.165 CV 1
ASSI { 449}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 9 and name HB2 ))
2.500 0.800 0.800 peak 449 spectrum 1 weight 0.10000E+01 volume 0.47176E-02 ppm1 6.648 ppm2 3.167 CV 1
ASSI { 451}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 41 and name HB3 ))
3.900 1.900 1.900 peak 451 spectrum 1 weight 0.10000E+01 volume 0.10957E-02 ppm1 7.601 ppm2 3.125 CV 1
ASSI { 452}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 41 and name HB3 ))
2.300 0.700 0.700 peak 452 spectrum 1 weight 0.10000E+01 volume 0.45958E-02 ppm1 7.523 ppm2 3.121 CV 1
ASSI { 460}
(( segid " " and resid 83 and name HE22))
(( segid " " and resid 74 and name HA ))
2.900 1.000 1.000 peak 460 spectrum 1 weight 0.10000E+01 volume 0.20940E-02 ppm1 6.687 ppm2 3.103 CV 1
ASSI { 461}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 17 and name HD3 ))
3.400 3.400 2.600 peak 461 spectrum 1 weight 0.10000E+01 volume 0.60567E-03 ppm1 6.795 ppm2 3.092 CV 1
ASSI { 462}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 28 and name HB3 ))
2.700 0.900 0.900 peak 462 spectrum 1 weight 0.10000E+01 volume 0.50523E-02 ppm1 7.216 ppm2 3.038 CV 1
ASSI { 463}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 28 and name HB3 ))
3.600 1.600 1.600 peak 463 spectrum 1 weight 0.10000E+01 volume 0.94049E-03 ppm1 7.025 ppm2 3.039 CV 1
ASSI { 464}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 28 and name HB3 ))
2.900 1.100 1.100 peak 464 spectrum 1 weight 0.10000E+01 volume 0.16405E-02 ppm1 6.949 ppm2 3.038 CV 1
ASSI { 466}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HB2 ))
4.400 2.400 1.600 peak 466 spectrum 1 weight 0.10000E+01 volume 0.70613E-03 ppm1 7.554 ppm2 2.985 CV 1
ASSI { 467}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 25 and name HD3 ))
4.400 2.400 1.600 peak 467 spectrum 1 weight 0.10000E+01 volume 0.39566E-03 ppm1 7.095 ppm2 2.977 CV 1
ASSI { 468}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 25 and name HD3 ))
3.600 1.600 1.600 peak 468 spectrum 1 weight 0.10000E+01 volume 0.93739E-03 ppm1 6.794 ppm2 2.982 CV 1
ASSI { 471}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 72 and name HB2 ))
4.100 2.100 1.900 peak 471 spectrum 1 weight 0.10000E+01 volume 0.82783E-03 ppm1 6.487 ppm2 2.916 CV 1
ASSI { 472}
(( segid " " and resid 14 and name HZ ))
(( segid " " and resid 77 and name HB2 ))
4.600 2.600 1.400 peak 472 spectrum 1 weight 0.10000E+01 volume 0.46567E-03 ppm1 7.133 ppm2 2.904 CV 1
ASSI { 474}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 27 and name HB2 ))
2.500 0.800 0.800 peak 474 spectrum 1 weight 0.10000E+01 volume 0.49610E-02 ppm1 6.880 ppm2 2.842 CV 1
ASSI { 475}
(( segid " " and resid 11 and name HD21))
(( segid " " and resid 11 and name HB3 ))
2.900 1.100 1.100 peak 475 spectrum 1 weight 0.10000E+01 volume 0.18901E-02 ppm1 7.631 ppm2 2.811 CV 1
ASSI { 477}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 18 and name HB3 ))
2.600 0.900 0.900 peak 477 spectrum 1 weight 0.10000E+01 volume 0.49306E-02 ppm1 7.161 ppm2 2.809 CV 1
ASSI { 479}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 18 and name HB3 ))
4.800 2.900 1.200 peak 479 spectrum 1 weight 0.10000E+01 volume 0.49306E-03 ppm1 6.791 ppm2 2.810 CV 1
ASSI { 481}
(( segid " " and resid 41 and name HZ2 ))
(( segid " " and resid 68 and name HE2 ))
4.800 2.900 1.200 peak 481 spectrum 1 weight 0.10000E+01 volume 0.71220E-03 ppm1 7.442 ppm2 2.695 CV 1
ASSI { 482}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 14 and name HB3 ))
4.600 2.600 1.400 peak 482 spectrum 1 weight 0.10000E+01 volume 0.73654E-03 ppm1 7.263 ppm2 2.696 CV 1
ASSI { 484}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 14 and name HB3 ))
2.500 0.800 0.800 peak 484 spectrum 1 weight 0.10000E+01 volume 0.54176E-02 ppm1 7.101 ppm2 2.695 CV 1
ASSI { 487}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 26 and name HB3 ))
3.400 1.400 1.400 peak 487 spectrum 1 weight 0.10000E+01 volume 0.91919E-03 ppm1 6.487 ppm2 2.641 CV 1
ASSI { 488}
(( segid " " and resid 39 and name HE21))
(( segid " " and resid 39 and name HG2 ))
3.600 1.600 1.600 peak 488 spectrum 1 weight 0.10000E+01 volume 0.75481E-03 ppm1 7.435 ppm2 2.586 CV 1
ASSI { 489}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 27 and name HB3 ))
2.500 0.800 0.800 peak 489 spectrum 1 weight 0.10000E+01 volume 0.48393E-02 ppm1 6.879 ppm2 2.580 CV 1
ASSI { 490}
(( segid " " and resid 39 and name HE22))
(( segid " " and resid 39 and name HG2 ))
4.700 2.700 1.300 peak 490 spectrum 1 weight 0.10000E+01 volume 0.44740E-03 ppm1 6.830 ppm2 2.585 CV 1
ASSI { 494}
(( segid " " and resid 14 and name HZ ))
(( segid " " and resid 77 and name HB3 ))
3.700 1.800 1.800 peak 494 spectrum 1 weight 0.10000E+01 volume 0.10805E-02 ppm1 7.133 ppm2 2.510 CV 1
ASSI { 495}
(( segid " " and resid 9 and name HZ ))
(( segid " " and resid 76 and name HB2 ))
3.000 1.100 1.100 peak 495 spectrum 1 weight 0.10000E+01 volume 0.12600E-01 ppm1 6.981 ppm2 2.507 CV 1
ASSI { 496}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 58 and name HB ))
3.900 1.900 1.900 peak 496 spectrum 1 weight 0.10000E+01 volume 0.56002E-03 ppm1 7.217 ppm2 2.485 CV 1
ASSI { 497}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 58 and name HB ))
2.500 0.800 0.800 peak 497 spectrum 1 weight 0.10000E+01 volume 0.37436E-02 ppm1 7.025 ppm2 2.483 CV 1
ASSI { 498}
(( segid " " and resid 83 and name HE22))
(( segid " " and resid 83 and name HG2 ))
4.000 2.000 2.000 peak 498 spectrum 1 weight 0.10000E+01 volume 0.13088E-02 ppm1 6.684 ppm2 2.471 CV 1
ASSI { 499}
(( segid " " and resid 39 and name HE21))
(( segid " " and resid 39 and name HG3 ))
3.100 1.200 1.200 peak 499 spectrum 1 weight 0.10000E+01 volume 0.16496E-02 ppm1 7.436 ppm2 2.459 CV 1
ASSI { 500}
(( segid " " and resid 39 and name HE22))
(( segid " " and resid 39 and name HG3 ))
4.300 2.300 1.700 peak 500 spectrum 1 weight 0.10000E+01 volume 0.70309E-03 ppm1 6.830 ppm2 2.459 CV 1
ASSI { 502}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HG2 ))
3.800 1.800 1.800 peak 502 spectrum 1 weight 0.10000E+01 volume 0.11809E-02 ppm1 7.358 ppm2 2.439 CV 1
OR { 502}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HG3 ))
ASSI { 503}
(( segid " " and resid 55 and name HE22))
(( segid " " and resid 55 and name HG3 ))
3.200 1.300 1.300 peak 503 spectrum 1 weight 0.10000E+01 volume 0.49610E-02 ppm1 6.886 ppm2 2.441 CV 1
OR { 503}
(( segid " " and resid 55 and name HE22))
(( segid " " and resid 55 and name HG2 ))
ASSI { 504}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 74 and name HD2 ))
4.200 2.200 1.800 peak 504 spectrum 1 weight 0.10000E+01 volume 0.40784E-03 ppm1 7.602 ppm2 2.402 CV 1
ASSI { 505}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 63 and name HB3 ))
2.400 0.700 0.700 peak 505 spectrum 1 weight 0.10000E+01 volume 0.44740E-02 ppm1 7.292 ppm2 2.411 CV 1
ASSI { 507}
(( segid " " and resid 63 and name HZ ))
(( segid " " and resid 74 and name HD2 ))
4.100 2.100 1.900 peak 507 spectrum 1 weight 0.10000E+01 volume 0.10927E-02 ppm1 6.716 ppm2 2.402 CV 1
ASSI { 508}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 9 and name HB3 ))
2.400 0.700 0.700 peak 508 spectrum 1 weight 0.10000E+01 volume 0.47784E-02 ppm1 6.648 ppm2 2.399 CV 1
ASSI { 510}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 76 and name HG2 ))
4.300 2.300 1.700 peak 510 spectrum 1 weight 0.10000E+01 volume 0.12113E-02 ppm1 6.894 ppm2 2.354 CV 1
ASSI { 512}
(( segid " " and resid 9 and name HZ ))
(( segid " " and resid 76 and name HG3 ))
3.300 1.400 1.400 peak 512 spectrum 1 weight 0.10000E+01 volume 0.25597E-02 ppm1 6.982 ppm2 2.227 CV 1
OR { 512}
(( segid " " and resid 9 and name HZ ))
(( segid " " and resid 76 and name HB3 ))
ASSI { 513}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 76 and name HG3 ))
2.500 0.800 0.800 peak 513 spectrum 1 weight 0.10000E+01 volume 0.35306E-02 ppm1 6.893 ppm2 2.227 CV 1
OR { 513}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 76 and name HB3 ))
ASSI { 514}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 76 and name HG3 ))
4.300 2.300 1.700 peak 514 spectrum 1 weight 0.10000E+01 volume 0.59958E-03 ppm1 6.644 ppm2 2.227 CV 1
OR { 514}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 76 and name HB3 ))
ASSI { 516}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HG2 ))
2.600 2.600 3.400 peak 516 spectrum 1 weight 0.10000E+01 volume 0.81266E-02 ppm1 6.972 ppm2 2.161 CV 1
ASSI { 520}
(( segid " " and resid 9 and name HZ ))
(( segid " " and resid 75 and name HB ))
5.600 4.000 0.400 peak 520 spectrum 1 weight 0.10000E+01 volume 0.15826E-03 ppm1 6.984 ppm2 2.085 CV 1
ASSI { 521}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 34 and name HG2 ))
3.200 1.300 1.300 peak 521 spectrum 1 weight 0.10000E+01 volume 0.58437E-03 ppm1 6.606 ppm2 2.090 CV 1
ASSI { 525}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 31 and name HB2 ))
3.100 1.200 1.200 peak 525 spectrum 1 weight 0.10000E+01 volume 0.18413E-02 ppm1 7.485 ppm2 2.015 CV 1
ASSI { 526}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 57 and name HB2 ))
3.600 1.600 1.600 peak 526 spectrum 1 weight 0.10000E+01 volume 0.13392E-02 ppm1 6.878 ppm2 1.933 CV 1
ASSI { 531}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 58 and name HG12))
2.900 1.000 1.000 peak 531 spectrum 1 weight 0.10000E+01 volume 0.27727E-02 ppm1 7.022 ppm2 1.870 CV 1
ASSI { 532}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 62 and name HB3 ))
4.500 2.600 1.500 peak 532 spectrum 1 weight 0.10000E+01 volume 0.52045E-03 ppm1 7.291 ppm2 1.866 CV 1
ASSI { 535}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 31 and name HD3 ))
2.700 0.900 0.900 peak 535 spectrum 1 weight 0.10000E+01 volume 0.24866E-02 ppm1 6.947 ppm2 1.843 CV 1
ASSI { 536}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 10 and name HD3 ))
4.600 2.600 1.400 peak 536 spectrum 1 weight 0.10000E+01 volume 0.61480E-03 ppm1 6.897 ppm2 1.849 CV 1
ASSI { 537}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 10 and name HD3 ))
4.100 2.100 1.900 peak 537 spectrum 1 weight 0.10000E+01 volume 0.18505E-02 ppm1 6.648 ppm2 1.848 CV 1
ASSI { 539}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB2 ))
2.500 0.800 0.800 peak 539 spectrum 1 weight 0.10000E+01 volume 0.45958E-02 ppm1 7.528 ppm2 1.831 CV 1
ASSI { 540}
(( segid " " and resid 41 and name HZ2 ))
(( segid " " and resid 31 and name HD3 ))
3.000 1.100 1.100 peak 540 spectrum 1 weight 0.10000E+01 volume 0.22005E-02 ppm1 7.445 ppm2 1.826 CV 1
ASSI { 543}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 34 and name HG3 ))
3.900 1.900 1.900 peak 543 spectrum 1 weight 0.10000E+01 volume 0.24166E-02 ppm1 6.606 ppm2 1.779 CV 1
ASSI { 546}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 57 and name HB3 ))
2.600 0.900 0.900 peak 546 spectrum 1 weight 0.10000E+01 volume 0.21518E-02 ppm1 6.879 ppm2 1.698 CV 1
ASSI { 548}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 58 and name HG13))
2.600 0.900 0.900 peak 548 spectrum 1 weight 0.10000E+01 volume 0.28062E-02 ppm1 7.024 ppm2 1.679 CV 1
ASSI { 550}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 17 and name HB3 ))
3.100 1.200 1.200 peak 550 spectrum 1 weight 0.10000E+01 volume 0.18596E-02 ppm1 7.161 ppm2 1.671 CV 1
OR { 550}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 17 and name HB2 ))
ASSI { 551}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 17 and name HB3 ))
3.500 1.600 1.600 peak 551 spectrum 1 weight 0.10000E+01 volume 0.83093E-03 ppm1 6.792 ppm2 1.674 CV 1
OR { 551}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 17 and name HB2 ))
ASSI { 553}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 10 and name HG2 ))
3.900 1.900 1.900 peak 553 spectrum 1 weight 0.10000E+01 volume 0.82176E-03 ppm1 6.648 ppm2 1.645 CV 1
OR { 553}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 10 and name HG3 ))
ASSI { 557}
(( segid " " and resid 63 and name HZ ))
(( segid " " and resid 74 and name HG2 ))
4.600 2.700 1.400 peak 557 spectrum 1 weight 0.10000E+01 volume 0.71220E-03 ppm1 6.715 ppm2 1.527 CV 1
ASSI { 562}
(( segid " " and resid 9 and name HZ ))
( segid " " and resid 44 and name HB% )
3.200 1.300 1.300 peak 562 spectrum 1 weight 0.10000E+01 volume 0.12844E-02 ppm1 6.981 ppm2 1.510 CV 1
ASSI { 563}
( segid " " and resid 9 and name HE% )
( segid " " and resid 44 and name HB% )
2.900 1.100 1.100 peak 563 spectrum 1 weight 0.10000E+01 volume 0.26570E-02 ppm1 6.892 ppm2 1.508 CV 1
ASSI { 564}
( segid " " and resid 9 and name HD% )
( segid " " and resid 44 and name HB% )
3.700 1.700 1.700 peak 564 spectrum 1 weight 0.10000E+01 volume 0.14944E-02 ppm1 6.647 ppm2 1.511 CV 1
ASSI { 565}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 78 and name HG3 ))
3.000 1.100 1.100 peak 565 spectrum 1 weight 0.10000E+01 volume 0.15675E-02 ppm1 7.055 ppm2 1.498 CV 1
ASSI { 566}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HG12))
4.300 2.300 1.700 peak 566 spectrum 1 weight 0.10000E+01 volume 0.69696E-03 ppm1 6.607 ppm2 1.490 CV 1
ASSI { 567}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HG3 ))
3.300 1.400 1.400 peak 567 spectrum 1 weight 0.10000E+01 volume 0.17166E-02 ppm1 7.485 ppm2 1.479 CV 1
OR { 567}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HG2 ))
ASSI { 569}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 17 and name HG2 ))
3.500 1.600 1.600 peak 569 spectrum 1 weight 0.10000E+01 volume 0.18109E-02 ppm1 7.104 ppm2 1.457 CV 1
OR { 569}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 17 and name HG3 ))
ASSI { 570}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 13 and name HD3 ))
3.200 1.300 1.300 peak 570 spectrum 1 weight 0.10000E+01 volume 0.13727E-02 ppm1 7.264 ppm2 1.445 CV 1
OR { 570}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 13 and name HD2 ))
ASSI { 571}
(( segid " " and resid 14 and name HZ ))
(( segid " " and resid 13 and name HD3 ))
2.700 2.700 3.300 peak 571 spectrum 1 weight 0.10000E+01 volume 0.16070E-02 ppm1 7.132 ppm2 1.443 CV 1
OR { 571}
(( segid " " and resid 14 and name HZ ))
(( segid " " and resid 13 and name HD2 ))
ASSI { 575}
(( segid " " and resid 63 and name HZ ))
(( segid " " and resid 74 and name HD3 ))
2.600 0.800 0.800 peak 575 spectrum 1 weight 0.10000E+01 volume 0.23192E-02 ppm1 6.717 ppm2 1.387 CV 1
ASSI { 576}
(( segid " " and resid 41 and name HZ2 ))
(( segid " " and resid 68 and name HD2 ))
2.500 0.800 0.800 peak 576 spectrum 1 weight 0.10000E+01 volume 0.41089E-02 ppm1 7.442 ppm2 1.373 CV 1
ASSI { 578}
(( segid " " and resid 80 and name HN ))
( segid " " and resid 79 and name HG2%)
3.200 1.300 1.300 peak 578 spectrum 1 weight 0.10000E+01 volume 0.45958E-02 ppm1 7.574 ppm2 1.295 CV 1
ASSI { 579}
(( segid " " and resid 41 and name HE3 ))
( segid " " and resid 58 and name HG2%)
3.500 1.500 1.500 peak 579 spectrum 1 weight 0.10000E+01 volume 0.28488E-02 ppm1 7.525 ppm2 1.254 CV 1
ASSI { 580}
( segid " " and resid 63 and name HD% )
( segid " " and resid 58 and name HG2%)
4.300 2.300 1.700 peak 580 spectrum 1 weight 0.10000E+01 volume 0.53567E-03 ppm1 7.294 ppm2 1.254 CV 1
ASSI { 581}
( segid " " and resid 28 and name HD% )
( segid " " and resid 58 and name HG2%)
4.000 2.000 2.000 peak 581 spectrum 1 weight 0.10000E+01 volume 0.63611E-03 ppm1 7.217 ppm2 1.256 CV 1
ASSI { 582}
(( segid " " and resid 41 and name HZ3 ))
( segid " " and resid 58 and name HG2%)
3.500 1.600 1.600 peak 582 spectrum 1 weight 0.10000E+01 volume 0.18566E-02 ppm1 7.024 ppm2 1.256 CV 1
ASSI { 584}
(( segid " " and resid 63 and name HZ ))
( segid " " and resid 58 and name HG2%)
3.300 1.400 1.400 peak 584 spectrum 1 weight 0.10000E+01 volume 0.19692E-02 ppm1 6.717 ppm2 1.249 CV 1
ASSI { 585}
( segid " " and resid 9 and name HD% )
( segid " " and resid 58 and name HG2%)
2.500 0.800 0.800 peak 585 spectrum 1 weight 0.10000E+01 volume 0.49610E-02 ppm1 6.648 ppm2 1.252 CV 1
ASSI { 586}
(( segid " " and resid 62 and name HN ))
( segid " " and resid 58 and name HG2%)
4.100 2.100 1.900 peak 586 spectrum 1 weight 0.10000E+01 volume 0.76391E-03 ppm1 6.369 ppm2 1.252 CV 1
ASSI { 587}
( segid " " and resid 9 and name HE% )
( segid " " and resid 58 and name HG2%)
2.900 1.100 1.100 peak 587 spectrum 1 weight 0.10000E+01 volume 0.29583E-02 ppm1 6.894 ppm2 1.245 CV 1
ASSI { 588}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 73 and name HG13))
3.100 1.200 1.200 peak 588 spectrum 1 weight 0.10000E+01 volume 0.11596E-02 ppm1 7.597 ppm2 1.225 CV 1
ASSI { 589}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 51 and name HG2%)
4.600 2.600 1.400 peak 589 spectrum 1 weight 0.10000E+01 volume 0.62089E-03 ppm1 7.676 ppm2 1.186 CV 1
ASSI { 591}
(( segid " " and resid 55 and name HE21))
( segid " " and resid 6 and name HG2%)
2.500 2.500 3.500 peak 591 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 7.528 ppm2 1.165 CV 1
ASSI { 593}
(( segid " " and resid 41 and name HZ2 ))
( segid " " and resid 37 and name HD1%)
3.800 1.800 1.800 peak 593 spectrum 1 weight 0.10000E+01 volume 0.93739E-03 ppm1 7.443 ppm2 1.150 CV 1
ASSI { 594}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 37 and name HD1%)
4.700 2.800 1.300 peak 594 spectrum 1 weight 0.10000E+01 volume 0.79438E-03 ppm1 6.606 ppm2 1.148 CV 1
ASSI { 595}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 13 and name HG2 ))
3.700 1.700 1.700 peak 595 spectrum 1 weight 0.10000E+01 volume 0.48089E-03 ppm1 7.263 ppm2 1.104 CV 1
ASSI { 596}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 13 and name HG2 ))
3.500 1.500 1.500 peak 596 spectrum 1 weight 0.10000E+01 volume 0.83700E-03 ppm1 7.101 ppm2 1.102 CV 1
ASSI { 597}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 84 and name HG13))
2.500 2.500 3.500 peak 597 spectrum 1 weight 0.10000E+01 volume 0.16922E-02 ppm1 6.953 ppm2 1.082 CV 1
ASSI { 598}
(( segid " " and resid 56 and name HN ))
( segid " " and resid 56 and name HD1%)
4.500 2.500 1.500 peak 598 spectrum 1 weight 0.10000E+01 volume 0.47784E-03 ppm1 7.358 ppm2 1.066 CV 1
ASSI { 599}
( segid " " and resid 9 and name HD% )
( segid " " and resid 58 and name HD1%)
2.700 0.900 0.900 peak 599 spectrum 1 weight 0.10000E+01 volume 0.26905E-02 ppm1 6.648 ppm2 1.043 CV 1
ASSI { 600}
(( segid " " and resid 41 and name HD1 ))
( segid " " and resid 37 and name HD2%)
3.800 1.800 1.800 peak 600 spectrum 1 weight 0.10000E+01 volume 0.15583E-02 ppm1 7.602 ppm2 1.018 CV 1
ASSI { 601}
(( segid " " and resid 41 and name HZ3 ))
( segid " " and resid 30 and name HD1%)
3.400 3.400 2.600 peak 601 spectrum 1 weight 0.10000E+01 volume 0.19692E-02 ppm1 7.024 ppm2 1.022 CV 1
ASSI { 603}
(( segid " " and resid 41 and name HZ2 ))
( segid " " and resid 37 and name HD2%)
3.600 1.700 1.700 peak 603 spectrum 1 weight 0.10000E+01 volume 0.12326E-02 ppm1 7.439 ppm2 1.007 CV 1
ASSI { 604}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 52 and name HG1%)
2.700 0.900 0.900 peak 604 spectrum 1 weight 0.10000E+01 volume 0.32262E-02 ppm1 7.674 ppm2 0.989 CV 1
ASSI { 606}
(( segid " " and resid 84 and name HN ))
( segid " " and resid 75 and name HG1%)
1.900 0.500 0.500 peak 606 spectrum 1 weight 0.10000E+01 volume 0.74570E-02 ppm1 6.948 ppm2 0.963 CV 1
ASSI { 607}
(( segid " " and resid 39 and name HE22))
( segid " " and resid 36 and name HG2%)
2.900 2.900 3.100 peak 607 spectrum 1 weight 0.10000E+01 volume 0.10957E-02 ppm1 6.831 ppm2 0.963 CV 1
ASSI { 608}
(( segid " " and resid 83 and name HE22))
( segid " " and resid 75 and name HG1%)
3.400 1.400 1.400 peak 608 spectrum 1 weight 0.10000E+01 volume 0.14335E-02 ppm1 6.683 ppm2 0.963 CV 1
ASSI { 610}
(( segid " " and resid 41 and name HE3 ))
( segid " " and resid 30 and name HG2%)
2.800 1.000 1.000 peak 610 spectrum 1 weight 0.10000E+01 volume 0.30345E-02 ppm1 7.524 ppm2 0.929 CV 1
ASSI { 611}
(( segid " " and resid 41 and name HZ3 ))
( segid " " and resid 30 and name HG2%)
4.000 2.000 2.000 peak 611 spectrum 1 weight 0.10000E+01 volume 0.88568E-03 ppm1 7.020 ppm2 0.939 CV 1
ASSI { 612}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 52 and name HG2%)
3.500 1.500 1.500 peak 612 spectrum 1 weight 0.10000E+01 volume 0.24349E-02 ppm1 7.674 ppm2 0.922 CV 1
ASSI { 613}
( segid " " and resid 18 and name HD% )
( segid " " and resid 21 and name HD1%)
3.800 1.800 1.800 peak 613 spectrum 1 weight 0.10000E+01 volume 0.79438E-03 ppm1 7.162 ppm2 0.908 CV 1
OR { 613}
( segid " " and resid 18 and name HD% )
( segid " " and resid 21 and name HD2%)
ASSI { 616}
(( segid " " and resid 63 and name HZ ))
(( segid " " and resid 74 and name HG3 ))
3.500 1.600 1.600 peak 616 spectrum 1 weight 0.10000E+01 volume 0.10287E-02 ppm1 6.717 ppm2 0.886 CV 1
ASSI { 619}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 86 and name HD1%)
4.400 2.400 1.600 peak 619 spectrum 1 weight 0.10000E+01 volume 0.66655E-03 ppm1 6.608 ppm2 0.859 CV 1
ASSI { 620}
(( segid " " and resid 84 and name HN ))
( segid " " and resid 84 and name HD1%)
4.200 2.200 1.800 peak 620 spectrum 1 weight 0.10000E+01 volume 0.69089E-03 ppm1 6.958 ppm2 0.837 CV 1
ASSI { 622}
(( segid " " and resid 41 and name HD1 ))
( segid " " and resid 73 and name HG2%)
3.100 1.200 1.200 peak 622 spectrum 1 weight 0.10000E+01 volume 0.49306E-02 ppm1 7.593 ppm2 0.788 CV 1
ASSI { 625}
( segid " " and resid 9 and name HD% )
( segid " " and resid 45 and name HG2%)
2.600 0.900 0.900 peak 625 spectrum 1 weight 0.10000E+01 volume 0.39566E-02 ppm1 6.648 ppm2 0.784 CV 1
ASSI { 626}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 13 and name HG3 ))
3.400 3.400 2.600 peak 626 spectrum 1 weight 0.10000E+01 volume 0.38349E-03 ppm1 7.265 ppm2 0.747 CV 1
ASSI { 630}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 31 and name HG3 ))
5.300 3.500 0.700 peak 630 spectrum 1 weight 0.10000E+01 volume 0.33175E-03 ppm1 7.602 ppm2 0.724 CV 1
ASSI { 631}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 68 and name HG3 ))
4.300 2.300 1.700 peak 631 spectrum 1 weight 0.10000E+01 volume 0.84307E-03 ppm1 6.487 ppm2 0.689 CV 1
ASSI { 633}
(( segid " " and resid 27 and name HZ ))
( segid " " and resid 5 and name HG2%)
3.400 1.400 1.400 peak 633 spectrum 1 weight 0.10000E+01 volume 0.42306E-03 ppm1 7.177 ppm2 0.642 CV 1
ASSI { 634}
( segid " " and resid 27 and name HE% )
( segid " " and resid 5 and name HG2%)
3.800 1.800 1.800 peak 634 spectrum 1 weight 0.10000E+01 volume 0.78832E-03 ppm1 7.079 ppm2 0.641 CV 1
ASSI { 635}
( segid " " and resid 27 and name HD% )
( segid " " and resid 5 and name HG2%)
3.300 1.400 1.400 peak 635 spectrum 1 weight 0.10000E+01 volume 0.13544E-02 ppm1 6.879 ppm2 0.640 CV 1
ASSI { 636}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HB3 ))
3.000 1.200 1.200 peak 636 spectrum 1 weight 0.10000E+01 volume 0.11657E-02 ppm1 8.069 ppm2 2.135 CV 1
ASSI { 639}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HB2 ))
3.300 1.400 1.400 peak 639 spectrum 1 weight 0.10000E+01 volume 0.14518E-02 ppm1 8.123 ppm2 2.033 CV 1
ASSI { 640}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HG2 ))
2.600 0.800 0.800 peak 640 spectrum 1 weight 0.10000E+01 volume 0.38349E-02 ppm1 8.070 ppm2 2.026 CV 1
ASSI { 642}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HB3 ))
3.400 1.400 1.400 peak 642 spectrum 1 weight 0.10000E+01 volume 0.23131E-02 ppm1 7.849 ppm2 1.980 CV 1
ASSI { 646}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HG3 ))
3.000 1.200 1.200 peak 646 spectrum 1 weight 0.10000E+01 volume 0.27666E-02 ppm1 8.063 ppm2 1.892 CV 1
ASSI { 649}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HB3 ))
3.200 1.300 1.300 peak 649 spectrum 1 weight 0.10000E+01 volume 0.31045E-02 ppm1 8.050 ppm2 1.806 CV 1
ASSI { 655}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HG2 ))
3.100 1.200 1.200 peak 655 spectrum 1 weight 0.10000E+01 volume 0.32262E-02 ppm1 8.135 ppm2 1.588 CV 1
ASSI { 656}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 25 and name HB2 ))
3.900 3.900 2.100 peak 656 spectrum 1 weight 0.11000E+01 volume 0.97697E-03 ppm1 8.004 ppm2 1.577 CV 1
ASSI { 663}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HG2 ))
2.200 2.200 3.800 peak 663 spectrum 1 weight 0.10000E+01 volume 0.17044E-01 ppm1 8.080 ppm2 1.481 CV 1
ASSI { 664}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HG2 ))
3.400 1.500 1.500 peak 664 spectrum 1 weight 0.10000E+01 volume 0.30070E-02 ppm1 7.769 ppm2 1.480 CV 1
ASSI { 665}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB3 ))
3.200 1.300 1.300 peak 665 spectrum 1 weight 0.10000E+01 volume 0.41697E-02 ppm1 8.138 ppm2 1.353 CV 1
ASSI { 666}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB3 ))
2.800 1.000 1.000 peak 666 spectrum 1 weight 0.10000E+01 volume 0.13026E-02 ppm1 8.087 ppm2 1.277 CV 1
ASSI { 669}
(( segid " " and resid 62 and name HD2 ))
( segid " " and resid 58 and name HG2%)
2.200 0.600 0.600 peak 669 spectrum 1 weight 0.10000E+01 volume 0.65741E-02 ppm1 7.949 ppm2 1.255 CV 1
ASSI { 672}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HG13))
3.400 1.400 1.400 peak 672 spectrum 1 weight 0.10000E+01 volume 0.98310E-03 ppm1 7.707 ppm2 1.210 CV 1
ASSI { 673}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 51 and name HG2%)
2.600 2.600 3.400 peak 673 spectrum 1 weight 0.10000E+01 volume 0.10439E-01 ppm1 8.196 ppm2 1.178 CV 1
ASSI { 675}
(( segid " " and resid 62 and name HD2 ))
( segid " " and resid 58 and name HD1%)
5.200 3.300 0.800 peak 675 spectrum 1 weight 0.10000E+01 volume 0.42610E-03 ppm1 7.948 ppm2 1.044 CV 1
ASSI { 683}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 73 and name HG2%)
3.900 1.900 1.900 peak 683 spectrum 1 weight 0.10000E+01 volume 0.11900E-02 ppm1 8.253 ppm2 0.796 CV 1
ASSI { 689}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 42 and name HD2%)
4.700 2.700 1.300 peak 689 spectrum 1 weight 0.10000E+01 volume 0.44132E-03 ppm1 8.139 ppm2 0.633 CV 1
ASSI { 690}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HD3 ))
4.300 2.300 1.700 peak 690 spectrum 1 weight 0.10000E+01 volume 0.14396E-02 ppm1 8.130 ppm2 2.976 CV 1
ASSI { 693}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.300 1.400 1.400 peak 693 spectrum 1 weight 0.10000E+01 volume 0.75784E-03 ppm1 8.087 ppm2 2.908 CV 1
ASSI { 698}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 72 and name HB3 ))
3.900 1.900 1.900 peak 698 spectrum 1 weight 0.10000E+01 volume 0.41393E-03 ppm1 7.712 ppm2 2.805 CV 1
ASSI { 706}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HG2 ))
3.500 1.500 1.500 peak 706 spectrum 1 weight 0.10000E+01 volume 0.12083E-02 ppm1 8.121 ppm2 2.241 CV 1
OR { 706}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 22 and name HG3 ))
ASSI { 709}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 75 and name HG2%)
4.200 2.200 1.800 peak 709 spectrum 1 weight 0.10000E+01 volume 0.49001E-03 ppm1 8.335 ppm2 0.490 CV 1
ASSI { 711}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HG3 ))
3.700 1.700 1.700 peak 711 spectrum 1 weight 0.10000E+01 volume 0.92222E-03 ppm1 9.298 ppm2 1.472 CV 1
ASSI { 712}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HA1 ))
3.400 1.400 1.400 peak 712 spectrum 1 weight 0.10000E+01 volume 0.11504E-02 ppm1 8.477 ppm2 4.060 CV 1
ASSI { 714}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 35 and name HA ))
3.900 1.900 1.900 peak 714 spectrum 1 weight 0.10000E+01 volume 0.61176E-03 ppm1 8.830 ppm2 4.049 CV 1
ASSI { 716}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 27 and name HA ))
4.400 2.400 1.600 peak 716 spectrum 1 weight 0.10000E+01 volume 0.37132E-03 ppm1 9.658 ppm2 4.655 CV 1
ASSI { 717}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 29 and name HA ))
4.100 2.100 1.900 peak 717 spectrum 1 weight 0.10000E+01 volume 0.33479E-03 ppm1 9.654 ppm2 4.565 CV 1
ASSI { 718}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 8 and name HA1 ))
3.400 1.400 1.400 peak 718 spectrum 1 weight 0.10000E+01 volume 0.15766E-02 ppm1 9.894 ppm2 4.573 CV 1
ASSI { 721}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 86 and name HD1%)
4.200 2.200 1.800 peak 721 spectrum 1 weight 0.10000E+01 volume 0.53567E-03 ppm1 8.551 ppm2 0.862 CV 1
ASSI { 723}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HB2 ))
3.500 1.600 1.600 peak 723 spectrum 1 weight 0.10000E+01 volume 0.18079E-02 ppm1 8.070 ppm2 2.313 CV 1
ASSI { 724}
(( segid " " and resid 62 and name HE1 ))
(( segid " " and resid 12 and name HB3 ))
4.300 2.300 1.700 peak 724 spectrum 1 weight 0.10000E+01 volume 0.79135E-03 ppm1 8.187 ppm2 3.138 CV 1
ASSI { 726}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HB2 ))
4.500 2.500 1.500 peak 726 spectrum 1 weight 0.10000E+01 volume 0.67869E-03 ppm1 8.251 ppm2 2.932 CV 1
ASSI { 728}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 59 and name HA ))
4.400 2.400 1.600 peak 728 spectrum 1 weight 0.10000E+01 volume 0.71826E-03 ppm1 7.811 ppm2 4.935 CV 1
ASSI { 729}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HA ))
3.500 1.500 1.500 peak 729 spectrum 1 weight 0.10000E+01 volume 0.75177E-03 ppm1 7.802 ppm2 4.502 CV 1
ASSI { 731}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 49 and name HA ))
4.000 2.000 2.000 peak 731 spectrum 1 weight 0.10000E+01 volume 0.36219E-03 ppm1 7.675 ppm2 4.136 CV 1
ASSI { 734}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 58 and name HB ))
3.400 1.400 1.400 peak 734 spectrum 1 weight 0.10000E+01 volume 0.33479E-02 ppm1 7.529 ppm2 2.473 CV 1
ASSI { 736}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 73 and name HG12))
3.300 1.400 1.400 peak 736 spectrum 1 weight 0.10000E+01 volume 0.14761E-02 ppm1 7.601 ppm2 1.552 CV 1
OR { 736}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 73 and name HB ))
ASSI { 737}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HG ))
2.700 0.900 0.900 peak 737 spectrum 1 weight 0.10000E+01 volume 0.35306E-02 ppm1 8.082 ppm2 1.600 CV 1
ASSI { 739}
(( segid " " and resid 39 and name HE21))
( segid " " and resid 36 and name HG2%)
3.700 1.700 1.700 peak 739 spectrum 1 weight 0.10000E+01 volume 0.54176E-03 ppm1 7.437 ppm2 0.965 CV 1
ASSI { 740}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 42 and name HD2%)
4.500 2.500 1.500 peak 740 spectrum 1 weight 0.10000E+01 volume 0.46871E-03 ppm1 7.765 ppm2 0.637 CV 1
ASSI { 742}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 25 and name HG3 ))
4.300 2.300 1.700 peak 742 spectrum 1 weight 0.10000E+01 volume 0.10622E-03 ppm1 7.997 ppm2 1.313 CV 1
ASSI { 744}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 56 and name HD1%)
4.700 2.800 1.300 peak 744 spectrum 1 weight 0.10000E+01 volume 0.27483E-03 ppm1 6.920 ppm2 1.064 CV 1
ASSI { 745}
(( segid " " and resid 39 and name HE22))
( segid " " and resid 36 and name HD1%)
3.700 1.700 1.700 peak 745 spectrum 1 weight 0.10000E+01 volume 0.23101E-03 ppm1 6.830 ppm2 0.998 CV 1
ASSI { 746}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 74 and name HG3 ))
3.000 1.100 1.100 peak 746 spectrum 1 weight 0.10000E+01 volume 0.10835E-02 ppm1 7.522 ppm2 0.880 CV 1
ASSI { 748}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 17 and name HD2 ))
3.400 1.400 1.400 peak 748 spectrum 1 weight 0.10000E+01 volume 0.94656E-03 ppm1 7.100 ppm2 3.073 CV 1
OR { 748}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 17 and name HD3 ))
ASSI { 749}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 9 and name HB2 ))
5.100 3.300 0.900 peak 749 spectrum 1 weight 0.10000E+01 volume 0.25627E-03 ppm1 6.887 ppm2 3.149 CV 1
ASSI { 751}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HA ))
6.000 5.200 0.000 peak 751 spectrum 1 weight 0.10000E+01 volume 0.21883E-04 ppm1 7.058 ppm2 3.957 CV 1
ASSI { 753}
(( segid " " and resid 63 and name HZ ))
(( segid " " and resid 74 and name HB3 ))
2.800 1.000 1.000 peak 753 spectrum 1 weight 0.10000E+01 volume 0.22401E-02 ppm1 6.717 ppm2 1.205 CV 1
OR { 753}
(( segid " " and resid 63 and name HZ ))
(( segid " " and resid 74 and name HB2 ))
ASSI { 754}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 45 and name HG13))
4.400 2.400 1.600 peak 754 spectrum 1 weight 0.10000E+01 volume 0.90698E-03 ppm1 6.649 ppm2 1.191 CV 1
ASSI { 755}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 45 and name HG13))
3.600 1.600 1.600 peak 755 spectrum 1 weight 0.10000E+01 volume 0.12387E-02 ppm1 6.894 ppm2 1.191 CV 1
ASSI { 756}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 58 and name HA ))
4.500 2.600 1.500 peak 756 spectrum 1 weight 0.10000E+01 volume 0.65437E-03 ppm1 7.948 ppm2 5.362 CV 1
ASSI { 763}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 63 and name HD% )
4.300 2.300 1.700 peak 763 spectrum 1 weight 0.10000E+01 volume 0.50523E-03 ppm1 9.428 ppm2 7.297 CV 1
ASSI { 764}
(( segid " " and resid 69 and name HN ))
( segid " " and resid 63 and name HD% )
4.300 2.300 1.700 peak 764 spectrum 1 weight 0.10000E+01 volume 0.90091E-03 ppm1 9.299 ppm2 7.296 CV 1
ASSI { 767}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 41 and name HZ3 ))
4.300 2.300 1.700 peak 767 spectrum 1 weight 0.10000E+01 volume 0.43523E-03 ppm1 9.657 ppm2 7.029 CV 1
ASSI { 770}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 17 and name HN ))
3.900 1.900 1.900 peak 770 spectrum 1 weight 0.10000E+01 volume 0.32566E-03 ppm1 8.323 ppm2 7.847 CV 1
ASSI { 778}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
3.400 1.500 1.500 peak 778 spectrum 1 weight 0.10000E+01 volume 0.14214E-02 ppm1 8.938 ppm2 7.563 CV 1
ASSI { 782}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HN ))
4.800 2.900 1.200 peak 782 spectrum 1 weight 0.10000E+01 volume 0.44132E-03 ppm1 9.124 ppm2 7.361 CV 1
ASSI { 784}
(( segid " " and resid 14 and name HN ))
( segid " " and resid 14 and name HE% )
4.600 2.700 1.400 peak 784 spectrum 1 weight 0.10000E+01 volume 0.68482E-03 ppm1 8.957 ppm2 7.266 CV 1
ASSI { 787}
(( segid " " and resid 7 and name HN ))
( segid " " and resid 27 and name HE% )
4.100 2.100 1.900 peak 787 spectrum 1 weight 0.10000E+01 volume 0.46262E-03 ppm1 9.098 ppm2 7.082 CV 1
ASSI { 790}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 37 and name HN ))
4.200 2.200 1.800 peak 790 spectrum 1 weight 0.10000E+01 volume 0.37132E-03 ppm1 8.830 ppm2 6.610 CV 1
ASSI { 796}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HN ))
2.500 0.800 0.800 peak 796 spectrum 1 weight 0.10000E+01 volume 0.29736E-02 ppm1 7.793 ppm2 7.680 CV 1
ASSI { 798}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HN ))
2.300 0.700 0.700 peak 798 spectrum 1 weight 0.10000E+01 volume 0.57219E-02 ppm1 7.706 ppm2 7.581 CV 1
ASSI { 799}
(( segid " " and resid 62 and name HE1 ))
( segid " " and resid 14 and name HE% )
3.600 1.600 1.600 peak 799 spectrum 1 weight 0.10000E+01 volume 0.14853E-02 ppm1 8.187 ppm2 7.267 CV 1
ASSI { 801}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 14 and name HZ ))
2.000 0.500 0.500 peak 801 spectrum 1 weight 0.10000E+01 volume 0.22857E-01 ppm1 7.263 ppm2 7.118 CV 1
ASSI { 802}
(( segid " " and resid 62 and name HE1 ))
( segid " " and resid 14 and name HD% )
2.900 1.100 1.100 peak 802 spectrum 1 weight 0.10000E+01 volume 0.20666E-02 ppm1 8.187 ppm2 7.105 CV 1
ASSI { 803}
(( segid " " and resid 27 and name HZ ))
( segid " " and resid 27 and name HE% )
2.400 0.700 0.700 peak 803 spectrum 1 weight 0.10000E+01 volume 0.81569E-02 ppm1 7.178 ppm2 7.083 CV 1
ASSI { 804}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 63 and name HN ))
2.700 0.900 0.900 peak 804 spectrum 1 weight 0.10000E+01 volume 0.33479E-02 ppm1 7.294 ppm2 7.064 CV 1
ASSI { 805}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 41 and name HZ3 ))
2.500 0.800 0.800 peak 805 spectrum 1 weight 0.10000E+01 volume 0.42002E-02 ppm1 7.525 ppm2 7.029 CV 1
ASSI { 808}
(( segid " " and resid 41 and name HZ2 ))
(( segid " " and resid 41 and name HH2 ))
2.300 0.600 0.600 peak 808 spectrum 1 weight 0.10000E+01 volume 0.66352E-02 ppm1 7.445 ppm2 6.951 CV 1
ASSI { 809}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 41 and name HH2 ))
2.800 2.800 3.200 peak 809 spectrum 1 weight 0.10000E+01 volume 0.90395E-02 ppm1 7.294 ppm2 6.935 CV 1
ASSI { 810}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 41 and name HH2 ))
2.500 0.800 0.800 peak 810 spectrum 1 weight 0.10000E+01 volume 0.40480E-02 ppm1 7.216 ppm2 6.943 CV 1
ASSI { 811}
(( segid " " and resid 24 and name HD21))
(( segid " " and resid 24 and name HD22))
1.800 0.400 0.400 peak 811 spectrum 1 weight 0.10000E+01 volume 0.20727E-01 ppm1 7.536 ppm2 6.923 CV 1
ASSI { 812}
(( segid " " and resid 55 and name HE21))
(( segid " " and resid 55 and name HE22))
1.900 0.500 0.500 peak 812 spectrum 1 weight 0.10000E+01 volume 0.11870E-01 ppm1 7.545 ppm2 6.893 CV 1
ASSI { 813}
(( segid " " and resid 9 and name HZ ))
( segid " " and resid 9 and name HE% )
1.900 0.400 0.400 peak 813 spectrum 1 weight 0.10000E+01 volume 0.23405E-01 ppm1 6.979 ppm2 6.902 CV 1
ASSI { 814}
(( segid " " and resid 27 and name HZ ))
( segid " " and resid 27 and name HD% )
3.800 1.800 1.800 peak 814 spectrum 1 weight 0.10000E+01 volume 0.16831E-02 ppm1 7.179 ppm2 6.888 CV 1
ASSI { 815}
( segid " " and resid 27 and name HE% )
( segid " " and resid 27 and name HD% )
2.100 0.500 0.500 peak 815 spectrum 1 weight 0.10000E+01 volume 0.14518E-01 ppm1 7.078 ppm2 6.885 CV 1
ASSI { 817}
( segid " " and resid 18 and name HD% )
( segid " " and resid 18 and name HE% )
2.200 0.600 0.600 peak 817 spectrum 1 weight 0.10000E+01 volume 0.12022E-01 ppm1 7.165 ppm2 6.798 CV 1
ASSI { 819}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 63 and name HZ ))
2.300 0.700 0.700 peak 819 spectrum 1 weight 0.10000E+01 volume 0.56610E-02 ppm1 6.943 ppm2 6.720 CV 1
ASSI { 820}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 63 and name HZ ))
3.800 1.800 1.800 peak 820 spectrum 1 weight 0.10000E+01 volume 0.11627E-02 ppm1 7.295 ppm2 6.712 CV 1
ASSI { 821}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 83 and name HE22))
1.800 0.400 0.400 peak 821 spectrum 1 weight 0.10000E+01 volume 0.14274E-01 ppm1 7.711 ppm2 6.687 CV 1
ASSI { 822}
(( segid " " and resid 9 and name HZ ))
( segid " " and resid 9 and name HD% )
3.600 1.600 1.600 peak 822 spectrum 1 weight 0.10000E+01 volume 0.17744E-02 ppm1 6.980 ppm2 6.655 CV 1
ASSI { 823}
(( segid " " and resid 62 and name HE1 ))
( segid " " and resid 9 and name HD% )
3.300 1.300 1.300 peak 823 spectrum 1 weight 0.10000E+01 volume 0.13878E-02 ppm1 8.187 ppm2 6.652 CV 1
ASSI { 825}
( segid " " and resid 9 and name HE% )
( segid " " and resid 9 and name HD% )
2.200 0.600 0.600 peak 825 spectrum 1 weight 0.10000E+01 volume 0.87657E-02 ppm1 6.895 ppm2 6.652 CV 1
ASSI { 827}
( segid " " and resid 63 and name HD% )
( segid " " and resid 28 and name HE% )
2.900 1.100 1.100 peak 827 spectrum 1 weight 0.10000E+01 volume 0.26053E-02 ppm1 7.292 ppm2 6.490 CV 1
ASSI { 828}
( segid " " and resid 28 and name HD% )
( segid " " and resid 28 and name HE% )
2.200 0.600 0.600 peak 828 spectrum 1 weight 0.10000E+01 volume 0.10135E-01 ppm1 7.217 ppm2 6.490 CV 1
ASSI { 833}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HN ))
2.400 0.700 0.700 peak 833 spectrum 1 weight 0.10000E+01 volume 0.31957E-02 ppm1 8.891 ppm2 8.614 CV 1
ASSI { 835}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
2.400 0.700 0.700 peak 835 spectrum 1 weight 0.10000E+01 volume 0.37740E-02 ppm1 8.609 ppm2 8.372 CV 1
ASSI { 841}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HN ))
2.800 1.000 1.000 peak 841 spectrum 1 weight 0.10000E+01 volume 0.17227E-02 ppm1 10.085 ppm2 9.897 CV 1
ASSI { 844}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HN ))
4.200 2.200 1.800 peak 844 spectrum 1 weight 0.10000E+01 volume 0.57219E-03 ppm1 8.564 ppm2 8.126 CV 1
ASSI { 845}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 44 and name HN ))
4.500 2.500 1.500 peak 845 spectrum 1 weight 0.10000E+01 volume 0.32870E-03 ppm1 8.608 ppm2 7.871 CV 1
ASSI { 846}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 84 and name HN ))
2.200 2.200 3.800 peak 846 spectrum 1 weight 0.10000E+01 volume 0.33784E-01 ppm1 8.560 ppm2 6.960 CV 1
ASSI { 848}
(( segid " " and resid 60 and name HN ))
( segid " " and resid 28 and name HE% )
4.700 2.700 1.300 peak 848 spectrum 1 weight 0.10000E+01 volume 0.41393E-03 ppm1 7.996 ppm2 6.490 CV 1
ASSI { 849}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 83 and name HE22))
3.600 1.600 1.600 peak 849 spectrum 1 weight 0.10000E+01 volume 0.93436E-03 ppm1 7.951 ppm2 6.690 CV 1
ASSI { 851}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 41 and name HD1 ))
4.600 2.600 1.400 peak 851 spectrum 1 weight 0.10000E+01 volume 0.31653E-03 ppm1 8.069 ppm2 7.605 CV 1
ASSI { 852}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 45 and name HN ))
3.900 1.900 1.900 peak 852 spectrum 1 weight 0.10000E+01 volume 0.10105E-02 ppm1 8.139 ppm2 7.579 CV 1
ASSI { 853}
(( segid " " and resid 62 and name HE1 ))
(( segid " " and resid 12 and name HN ))
3.500 3.500 2.500 peak 853 spectrum 1 weight 0.10000E+01 volume 0.38653E-03 ppm1 8.187 ppm2 7.561 CV 1
ASSI { 854}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 38 and name HN ))
4.500 2.600 1.500 peak 854 spectrum 1 weight 0.10000E+01 volume 0.32566E-03 ppm1 8.064 ppm2 7.535 CV 1
ASSI { 855}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 83 and name HE22))
3.100 1.200 1.200 peak 855 spectrum 1 weight 0.10000E+01 volume 0.12448E-02 ppm1 7.295 ppm2 6.678 CV 1
ASSI { 856}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 63 and name HZ ))
3.900 1.900 1.900 peak 856 spectrum 1 weight 0.10000E+01 volume 0.49914E-03 ppm1 7.217 ppm2 6.720 CV 1
ASSI { 857}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 63 and name HZ ))
3.500 1.500 1.500 peak 857 spectrum 1 weight 0.10000E+01 volume 0.10622E-02 ppm1 7.021 ppm2 6.720 CV 1
ASSI { 858}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 29 and name HN ))
5.100 3.300 0.900 peak 858 spectrum 1 weight 0.10000E+01 volume 0.31045E-03 ppm1 9.333 ppm2 8.821 CV 1
ASSI { 859}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HB3 ))
4.400 2.400 1.600 peak 859 spectrum 1 weight 0.10000E+01 volume 0.43219E-03 ppm1 7.359 ppm2 2.081 CV 1
ASSI { 861}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 56 and name HD2%)
4.800 2.900 1.200 peak 861 spectrum 1 weight 0.10000E+01 volume 0.33175E-03 ppm1 9.894 ppm2 0.996 CV 1
ASSI { 862}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 36 and name HG2%)
4.000 2.000 2.000 peak 862 spectrum 1 weight 0.10000E+01 volume 0.65437E-03 ppm1 8.829 ppm2 0.959 CV 1
ASSI { 865}
(( segid " " and resid 78 and name HD3 ))
(( segid " " and resid 77 and name HA ))
2.400 0.700 0.700 peak 865 spectrum 1 weight 0.10000E+01 volume 0.49306E-02 ppm1 3.402 ppm2 5.039 CV 1
ASSI { 867}
(( segid " " and resid 76 and name HD3 ))
(( segid " " and resid 75 and name HA ))
2.500 0.800 0.800 peak 867 spectrum 1 weight 0.10000E+01 volume 0.27423E-02 ppm1 3.710 ppm2 4.833 CV 1
ASSI { 871}
(( segid " " and resid 90 and name HD3 ))
(( segid " " and resid 89 and name HA ))
3.000 1.200 1.200 peak 871 spectrum 1 weight 0.10000E+01 volume 0.89175E-03 ppm1 3.683 ppm2 4.739 CV 1
ASSI { 878}
(( segid " " and resid 57 and name HD2 ))
(( segid " " and resid 29 and name HA ))
2.900 1.000 1.000 peak 878 spectrum 1 weight 0.10000E+01 volume 0.24805E-02 ppm1 3.296 ppm2 4.566 CV 1
ASSI { 884}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB2 ))
3.600 1.600 1.600 peak 884 spectrum 1 weight 0.10000E+01 volume 0.48393E-03 ppm1 4.235 ppm2 4.370 CV 1
ASSI { 885}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HB2 ))
1.800 0.400 0.400 peak 885 spectrum 1 weight 0.10000E+01 volume 0.12326E-01 ppm1 3.321 ppm2 4.360 CV 1
ASSI { 887}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HA ))
4.100 2.100 1.900 peak 887 spectrum 1 weight 0.10000E+01 volume 0.67869E-03 ppm1 4.135 ppm2 4.309 CV 1
ASSI { 888}
(( segid " " and resid 71 and name HA2 ))
(( segid " " and resid 71 and name HA1 ))
1.800 0.400 0.400 peak 888 spectrum 1 weight 0.10000E+01 volume 0.12144E-01 ppm1 3.885 ppm2 4.306 CV 1
ASSI { 890}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HA ))
2.900 1.000 1.000 peak 890 spectrum 1 weight 0.10000E+01 volume 0.32262E-02 ppm1 3.317 ppm2 4.236 CV 1
ASSI { 892}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name HA ))
2.800 1.000 1.000 peak 892 spectrum 1 weight 0.10000E+01 volume 0.17836E-02 ppm1 3.032 ppm2 5.086 CV 1
ASSI { 893}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HA ))
2.800 1.000 1.000 peak 893 spectrum 1 weight 0.10000E+01 volume 0.41393E-02 ppm1 2.934 ppm2 5.028 CV 1
ASSI { 898}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HA ))
2.400 0.700 0.700 peak 898 spectrum 1 weight 0.10000E+01 volume 0.42610E-02 ppm1 2.537 ppm2 4.944 CV 1
ASSI { 899}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 72 and name HA ))
2.300 0.700 0.700 peak 899 spectrum 1 weight 0.10000E+01 volume 0.60263E-02 ppm1 2.820 ppm2 4.932 CV 1
ASSI { 903}
(( segid " " and resid 47 and name HD3 ))
(( segid " " and resid 47 and name HA ))
4.200 2.200 1.800 peak 903 spectrum 1 weight 0.10000E+01 volume 0.63307E-03 ppm1 2.968 ppm2 4.835 CV 1
ASSI { 905}
(( segid " " and resid 33 and name HD3 ))
(( segid " " and resid 34 and name HA ))
3.800 1.800 1.800 peak 905 spectrum 1 weight 0.10000E+01 volume 0.20757E-03 ppm1 3.179 ppm2 4.730 CV 1
OR { 905}
(( segid " " and resid 33 and name HD2 ))
(( segid " " and resid 34 and name HA ))
ASSI { 906}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HA ))
2.500 0.800 0.800 peak 906 spectrum 1 weight 0.10000E+01 volume 0.68482E-02 ppm1 2.657 ppm2 4.724 CV 1
ASSI { 907}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HA ))
3.100 1.200 1.200 peak 907 spectrum 1 weight 0.10000E+01 volume 0.22005E-02 ppm1 2.843 ppm2 4.651 CV 1
ASSI { 908}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HA ))
3.100 1.200 1.200 peak 908 spectrum 1 weight 0.10000E+01 volume 0.27088E-02 ppm1 3.113 ppm2 4.623 CV 1
ASSI { 909}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 18 and name HA ))
3.100 1.200 1.200 peak 909 spectrum 1 weight 0.10000E+01 volume 0.33175E-02 ppm1 3.165 ppm2 4.598 CV 1
ASSI { 911}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 18 and name HA ))
2.700 0.900 0.900 peak 911 spectrum 1 weight 0.10000E+01 volume 0.27423E-02 ppm1 2.802 ppm2 4.596 CV 1
ASSI { 912}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 23 and name HA ))
4.000 2.000 2.000 peak 912 spectrum 1 weight 0.10000E+01 volume 0.57219E-03 ppm1 2.815 ppm2 4.478 CV 1
OR { 912}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 23 and name HA ))
ASSI { 914}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 60 and name HB2 ))
4.000 2.000 2.000 peak 914 spectrum 1 weight 0.10000E+01 volume 0.68482E-03 ppm1 2.635 ppm2 4.371 CV 1
ASSI { 917}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HA ))
2.800 1.000 1.000 peak 917 spectrum 1 weight 0.10000E+01 volume 0.35610E-02 ppm1 2.802 ppm2 4.314 CV 1
ASSI { 926}
(( segid " " and resid 74 and name HD2 ))
(( segid " " and resid 41 and name HA ))
2.600 0.800 0.800 peak 926 spectrum 1 weight 0.10000E+01 volume 0.14731E-02 ppm1 2.396 ppm2 4.131 CV 1
ASSI { 927}
(( segid " " and resid 47 and name HD3 ))
(( segid " " and resid 52 and name HA ))
3.200 3.200 2.800 peak 927 spectrum 1 weight 0.10000E+01 volume 0.15431E-02 ppm1 2.966 ppm2 4.066 CV 1
ASSI { 932}
(( segid " " and resid 66 and name HA2 ))
(( segid " " and resid 66 and name HA1 ))
2.000 0.500 0.500 peak 932 spectrum 1 weight 0.10000E+01 volume 0.67262E-02 ppm1 3.919 ppm2 4.084 CV 1
ASSI { 933}
(( segid " " and resid 20 and name HA2 ))
(( segid " " and resid 20 and name HA1 ))
1.800 0.400 0.400 peak 933 spectrum 1 weight 0.10000E+01 volume 0.19327E-01 ppm1 3.872 ppm2 4.066 CV 1
ASSI { 935}
(( segid " " and resid 10 and name HD2 ))
(( segid " " and resid 9 and name HA ))
2.300 0.700 0.700 peak 935 spectrum 1 weight 0.10000E+01 volume 0.55697E-02 ppm1 3.325 ppm2 4.050 CV 1
ASSI { 937}
(( segid " " and resid 76 and name HD3 ))
(( segid " " and resid 76 and name HD2 ))
1.800 0.400 0.400 peak 937 spectrum 1 weight 0.10000E+01 volume 0.83700E-02 ppm1 3.712 ppm2 3.925 CV 1
ASSI { 938}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HD2 ))
3.600 1.600 1.600 peak 938 spectrum 1 weight 0.10000E+01 volume 0.11779E-02 ppm1 3.805 ppm2 3.920 CV 1
ASSI { 941}
(( segid " " and resid 89 and name HD3 ))
(( segid " " and resid 89 and name HD2 ))
1.800 0.400 0.400 peak 941 spectrum 1 weight 0.10000E+01 volume 0.13118E-01 ppm1 3.622 ppm2 3.830 CV 1
ASSI { 942}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HA ))
3.000 1.100 1.100 peak 942 spectrum 1 weight 0.10000E+01 volume 0.37132E-02 ppm1 3.111 ppm2 3.966 CV 1
ASSI { 943}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 68 and name HA ))
3.300 3.300 2.700 peak 943 spectrum 1 weight 0.10000E+01 volume 0.22553E-02 ppm1 2.946 ppm2 3.855 CV 1
ASSI { 944}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 12 and name HB2 ))
1.600 0.300 0.600 peak 944 spectrum 1 weight 0.10000E+01 volume 0.24835E-01 ppm1 3.143 ppm2 3.599 CV 1
ASSI { 945}
(( segid " " and resid 41 and name HB3 ))
(( segid " " and resid 38 and name HA ))
2.700 2.700 3.300 peak 945 spectrum 1 weight 0.10000E+01 volume 0.17379E-01 ppm1 3.101 ppm2 3.490 CV 1
ASSI { 946}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name HB2 ))
1.800 0.400 0.400 peak 946 spectrum 1 weight 0.10000E+01 volume 0.10561E-01 ppm1 3.031 ppm2 3.490 CV 1
ASSI { 947}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HB2 ))
2.000 0.500 0.500 peak 947 spectrum 1 weight 0.10000E+01 volume 0.80349E-02 ppm1 3.111 ppm2 3.397 CV 1
ASSI { 948}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 5 and name HB ))
3.100 1.200 1.200 peak 948 spectrum 1 weight 0.10000E+01 volume 0.24409E-02 ppm1 2.835 ppm2 3.398 CV 1
ASSI { 949}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 29 and name HD2 ))
3.400 3.400 2.600 peak 949 spectrum 1 weight 0.10000E+01 volume 0.26175E-02 ppm1 3.025 ppm2 3.231 CV 1
OR { 949}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 29 and name HD3 ))
ASSI { 952}
(( segid " " and resid 78 and name HG2 ))
(( segid " " and resid 77 and name HA ))
4.400 2.400 1.600 peak 952 spectrum 1 weight 0.10000E+01 volume 0.98917E-03 ppm1 1.729 ppm2 5.035 CV 1
ASSI { 953}
(( segid " " and resid 13 and name HD3 ))
(( segid " " and resid 77 and name HA ))
4.200 2.200 1.800 peak 953 spectrum 1 weight 0.10000E+01 volume 0.28457E-03 ppm1 1.442 ppm2 5.035 CV 1
OR { 953}
(( segid " " and resid 13 and name HD2 ))
(( segid " " and resid 77 and name HA ))
ASSI { 954}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 63 and name HA ))
4.400 2.400 1.600 peak 954 spectrum 1 weight 0.10000E+01 volume 0.97090E-03 ppm1 2.151 ppm2 5.025 CV 1
OR { 954}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 63 and name HA ))
ASSI { 958}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 72 and name HA ))
3.900 1.900 1.900 peak 958 spectrum 1 weight 0.10000E+01 volume 0.20636E-02 ppm1 1.535 ppm2 4.928 CV 1
OR { 958}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 72 and name HA ))
ASSI { 959}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 75 and name HA ))
5.400 3.700 0.600 peak 959 spectrum 1 weight 0.10000E+01 volume 0.39262E-03 ppm1 2.345 ppm2 4.834 CV 1
ASSI { 961}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 75 and name HA ))
2.700 0.900 0.900 peak 961 spectrum 1 weight 0.10000E+01 volume 0.24592E-02 ppm1 2.094 ppm2 4.835 CV 1
ASSI { 962}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 47 and name HA ))
3.100 1.200 1.200 peak 962 spectrum 1 weight 0.10000E+01 volume 0.87354E-03 ppm1 1.588 ppm2 4.833 CV 1
ASSI { 964}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HA ))
3.300 1.400 1.400 peak 964 spectrum 1 weight 0.10000E+01 volume 0.11809E-02 ppm1 2.057 ppm2 4.811 CV 1
ASSI { 965}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HA ))
2.600 0.800 0.800 peak 965 spectrum 1 weight 0.10000E+01 volume 0.23131E-02 ppm1 2.215 ppm2 4.724 CV 1
ASSI { 969}
(( segid " " and resid 33 and name HG2 ))
(( segid " " and resid 34 and name HA ))
4.600 2.600 1.400 peak 969 spectrum 1 weight 0.10000E+01 volume 0.38958E-03 ppm1 1.472 ppm2 4.732 CV 1
OR { 969}
(( segid " " and resid 33 and name HG3 ))
(( segid " " and resid 34 and name HA ))
ASSI { 970}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 88 and name HA ))
4.800 2.800 1.200 peak 970 spectrum 1 weight 0.10000E+01 volume 0.88264E-03 ppm1 2.088 ppm2 4.655 CV 1
OR { 970}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 88 and name HA ))
ASSI { 972}
(( segid " " and resid 88 and name HB2 ))
(( segid " " and resid 88 and name HA ))
2.700 0.900 0.900 peak 972 spectrum 1 weight 0.10000E+01 volume 0.20027E-02 ppm1 1.637 ppm2 4.658 CV 1
ASSI { 973}
(( segid " " and resid 88 and name HB3 ))
(( segid " " and resid 88 and name HA ))
3.000 1.100 1.100 peak 973 spectrum 1 weight 0.10000E+01 volume 0.28488E-02 ppm1 1.519 ppm2 4.659 CV 1
ASSI { 974}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 48 and name HA ))
3.400 1.500 1.500 peak 974 spectrum 1 weight 0.10000E+01 volume 0.94656E-03 ppm1 1.479 ppm2 4.611 CV 1
OR { 974}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 48 and name HB ))
ASSI { 975}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 48 and name HB ))
4.600 2.600 1.400 peak 975 spectrum 1 weight 0.10000E+01 volume 0.54784E-03 ppm1 2.343 ppm2 4.606 CV 1
OR { 975}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 48 and name HA ))
OR { 975}
(( segid " " and resid 49 and name HG3 ))
(( segid " " and resid 48 and name HA ))
OR { 975}
(( segid " " and resid 49 and name HG3 ))
(( segid " " and resid 48 and name HB ))
ASSI { 980}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 67 and name HA ))
2.500 0.800 0.800 peak 980 spectrum 1 weight 0.10000E+01 volume 0.50219E-02 ppm1 1.777 ppm2 4.598 CV 1
ASSI { 981}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HA ))
2.500 0.800 0.800 peak 981 spectrum 1 weight 0.10000E+01 volume 0.57828E-02 ppm1 1.632 ppm2 4.568 CV 1
OR { 981}
(( segid " " and resid 29 and name HG3 ))
(( segid " " and resid 29 and name HA ))
ASSI { 982}
(( segid " " and resid 69 and name HB3 ))
(( segid " " and resid 69 and name HA ))
2.400 0.700 0.700 peak 982 spectrum 1 weight 0.10000E+01 volume 0.77004E-02 ppm1 1.868 ppm2 4.530 CV 1
OR { 982}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 69 and name HA ))
ASSI { 983}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HA ))
3.000 1.200 1.200 peak 983 spectrum 1 weight 0.10000E+01 volume 0.17866E-02 ppm1 1.523 ppm2 4.532 CV 1
ASSI { 984}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HA ))
3.000 1.100 1.100 peak 984 spectrum 1 weight 0.10000E+01 volume 0.24531E-02 ppm1 1.470 ppm2 4.529 CV 1
ASSI { 988}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 21 and name HA ))
3.000 1.100 1.100 peak 988 spectrum 1 weight 0.10000E+01 volume 0.21305E-02 ppm1 1.613 ppm2 4.498 CV 1
ASSI { 989}
(( segid " " and resid 86 and name HG12))
(( segid " " and resid 86 and name HA ))
3.400 1.500 1.500 peak 989 spectrum 1 weight 0.10000E+01 volume 0.85527E-03 ppm1 1.419 ppm2 4.492 CV 1
ASSI { 991}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 90 and name HA ))
4.200 2.200 1.800 peak 991 spectrum 1 weight 0.10000E+01 volume 0.58133E-03 ppm1 2.047 ppm2 4.428 CV 1
OR { 991}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 90 and name HA ))
ASSI { 994}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 90 and name HA ))
3.200 1.300 1.300 peak 994 spectrum 1 weight 0.10000E+01 volume 0.28944E-02 ppm1 2.308 ppm2 4.429 CV 1
ASSI { 996}
( segid " " and resid 79 and name HG2%)
(( segid " " and resid 77 and name HA ))
5.800 4.200 0.200 peak 996 spectrum 1 weight 0.10000E+01 volume 0.94353E-04 ppm1 1.286 ppm2 5.023 CV 1
ASSI { 998}
( segid " " and resid 80 and name HG1%)
(( segid " " and resid 77 and name HA ))
3.700 1.700 1.700 peak 998 spectrum 1 weight 0.10000E+01 volume 0.23283E-02 ppm1 0.886 ppm2 5.026 CV 1
ASSI { 1002}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 47 and name HA ))
3.800 1.800 1.800 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.75784E-03 ppm1 1.177 ppm2 4.834 CV 1
ASSI { 1005}
( segid " " and resid 80 and name HG2%)
(( segid " " and resid 81 and name HA ))
4.300 2.300 1.700 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.76391E-03 ppm1 0.849 ppm2 4.658 CV 1
ASSI { 1006}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 48 and name HA ))
3.100 1.200 1.200 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.17379E-02 ppm1 0.771 ppm2 4.611 CV 1
OR { 1006}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 48 and name HB ))
ASSI { 1008}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 48 and name HB ))
2.200 0.600 0.600 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.13757E-01 ppm1 1.169 ppm2 4.604 CV 1
OR { 1008}
( segid " " and resid 48 and name HG2%)
(( segid " " and resid 48 and name HA ))
ASSI { 1010}
( segid " " and resid 53 and name HG2%)
(( segid " " and resid 53 and name HA ))
2.800 1.000 1.000 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.49306E-02 ppm1 0.942 ppm2 4.602 CV 1
ASSI { 1011}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 53 and name HA ))
4.200 2.200 1.800 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.31653E-03 ppm1 0.915 ppm2 4.597 CV 1
ASSI { 1012}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 8 and name HA1 ))
3.000 1.100 1.100 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.29310E-02 ppm1 1.061 ppm2 4.580 CV 1
ASSI { 1013}
( segid " " and resid 51 and name HG2%)
(( segid " " and resid 51 and name HA ))
2.700 0.900 0.900 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.42914E-02 ppm1 1.184 ppm2 4.500 CV 1
ASSI { 1017}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 40 and name HA ))
4.200 2.200 1.800 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.58133E-03 ppm1 1.289 ppm2 4.340 CV 1
ASSI { 1019}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HA ))
2.600 0.800 0.800 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.43219E-02 ppm1 1.383 ppm2 4.313 CV 1
ASSI { 1020}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 71 and name HA1 ))
2.800 1.000 1.000 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.15126E-02 ppm1 1.141 ppm2 4.308 CV 1
ASSI { 1021}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 56 and name HA ))
2.900 1.000 1.000 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.33479E-02 ppm1 1.066 ppm2 4.299 CV 1
ASSI { 1022}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 56 and name HA ))
3.600 1.600 1.600 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.18931E-02 ppm1 0.985 ppm2 4.296 CV 1
ASSI { 1025}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 84 and name HA ))
3.000 1.100 1.100 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.57219E-02 ppm1 0.944 ppm2 4.289 CV 1
ASSI { 1028}
( segid " " and resid 80 and name HG2%)
(( segid " " and resid 80 and name HA ))
2.700 0.900 0.900 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.49610E-02 ppm1 0.851 ppm2 4.226 CV 1
ASSI { 1030}
(( segid " " and resid 37 and name HG ))
(( segid " " and resid 37 and name HA ))
2.400 0.700 0.700 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.75481E-02 ppm1 1.382 ppm2 4.196 CV 1
ASSI { 1031}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HA ))
2.500 0.800 0.800 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.63002E-02 ppm1 1.143 ppm2 4.194 CV 1
ASSI { 1032}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HA ))
2.400 0.800 0.800 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.61784E-02 ppm1 0.973 ppm2 4.167 CV 1
OR { 1032}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 36 and name HA ))
ASSI { 1033}
( segid " " and resid 44 and name HB% )
(( segid " " and resid 44 and name HA ))
2.200 0.600 0.600 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.14487E-01 ppm1 1.497 ppm2 4.145 CV 1
ASSI { 1034}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 41 and name HA ))
2.600 0.900 0.900 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.14913E-01 ppm1 1.397 ppm2 4.135 CV 1
ASSI { 1041}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 73 and name HA ))
2.100 0.500 0.500 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.80045E-02 ppm1 1.245 ppm2 4.062 CV 1
ASSI { 1042}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HA ))
2.500 0.800 0.800 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.33784E-02 ppm1 1.182 ppm2 4.055 CV 1
ASSI { 1045}
( segid " " and resid 35 and name HD2%)
(( segid " " and resid 35 and name HA ))
2.500 0.800 0.800 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.82783E-02 ppm1 0.961 ppm2 4.055 CV 1
ASSI { 1046}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 52 and name HA ))
2.100 0.500 0.500 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.15796E-01 ppm1 0.919 ppm2 4.063 CV 1
ASSI { 1049}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 39 and name HA ))
2.900 1.000 1.000 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.23405E-02 ppm1 0.770 ppm2 3.997 CV 1
ASSI { 1053}
(( segid " " and resid 45 and name HG13))
(( segid " " and resid 42 and name HA ))
2.300 0.600 0.600 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.36827E-02 ppm1 1.212 ppm2 3.906 CV 1
ASSI { 1054}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 42 and name HA ))
2.500 0.800 0.800 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.43827E-02 ppm1 0.877 ppm2 3.905 CV 1
ASSI { 1056}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 83 and name HA ))
2.300 0.600 0.600 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.40480E-02 ppm1 0.961 ppm2 3.894 CV 1
ASSI { 1059}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 30 and name HA ))
3.400 1.500 1.500 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.26570E-02 ppm1 1.011 ppm2 3.850 CV 1
ASSI { 1060}
( segid " " and resid 30 and name HG2%)
(( segid " " and resid 30 and name HA ))
2.500 0.800 0.800 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.38349E-02 ppm1 0.927 ppm2 3.852 CV 1
ASSI { 1062}
( segid " " and resid 88 and name HD1%)
(( segid " " and resid 89 and name HD2 ))
3.100 1.200 1.200 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.21731E-02 ppm1 0.892 ppm2 3.842 CV 1
OR { 1062}
( segid " " and resid 88 and name HD2%)
(( segid " " and resid 89 and name HD2 ))
ASSI { 1067}
(( segid " " and resid 87 and name HB3 ))
(( segid " " and resid 87 and name HA ))
2.400 0.700 0.700 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.84913E-02 ppm1 1.894 ppm2 4.324 CV 1
ASSI { 1070}
(( segid " " and resid 50 and name HG3 ))
(( segid " " and resid 50 and name HA ))
2.600 0.800 0.800 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.69392E-02 ppm1 2.274 ppm2 4.288 CV 1
ASSI { 1071}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HA ))
2.500 0.800 0.800 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.71523E-02 ppm1 2.091 ppm2 4.284 CV 1
ASSI { 1072}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 56 and name HA ))
2.700 2.700 3.300 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.58133E-02 ppm1 2.213 ppm2 4.277 CV 1
ASSI { 1074}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HA ))
2.500 0.800 0.800 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.49306E-02 ppm1 1.828 ppm2 4.211 CV 1
ASSI { 1076}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 37 and name HA ))
2.400 0.700 0.700 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.43219E-02 ppm1 2.268 ppm2 4.199 CV 1
ASSI { 1077}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 36 and name HA ))
2.300 0.700 0.700 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.10561E-01 ppm1 1.906 ppm2 4.168 CV 1
ASSI { 1078}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 36 and name HA ))
2.600 0.900 0.900 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.36523E-02 ppm1 2.124 ppm2 4.157 CV 1
ASSI { 1082}
(( segid " " and resid 10 and name HG3 ))
(( segid " " and resid 10 and name HA ))
3.500 1.500 1.500 peak 1082 spectrum 1 weight 0.10000E+01 volume 0.27149E-02 ppm1 1.640 ppm2 4.137 CV 1
OR { 1082}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HA ))
ASSI { 1086}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HA ))
2.600 0.900 0.900 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.76391E-02 ppm1 2.012 ppm2 4.053 CV 1
ASSI { 1088}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 35 and name HA ))
2.300 0.700 0.700 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.11657E-01 ppm1 1.763 ppm2 4.052 CV 1
OR { 1088}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HA ))
ASSI { 1091}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 39 and name HA ))
2.800 1.000 1.000 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.29888E-02 ppm1 2.456 ppm2 3.996 CV 1
ASSI { 1096}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HA ))
2.100 0.500 0.500 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.13970E-01 ppm1 1.862 ppm2 3.971 CV 1
ASSI { 1097}
(( segid " " and resid 78 and name HG2 ))
(( segid " " and resid 78 and name HD2 ))
2.500 0.800 0.800 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.32870E-02 ppm1 1.731 ppm2 3.956 CV 1
ASSI { 1098}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HD2 ))
3.600 1.600 1.600 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.13818E-02 ppm1 2.509 ppm2 3.929 CV 1
ASSI { 1107}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HD2 ))
2.600 0.800 0.800 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.40175E-02 ppm1 1.992 ppm2 3.840 CV 1
OR { 1107}
(( segid " " and resid 4 and name HG3 ))
(( segid " " and resid 4 and name HD2 ))
ASSI { 1109}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HA ))
2.900 1.000 1.000 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.35610E-02 ppm1 2.507 ppm2 3.802 CV 1
ASSI { 1110}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 76 and name HA ))
4.000 2.000 2.000 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.11231E-02 ppm1 2.343 ppm2 3.802 CV 1
ASSI { 1111}
(( segid " " and resid 76 and name HB3 ))
(( segid " " and resid 76 and name HA ))
2.500 0.800 0.800 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.38653E-02 ppm1 2.223 ppm2 3.802 CV 1
OR { 1111}
(( segid " " and resid 76 and name HG3 ))
(( segid " " and resid 76 and name HA ))
ASSI { 1114}
(( segid " " and resid 68 and name HB3 ))
(( segid " " and resid 68 and name HA ))
3.100 1.200 1.200 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.27209E-02 ppm1 0.051 ppm2 3.854 CV 1
ASSI { 1116}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 8 and name HA2 ))
2.800 1.000 1.000 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.19205E-02 ppm1 0.987 ppm2 3.618 CV 1
ASSI { 1118}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 34 and name HD3 ))
3.500 1.600 1.600 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.25444E-02 ppm1 1.018 ppm2 3.548 CV 1
ASSI { 1123}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 40 and name HD2 ))
6.000 4.800 0.000 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.23953E-04 ppm1 0.912 ppm2 3.329 CV 1
ASSI { 1127}
( segid " " and resid 61 and name HB% )
(( segid " " and resid 25 and name HD2 ))
3.300 1.400 1.400 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.13301E-02 ppm1 0.143 ppm2 3.126 CV 1
ASSI { 1129}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 74 and name HA ))
4.000 2.000 2.000 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.11900E-02 ppm1 0.486 ppm2 3.105 CV 1
ASSI { 1130}
( segid " " and resid 35 and name HD1%)
(( segid " " and resid 38 and name HD3 ))
3.000 1.100 1.100 peak 1130 spectrum 1 weight 0.10000E+01 volume 0.18718E-02 ppm1 0.995 ppm2 2.986 CV 1
ASSI { 1131}
( segid " " and resid 61 and name HB% )
(( segid " " and resid 25 and name HD3 ))
3.100 1.200 1.200 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.12083E-02 ppm1 0.142 ppm2 2.981 CV 1
ASSI { 1134}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 81 and name HB2 ))
4.000 2.000 2.000 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.16405E-02 ppm1 0.485 ppm2 2.551 CV 1
ASSI { 1136}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HB ))
3.400 1.400 1.400 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.28823E-02 ppm1 1.041 ppm2 2.483 CV 1
ASSI { 1138}
( segid " " and resid 53 and name HG2%)
(( segid " " and resid 53 and name HB ))
2.400 0.700 0.700 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.66048E-02 ppm1 0.943 ppm2 2.441 CV 1
ASSI { 1140}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HD2 ))
2.100 0.600 0.600 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.43219E-02 ppm1 0.790 ppm2 2.402 CV 1
ASSI { 1141}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 74 and name HD2 ))
2.700 0.900 0.900 peak 1141 spectrum 1 weight 0.10000E+01 volume 0.31045E-02 ppm1 0.878 ppm2 2.400 CV 1
ASSI { 1142}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 49 and name HG3 ))
3.200 1.300 1.300 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.17348E-02 ppm1 0.771 ppm2 2.344 CV 1
OR { 1142}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 49 and name HG2 ))
ASSI { 1143}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 76 and name HD3 ))
3.100 1.200 1.200 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.41089E-02 ppm1 2.093 ppm2 3.710 CV 1
ASSI { 1144}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 90 and name HD3 ))
2.900 1.000 1.000 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.21122E-02 ppm1 2.049 ppm2 3.682 CV 1
OR { 1144}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 90 and name HD3 ))
ASSI { 1145}
(( segid " " and resid 4 and name HG3 ))
(( segid " " and resid 4 and name HD3 ))
2.700 0.900 0.900 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.37436E-02 ppm1 1.985 ppm2 3.671 CV 1
OR { 1145}
(( segid " " and resid 4 and name HG2 ))
(( segid " " and resid 4 and name HD3 ))
ASSI { 1146}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 4 and name HD3 ))
3.000 1.100 1.100 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.32870E-02 ppm1 1.831 ppm2 3.659 CV 1
ASSI { 1147}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 34 and name HD2 ))
2.100 0.500 0.500 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.79438E-02 ppm1 1.912 ppm2 3.652 CV 1
ASSI { 1149}
(( segid " " and resid 37 and name HG ))
(( segid " " and resid 34 and name HD2 ))
3.500 1.500 1.500 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.29553E-02 ppm1 1.367 ppm2 3.653 CV 1
ASSI { 1151}
(( segid " " and resid 88 and name HB3 ))
(( segid " " and resid 89 and name HD3 ))
3.800 1.800 1.800 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.21731E-02 ppm1 1.519 ppm2 3.622 CV 1
ASSI { 1155}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HA ))
2.700 0.900 0.900 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.22309E-02 ppm1 1.831 ppm2 3.489 CV 1
ASSI { 1156}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 38 and name HA ))
3.000 1.200 1.200 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.21701E-02 ppm1 1.498 ppm2 3.489 CV 1
ASSI { 1158}
(( segid " " and resid 38 and name HG3 ))
(( segid " " and resid 38 and name HA ))
2.800 1.000 1.000 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.23557E-02 ppm1 1.325 ppm2 3.489 CV 1
ASSI { 1159}
(( segid " " and resid 78 and name HG3 ))
(( segid " " and resid 78 and name HD3 ))
2.600 0.900 0.900 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.22188E-02 ppm1 1.493 ppm2 3.404 CV 1
ASSI { 1160}
(( segid " " and resid 78 and name HG2 ))
(( segid " " and resid 78 and name HD3 ))
3.200 1.300 1.300 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.20483E-02 ppm1 1.732 ppm2 3.403 CV 1
ASSI { 1161}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HD3 ))
3.000 1.100 1.100 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.23070E-02 ppm1 2.118 ppm2 3.388 CV 1
OR { 1161}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HD2 ))
ASSI { 1165}
(( segid " " and resid 10 and name HD3 ))
(( segid " " and resid 10 and name HD2 ))
2.000 0.500 0.500 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.61784E-02 ppm1 1.841 ppm2 3.329 CV 1
ASSI { 1166}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HD2 ))
2.700 0.900 0.900 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.13118E-01 ppm1 1.741 ppm2 3.318 CV 1
ASSI { 1167}
(( segid " " and resid 10 and name HG3 ))
(( segid " " and resid 10 and name HD2 ))
2.500 0.800 0.800 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.41697E-02 ppm1 1.636 ppm2 3.327 CV 1
OR { 1167}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HD2 ))
ASSI { 1170}
(( segid " " and resid 29 and name HG2 ))
(( segid " " and resid 29 and name HD3 ))
2.300 0.700 0.700 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.89788E-02 ppm1 1.778 ppm2 3.226 CV 1
OR { 1170}
(( segid " " and resid 29 and name HG2 ))
(( segid " " and resid 29 and name HD2 ))
ASSI { 1172}
(( segid " " and resid 38 and name HG3 ))
(( segid " " and resid 38 and name HD2 ))
2.300 2.300 3.700 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.44132E-02 ppm1 1.327 ppm2 3.203 CV 1
ASSI { 1175}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HB2 ))
1.800 0.400 0.400 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.13635E-01 ppm1 1.860 ppm2 3.116 CV 1
ASSI { 1178}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 17 and name HD3 ))
2.300 0.700 0.700 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.79438E-02 ppm1 1.464 ppm2 3.080 CV 1
OR { 1178}
(( segid " " and resid 17 and name HG3 ))
(( segid " " and resid 17 and name HD2 ))
OR { 1178}
(( segid " " and resid 17 and name HG3 ))
(( segid " " and resid 17 and name HD3 ))
OR { 1178}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 17 and name HD2 ))
ASSI { 1179}
(( segid " " and resid 69 and name HD3 ))
(( segid " " and resid 69 and name HE2 ))
2.400 0.700 0.700 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.85527E-02 ppm1 1.693 ppm2 3.065 CV 1
OR { 1179}
(( segid " " and resid 69 and name HD2 ))
(( segid " " and resid 69 and name HE2 ))
ASSI { 1182}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 38 and name HD3 ))
1.900 1.900 4.100 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.10987E-01 ppm1 1.389 ppm2 2.998 CV 1
ASSI { 1183}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HD3 ))
4.500 2.600 1.500 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.16861E-03 ppm1 1.818 ppm2 2.995 CV 1
ASSI { 1186}
(( segid " " and resid 57 and name HD3 ))
(( segid " " and resid 57 and name HD2 ))
1.800 0.400 0.400 peak 1186 spectrum 1 weight 0.10000E+01 volume 0.93739E-02 ppm1 2.757 ppm2 3.301 CV 1
ASSI { 1187}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HB2 ))
1.800 0.400 0.400 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.13635E-01 ppm1 2.692 ppm2 3.184 CV 1
ASSI { 1188}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 18 and name HB2 ))
1.700 0.400 0.500 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.18809E-01 ppm1 2.802 ppm2 3.163 CV 1
ASSI { 1189}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HB2 ))
1.800 0.400 0.400 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.10805E-01 ppm1 2.396 ppm2 3.166 CV 1
ASSI { 1192}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name HB2 ))
1.700 0.400 0.500 peak 1192 spectrum 1 weight 0.10000E+01 volume 0.12935E-01 ppm1 2.407 ppm2 2.949 CV 1
ASSI { 1195}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 26 and name HB2 ))
1.900 0.400 0.400 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.13331E-01 ppm1 2.632 ppm2 2.909 CV 1
ASSI { 1196}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 77 and name HB2 ))
1.700 0.300 0.500 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.17561E-01 ppm1 2.495 ppm2 2.906 CV 1
ASSI { 1197}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 27 and name HB2 ))
1.600 0.300 0.600 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.23192E-01 ppm1 2.570 ppm2 2.842 CV 1
ASSI { 1198}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 40 and name HB2 ))
4.100 2.100 1.900 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.45349E-03 ppm1 0.917 ppm2 2.278 CV 1
ASSI { 1199}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 40 and name HB2 ))
3.200 1.300 1.300 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.22797E-02 ppm1 0.875 ppm2 2.263 CV 1
ASSI { 1200}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 40 and name HB2 ))
4.200 2.200 1.800 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.78522E-03 ppm1 0.792 ppm2 2.273 CV 1
ASSI { 1204}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 52 and name HB ))
2.500 0.800 0.800 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.45349E-02 ppm1 0.916 ppm2 2.127 CV 1
ASSI { 1205}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 52 and name HB ))
3.600 1.600 1.600 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.93739E-03 ppm1 0.629 ppm2 2.129 CV 1
ASSI { 1207}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 75 and name HB ))
2.300 0.600 0.600 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.56306E-02 ppm1 0.485 ppm2 2.097 CV 1
ASSI { 1208}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 45 and name HB ))
2.300 0.600 0.600 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.71220E-02 ppm1 0.781 ppm2 2.048 CV 1
ASSI { 1211}
( segid " " and resid 80 and name HG2%)
(( segid " " and resid 80 and name HB ))
2.300 0.700 0.700 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.74570E-02 ppm1 0.850 ppm2 2.040 CV 1
ASSI { 1212}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HB2 ))
2.700 0.900 0.900 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.58133E-02 ppm1 0.721 ppm2 2.032 CV 1
OR { 1212}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HD2 ))
ASSI { 1213}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HD2 ))
2.200 0.600 0.600 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.49914E-02 ppm1 0.981 ppm2 2.023 CV 1
OR { 1213}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HB2 ))
ASSI { 1214}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 31 and name HB2 ))
2.600 0.900 0.900 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.29979E-02 ppm1 1.016 ppm2 2.018 CV 1
ASSI { 1217}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 86 and name HB ))
2.200 0.600 0.600 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.94959E-02 ppm1 0.918 ppm2 1.919 CV 1
ASSI { 1221}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HB2 ))
2.500 0.800 0.800 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.10257E-01 ppm1 1.017 ppm2 1.908 CV 1
ASSI { 1222}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 36 and name HB ))
2.300 0.700 0.700 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.10257E-01 ppm1 0.972 ppm2 1.907 CV 1
OR { 1222}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HB ))
ASSI { 1223}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 78 and name HB3 ))
3.300 1.400 1.400 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.11413E-02 ppm1 0.487 ppm2 1.907 CV 1
ASSI { 1226}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HD3 ))
2.400 0.700 0.700 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.29949E-02 ppm1 0.722 ppm2 1.836 CV 1
ASSI { 1227}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 56 and name HG ))
2.300 0.700 0.700 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.63611E-02 ppm1 1.061 ppm2 1.808 CV 1
OR { 1227}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 56 and name HB2 ))
ASSI { 1230}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 56 and name HG ))
4.400 2.500 1.600 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.42914E-03 ppm1 0.870 ppm2 1.793 CV 1
OR { 1230}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 56 and name HB2 ))
ASSI { 1231}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 78 and name HG2 ))
4.400 2.400 1.600 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.71826E-03 ppm1 0.487 ppm2 1.735 CV 1
ASSI { 1234}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 57 and name HD3 ))
3.100 1.200 1.200 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.19235E-02 ppm1 1.544 ppm2 2.765 CV 1
ASSI { 1235}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HB2 ))
1.700 0.400 0.500 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.14822E-01 ppm1 2.213 ppm2 2.666 CV 1
ASSI { 1237}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HG2 ))
4.000 2.000 2.000 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.64524E-03 ppm1 2.056 ppm2 2.646 CV 1
ASSI { 1238}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 27 and name HB3 ))
2.400 0.700 0.700 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.36523E-02 ppm1 1.692 ppm2 2.582 CV 1
ASSI { 1240}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 39 and name HG2 ))
2.900 1.100 1.100 peak 1240 spectrum 1 weight 0.10000E+01 volume 0.19083E-02 ppm1 2.118 ppm2 2.575 CV 1
ASSI { 1241}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HG3 ))
3.400 1.400 1.400 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.10805E-02 ppm1 2.027 ppm2 2.572 CV 1
ASSI { 1244}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 76 and name HB2 ))
2.400 0.700 0.700 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.38349E-02 ppm1 2.343 ppm2 2.506 CV 1
ASSI { 1246}
(( segid " " and resid 58 and name HG13))
(( segid " " and resid 58 and name HB ))
2.700 0.900 0.900 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.25414E-02 ppm1 1.677 ppm2 2.480 CV 1
ASSI { 1247}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 83 and name HG2 ))
1.600 0.300 0.600 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.23679E-01 ppm1 2.136 ppm2 2.470 CV 1
ASSI { 1248}
(( segid " " and resid 83 and name HB3 ))
(( segid " " and resid 83 and name HG2 ))
2.600 0.800 0.800 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.49306E-02 ppm1 2.005 ppm2 2.471 CV 1
ASSI { 1249}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HG3 ))
2.200 0.600 0.600 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.10622E-01 ppm1 2.324 ppm2 2.457 CV 1
ASSI { 1250}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 55 and name HG2 ))
2.400 0.700 0.700 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.97697E-02 ppm1 2.074 ppm2 2.435 CV 1
OR { 1250}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 55 and name HG3 ))
ASSI { 1253}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 89 and name HB2 ))
1.900 0.500 0.500 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.91305E-02 ppm1 1.953 ppm2 2.395 CV 1
ASSI { 1254}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HG2 ))
2.300 0.600 0.600 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.16953E-01 ppm1 2.081 ppm2 2.358 CV 1
ASSI { 1258}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 90 and name HB2 ))
2.000 0.500 0.500 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.20544E-01 ppm1 2.039 ppm2 2.280 CV 1
OR { 1258}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 90 and name HB2 ))
ASSI { 1260}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 40 and name HB2 ))
1.700 0.400 0.500 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.21336E-01 ppm1 1.882 ppm2 2.269 CV 1
ASSI { 1261}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 4 and name HB2 ))
1.900 0.400 0.400 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.10805E-01 ppm1 1.836 ppm2 2.262 CV 1
ASSI { 1264}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 87 and name HG3 ))
2.000 0.500 0.500 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.21305E-01 ppm1 1.971 ppm2 2.203 CV 1
ASSI { 1265}
(( segid " " and resid 87 and name HB3 ))
(( segid " " and resid 87 and name HG3 ))
2.900 1.000 1.000 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.42914E-02 ppm1 1.894 ppm2 2.206 CV 1
ASSI { 1266}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HG2 ))
2.600 0.800 0.800 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.98917E-02 ppm1 1.865 ppm2 2.149 CV 1
ASSI { 1267}
(( segid " " and resid 67 and name HB3 ))
(( segid " " and resid 67 and name HG2 ))
2.400 0.700 0.700 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.63915E-02 ppm1 1.750 ppm2 2.150 CV 1
ASSI { 1269}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HB2 ))
2.600 0.800 0.800 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.45654E-02 ppm1 1.635 ppm2 2.068 CV 1
OR { 1269}
(( segid " " and resid 10 and name HG3 ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 1270}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HB2 ))
1.600 0.300 0.600 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.19448E-01 ppm1 1.185 ppm2 2.016 CV 1
ASSI { 1281}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 38 and name HB2 ))
1.700 0.400 0.500 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.11231E-01 ppm1 1.387 ppm2 1.813 CV 1
ASSI { 1283}
(( segid " " and resid 82 and name HG2 ))
(( segid " " and resid 82 and name HD2 ))
1.800 1.800 4.200 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.34697E-01 ppm1 1.475 ppm2 1.680 CV 1
OR { 1283}
(( segid " " and resid 82 and name HG2 ))
(( segid " " and resid 82 and name HD3 ))
ASSI { 1284}
(( segid " " and resid 82 and name HG3 ))
(( segid " " and resid 82 and name HD3 ))
2.000 0.500 0.500 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.27940E-01 ppm1 1.399 ppm2 1.683 CV 1
OR { 1284}
(( segid " " and resid 82 and name HG3 ))
(( segid " " and resid 82 and name HD2 ))
ASSI { 1289}
(( segid " " and resid 84 and name HG13))
(( segid " " and resid 84 and name HG12))
1.600 0.300 0.600 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.17866E-01 ppm1 1.083 ppm2 1.552 CV 1
ASSI { 1290}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 57 and name HB3 ))
3.300 1.400 1.400 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.15522E-02 ppm1 0.635 ppm2 1.694 CV 1
ASSI { 1293}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 21 and name HB3 ))
2.100 0.600 0.600 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.17348E-01 ppm1 0.906 ppm2 1.659 CV 1
OR { 1293}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HB2 ))
OR { 1293}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 21 and name HB2 ))
OR { 1293}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HB3 ))
ASSI { 1295}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HB ))
2.000 0.500 0.500 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.11231E-01 ppm1 0.831 ppm2 1.639 CV 1
ASSI { 1301}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 42 and name HB3 ))
2.400 0.700 0.700 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.46567E-02 ppm1 0.630 ppm2 1.491 CV 1
ASSI { 1307}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HD3 ))
3.700 1.700 1.700 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.36219E-02 ppm1 0.786 ppm2 1.388 CV 1
ASSI { 1310}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HG ))
2.200 0.600 0.600 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.99524E-02 ppm1 1.017 ppm2 1.384 CV 1
ASSI { 1311}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 13 and name HB3 ))
2.400 0.700 0.700 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.97090E-02 ppm1 0.730 ppm2 1.383 CV 1
ASSI { 1312}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 47 and name HB3 ))
3.300 1.300 1.300 peak 1312 spectrum 1 weight 0.10000E+01 volume 0.17561E-02 ppm1 0.628 ppm2 1.357 CV 1
ASSI { 1313}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HG13))
2.400 0.700 0.700 peak 1313 spectrum 1 weight 0.10000E+01 volume 0.59958E-02 ppm1 0.974 ppm2 1.310 CV 1
OR { 1313}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 36 and name HG13))
ASSI { 1314}
(( segid " " and resid 84 and name HG13))
( segid " " and resid 43 and name HG2%)
3.100 1.200 1.200 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.67565E-02 ppm1 1.093 ppm2 1.290 CV 1
ASSI { 1315}
( segid " " and resid 58 and name HD1%)
( segid " " and resid 58 and name HG2%)
2.400 0.700 0.700 peak 1315 spectrum 1 weight 0.10000E+01 volume 0.55697E-02 ppm1 1.039 ppm2 1.256 CV 1
ASSI { 1318}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 86 and name HG13))
2.300 0.700 0.700 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.54176E-02 ppm1 0.844 ppm2 1.216 CV 1
ASSI { 1319}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HB3 ))
2.300 0.700 0.700 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.41089E-02 ppm1 0.716 ppm2 1.175 CV 1
ASSI { 1322}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 13 and name HG2 ))
1.800 0.400 0.400 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.12570E-01 ppm1 0.746 ppm2 1.101 CV 1
ASSI { 1324}
( segid " " and resid 42 and name HD2%)
( segid " " and resid 52 and name HG1%)
2.400 0.700 0.700 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.56002E-02 ppm1 0.631 ppm2 0.992 CV 1
ASSI { 1325}
( segid " " and resid 42 and name HD1%)
( segid " " and resid 52 and name HG1%)
1.600 0.300 0.600 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.11078E+00 ppm1 0.775 ppm2 0.991 CV 1
ASSI { 1326}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HG2 ))
1.700 0.300 0.500 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.12205E-01 ppm1 0.721 ppm2 0.986 CV 1
ASSI { 1327}
( segid " " and resid 75 and name HG2%)
( segid " " and resid 75 and name HG1%)
2.200 0.600 0.600 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.10470E-01 ppm1 0.486 ppm2 0.964 CV 1
ASSI { 1328}
( segid " " and resid 42 and name HD2%)
( segid " " and resid 52 and name HG2%)
2.000 0.500 0.500 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.15522E-01 ppm1 0.632 ppm2 0.921 CV 1
ASSI { 1331}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 67 and name HA ))
4.900 3.000 1.100 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.62089E-03 ppm1 0.136 ppm2 4.607 CV 1
ASSI { 1332}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HD3 ))
3.400 1.500 1.500 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.30375E-02 ppm1 2.509 ppm2 3.714 CV 1
ASSI { 1333}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 76 and name HD3 ))
2.900 1.000 1.000 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.36219E-02 ppm1 2.345 ppm2 3.714 CV 1
ASSI { 1335}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 90 and name HD3 ))
3.900 1.900 1.900 peak 1335 spectrum 1 weight 0.10000E+01 volume 0.17074E-02 ppm1 2.393 ppm2 3.690 CV 1
ASSI { 1339}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 26 and name HB3 ))
2.600 0.800 0.800 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.68482E-02 ppm1 6.893 ppm2 2.636 CV 1
ASSI { 1340}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 77 and name HA ))
2.900 1.000 1.000 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.22584E-02 ppm1 2.890 ppm2 5.034 CV 1
ASSI { 1342}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 28 and name HA ))
4.600 2.600 1.400 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.71826E-03 ppm1 1.630 ppm2 5.079 CV 1
OR { 1342}
(( segid " " and resid 29 and name HG3 ))
(( segid " " and resid 28 and name HA ))
ASSI { 1343}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 86 and name HA ))
4.100 2.100 1.900 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.11992E-02 ppm1 0.847 ppm2 4.491 CV 1
ASSI { 1348}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 12 and name HA ))
3.200 1.300 1.300 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.23101E-02 ppm1 3.149 ppm2 4.378 CV 1
ASSI { 1349}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 66 and name HA1 ))
3.100 3.100 2.900 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.19205E-02 ppm1 3.892 ppm2 4.082 CV 1
ASSI { 1350}
(( segid " " and resid 15 and name HD3 ))
(( segid " " and resid 15 and name HA ))
4.000 2.000 2.000 peak 1350 spectrum 1 weight 0.10000E+01 volume 0.12326E-02 ppm1 3.390 ppm2 4.362 CV 1
OR { 1350}
(( segid " " and resid 15 and name HD2 ))
(( segid " " and resid 15 and name HA ))
ASSI { 1351}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HA ))
2.300 0.700 0.700 peak 1351 spectrum 1 weight 0.10000E+01 volume 0.11718E-01 ppm1 3.225 ppm2 4.310 CV 1
OR { 1351}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HA ))
ASSI { 1358}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 76 and name HD3 ))
4.800 2.900 1.200 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.86437E-03 ppm1 0.485 ppm2 3.715 CV 1
ASSI { 1359}
( segid " " and resid 88 and name HD2%)
(( segid " " and resid 89 and name HD3 ))
4.000 2.000 2.000 peak 1359 spectrum 1 weight 0.10000E+01 volume 0.29340E-02 ppm1 0.886 ppm2 3.630 CV 1
ASSI { 1360}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 76 and name HD3 ))
3.700 1.700 1.700 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.14366E-02 ppm1 0.960 ppm2 3.719 CV 1
ASSI { 1361}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 34 and name HD2 ))
2.600 0.800 0.800 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.35306E-02 ppm1 1.019 ppm2 3.652 CV 1
ASSI { 1362}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 41 and name HB3 ))
3.700 3.700 2.300 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.25870E-02 ppm1 1.180 ppm2 3.104 CV 1
ASSI { 1363}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 40 and name HD2 ))
4.000 2.000 2.000 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.50523E-03 ppm1 1.297 ppm2 3.322 CV 1
OR { 1363}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 40 and name HD3 ))
ASSI { 1366}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 40 and name HD2 ))
2.600 0.900 0.900 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.37436E-02 ppm1 2.001 ppm2 3.326 CV 1
OR { 1366}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 40 and name HD3 ))
ASSI { 1367}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 62 and name HB2 ))
2.800 2.800 3.200 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.58741E-02 ppm1 2.857 ppm2 3.104 CV 1
ASSI { 1372}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HE2 ))
3.300 1.400 1.400 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.17135E-02 ppm1 1.373 ppm2 2.796 CV 1
OR { 1372}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HE3 ))
ASSI { 1373}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HD3 ))
4.000 2.000 2.000 peak 1373 spectrum 1 weight 0.10000E+01 volume 0.43219E-03 ppm1 1.284 ppm2 2.993 CV 1
ASSI { 1374}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name HD2 ))
2.400 0.700 0.700 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.93132E-02 ppm1 1.662 ppm2 3.180 CV 1
OR { 1374}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name HD3 ))
ASSI { 1376}
(( segid " " and resid 68 and name HB3 ))
(( segid " " and resid 68 and name HD2 ))
3.900 1.900 1.900 peak 1376 spectrum 1 weight 0.10000E+01 volume 0.11870E-02 ppm1 0.051 ppm2 1.369 CV 1
ASSI { 1378}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 31 and name HA ))
3.300 1.400 1.400 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.89175E-03 ppm1 0.721 ppm2 4.055 CV 1
ASSI { 1379}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 52 and name HA ))
5.300 3.600 0.700 peak 1379 spectrum 1 weight 0.10000E+01 volume 0.42306E-03 ppm1 0.630 ppm2 4.053 CV 1
ASSI { 1380}
(( segid " " and resid 68 and name HG3 ))
(( segid " " and resid 68 and name HA ))
3.900 1.900 1.900 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.24531E-03 ppm1 0.682 ppm2 3.855 CV 1
ASSI { 1381}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 37 and name HA ))
4.000 2.000 2.000 peak 1381 spectrum 1 weight 0.10000E+01 volume 0.12844E-02 ppm1 1.015 ppm2 4.197 CV 1
ASSI { 1383}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 75 and name HA ))
4.000 2.000 2.000 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.67869E-03 ppm1 0.485 ppm2 4.829 CV 1
ASSI { 1384}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB2 ))
3.000 1.100 1.100 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.23557E-02 ppm1 5.344 ppm2 1.922 CV 1
ASSI { 1393}
(( segid " " and resid 62 and name HD1 ))
( segid " " and resid 75 and name HG2%)
4.700 2.800 1.300 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.25079E-03 ppm1 10.216 ppm2 0.489 CV 1
ASSI { 1394}
(( segid " " and resid 62 and name HD1 ))
(( segid " " and resid 76 and name HB2 ))
5.100 3.200 0.900 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.27332E-03 ppm1 10.215 ppm2 2.510 CV 1
ASSI { 1395}
(( segid " " and resid 62 and name HD1 ))
(( segid " " and resid 76 and name HA ))
2.900 1.000 1.000 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.23161E-02 ppm1 10.215 ppm2 3.802 CV 1
ASSI { 1396}
(( segid " " and resid 62 and name HD1 ))
( segid " " and resid 9 and name HD% )
4.300 2.400 1.700 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.28671E-03 ppm1 10.214 ppm2 6.652 CV 1
ASSI { 1397}
(( segid " " and resid 62 and name HD1 ))
( segid " " and resid 9 and name HE% )
4.500 2.500 1.500 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.29705E-03 ppm1 10.216 ppm2 6.896 CV 1
ASSI { 1399}
(( segid " " and resid 62 and name HD1 ))
( segid " " and resid 14 and name HE% )
3.500 1.500 1.500 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.79742E-03 ppm1 10.215 ppm2 7.268 CV 1
ASSI { 1400}
(( segid " " and resid 62 and name HD1 ))
(( segid " " and resid 14 and name HZ ))
5.200 3.400 0.800 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.17227E-03 ppm1 10.216 ppm2 7.132 CV 1
ASSI { 1}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB2 ))
2.400 0.700 0.700 peak 1 spectrum 1 weight 0.10000E+01 volume 0.86391E-02 ppm1 4.315 ppm2 1.960 CV 1
ASSI { 2}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB2 ))
2.100 0.600 0.600 peak 2 spectrum 1 weight 0.10000E+01 volume 0.12165E-01 ppm1 4.300 ppm2 1.812 CV 1
ASSI { 3}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB3 ))
2.500 0.800 0.800 peak 3 spectrum 1 weight 0.10000E+01 volume 0.69933E-02 ppm1 4.292 ppm2 1.668 CV 1
ASSI { 5}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 85 and name HA ))
2.600 0.900 0.900 peak 5 spectrum 1 weight 0.10000E+01 volume 0.35791E-02 ppm1 4.932 ppm2 5.060 CV 1
ASSI { 8}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 85 and name HB2 ))
3.500 1.500 1.500 peak 8 spectrum 1 weight 0.10000E+01 volume 0.17690E-02 ppm1 4.929 ppm2 1.901 CV 1
ASSI { 10}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HB3 ))
2.300 0.700 0.700 peak 10 spectrum 1 weight 0.10000E+01 volume 0.95210E-02 ppm1 4.119 ppm2 1.728 CV 1
OR { 10}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HB2 ))
ASSI { 11}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HG2 ))
2.800 1.000 1.000 peak 11 spectrum 1 weight 0.10000E+01 volume 0.27211E-02 ppm1 4.117 ppm2 1.461 CV 1
ASSI { 12}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 72 and name HB2 ))
2.600 0.800 0.800 peak 12 spectrum 1 weight 0.10000E+01 volume 0.36085E-02 ppm1 3.846 ppm2 2.937 CV 1
ASSI { 13}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 31 and name HG3 ))
3.400 3.400 2.600 peak 13 spectrum 1 weight 0.10000E+01 volume 0.50484E-02 ppm1 3.847 ppm2 0.706 CV 1
ASSI { 15}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 78 and name HD3 ))
2.600 0.800 0.800 peak 15 spectrum 1 weight 0.10000E+01 volume 0.30443E-02 ppm1 3.969 ppm2 3.410 CV 1
ASSI { 20}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 57 and name HA ))
2.800 1.000 1.000 peak 20 spectrum 1 weight 0.10000E+01 volume 0.28621E-02 ppm1 4.564 ppm2 5.349 CV 1
ASSI { 22}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB2 ))
3.200 1.300 1.300 peak 22 spectrum 1 weight 0.10000E+01 volume 0.14340E-02 ppm1 4.566 ppm2 1.895 CV 1
ASSI { 26}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HB2 ))
2.700 0.900 0.900 peak 26 spectrum 1 weight 0.10000E+01 volume 0.35556E-02 ppm1 5.052 ppm2 1.899 CV 1
ASSI { 27}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HB3 ))
2.600 0.800 0.800 peak 27 spectrum 1 weight 0.10000E+01 volume 0.29855E-02 ppm1 5.050 ppm2 1.635 CV 1
ASSI { 32}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 43 and name HG2%)
3.400 1.400 1.400 peak 32 spectrum 1 weight 0.10000E+01 volume 0.13458E-02 ppm1 4.138 ppm2 1.291 CV 1
ASSI { 33}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HG2 ))
2.700 0.900 0.900 peak 33 spectrum 1 weight 0.10000E+01 volume 0.39787E-02 ppm1 4.597 ppm2 2.142 CV 1
ASSI { 34}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB2 ))
2.500 0.800 0.800 peak 34 spectrum 1 weight 0.10000E+01 volume 0.68759E-02 ppm1 4.596 ppm2 1.850 CV 1
ASSI { 36}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB2 ))
2.300 0.700 0.700 peak 36 spectrum 1 weight 0.10000E+01 volume 0.95797E-02 ppm1 4.497 ppm2 1.663 CV 1
OR { 36}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB3 ))
ASSI { 37}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HD1%)
3.000 1.100 1.100 peak 37 spectrum 1 weight 0.10000E+01 volume 0.58006E-02 ppm1 4.495 ppm2 0.889 CV 1
OR { 37}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HD2%)
ASSI { 40}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HB3 ))
3.100 1.200 1.200 peak 40 spectrum 1 weight 0.10000E+01 volume 0.23919E-02 ppm1 4.657 ppm2 2.223 CV 1
ASSI { 41}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.700 0.900 0.900 peak 41 spectrum 1 weight 0.10000E+01 volume 0.48955E-02 ppm1 4.301 ppm2 2.977 CV 1
ASSI { 43}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB2 ))
3.200 1.200 1.200 peak 43 spectrum 1 weight 0.10000E+01 volume 0.23097E-02 ppm1 4.469 ppm2 2.943 CV 1
ASSI { 44}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB3 ))
2.700 0.900 0.900 peak 44 spectrum 1 weight 0.10000E+01 volume 0.35674E-02 ppm1 4.466 ppm2 2.544 CV 1
ASSI { 46}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HD2 ))
2.900 1.100 1.100 peak 46 spectrum 1 weight 0.10000E+01 volume 0.31031E-02 ppm1 5.352 ppm2 3.298 CV 1
ASSI { 49}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB3 ))
2.500 0.800 0.800 peak 49 spectrum 1 weight 0.10000E+01 volume 0.41374E-02 ppm1 5.350 ppm2 1.701 CV 1
ASSI { 50}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HA ))
2.200 0.600 0.600 peak 50 spectrum 1 weight 0.10000E+01 volume 0.53657E-02 ppm1 4.211 ppm2 4.722 CV 1
ASSI { 51}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HD2 ))
3.400 1.400 1.400 peak 51 spectrum 1 weight 0.10000E+01 volume 0.22509E-02 ppm1 4.212 ppm2 3.186 CV 1
OR { 51}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HD3 ))
ASSI { 53}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB3 ))
2.800 0.900 0.900 peak 53 spectrum 1 weight 0.10000E+01 volume 0.29502E-02 ppm1 4.207 ppm2 1.668 CV 1
ASSI { 54}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HG3 ))
3.000 1.100 1.100 peak 54 spectrum 1 weight 0.10000E+01 volume 0.21334E-02 ppm1 4.207 ppm2 1.470 CV 1
OR { 54}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HG2 ))
ASSI { 59}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 88 and name HD2%)
3.600 1.600 1.600 peak 59 spectrum 1 weight 0.10000E+01 volume 0.25682E-02 ppm1 4.653 ppm2 0.890 CV 1
ASSI { 60}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 61 and name HB% )
2.200 0.600 0.600 peak 60 spectrum 1 weight 0.10000E+01 volume 0.11636E-01 ppm1 3.905 ppm2 0.138 CV 1
ASSI { 63}
(( segid " " and resid 78 and name HD2 ))
(( segid " " and resid 78 and name HD3 ))
1.900 0.400 0.400 peak 63 spectrum 1 weight 0.10000E+01 volume 0.91094E-02 ppm1 3.961 ppm2 3.410 CV 1
ASSI { 65}
(( segid " " and resid 78 and name HD2 ))
(( segid " " and resid 78 and name HG3 ))
3.400 1.400 1.400 peak 65 spectrum 1 weight 0.10000E+01 volume 0.16750E-02 ppm1 3.964 ppm2 1.498 CV 1
ASSI { 66}
(( segid " " and resid 78 and name HD2 ))
( segid " " and resid 75 and name HG2%)
4.100 2.100 1.900 peak 66 spectrum 1 weight 0.10000E+01 volume 0.11166E-02 ppm1 3.969 ppm2 0.488 CV 1
ASSI { 70}
(( segid " " and resid 78 and name HD3 ))
( segid " " and resid 75 and name HG2%)
2.700 0.900 0.900 peak 70 spectrum 1 weight 0.10000E+01 volume 0.22039E-02 ppm1 3.406 ppm2 0.488 CV 1
ASSI { 72}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 78 and name HD2 ))
2.300 0.700 0.700 peak 72 spectrum 1 weight 0.10000E+01 volume 0.71114E-02 ppm1 5.043 ppm2 3.962 CV 1
ASSI { 75}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HB3 ))
2.600 0.800 0.800 peak 75 spectrum 1 weight 0.10000E+01 volume 0.32030E-02 ppm1 5.044 ppm2 2.508 CV 1
ASSI { 76}
(( segid " " and resid 4 and name HD2 ))
(( segid " " and resid 3 and name HA ))
2.200 0.600 0.600 peak 76 spectrum 1 weight 0.10000E+01 volume 0.10344E-01 ppm1 3.834 ppm2 4.790 CV 1
ASSI { 77}
(( segid " " and resid 4 and name HD2 ))
(( segid " " and resid 4 and name HB2 ))
3.100 1.200 1.200 peak 77 spectrum 1 weight 0.10000E+01 volume 0.44724E-02 ppm1 3.824 ppm2 2.272 CV 1
ASSI { 78}
(( segid " " and resid 90 and name HD2 ))
(( segid " " and resid 90 and name HG2 ))
2.100 0.500 0.500 peak 78 spectrum 1 weight 0.10000E+01 volume 0.17925E-01 ppm1 3.829 ppm2 2.054 CV 1
OR { 78}
(( segid " " and resid 90 and name HD2 ))
(( segid " " and resid 90 and name HG3 ))
ASSI { 79}
(( segid " " and resid 4 and name HD3 ))
(( segid " " and resid 3 and name HA ))
2.200 0.600 0.600 peak 79 spectrum 1 weight 0.10000E+01 volume 0.69933E-02 ppm1 3.670 ppm2 4.805 CV 1
ASSI { 82}
(( segid " " and resid 76 and name HD2 ))
(( segid " " and resid 75 and name HA ))
2.700 0.900 0.900 peak 82 spectrum 1 weight 0.10000E+01 volume 0.44783E-02 ppm1 3.921 ppm2 4.830 CV 1
ASSI { 83}
(( segid " " and resid 76 and name HD2 ))
(( segid " " and resid 76 and name HG2 ))
3.800 1.800 1.800 peak 83 spectrum 1 weight 0.10000E+01 volume 0.18865E-03 ppm1 3.918 ppm2 2.344 CV 1
ASSI { 85}
(( segid " " and resid 76 and name HD2 ))
(( segid " " and resid 75 and name HB ))
2.500 0.800 0.800 peak 85 spectrum 1 weight 0.10000E+01 volume 0.14634E-02 ppm1 3.917 ppm2 2.091 CV 1
ASSI { 86}
(( segid " " and resid 89 and name HD2 ))
(( segid " " and resid 88 and name HA ))
2.100 0.600 0.600 peak 86 spectrum 1 weight 0.10000E+01 volume 0.11284E-01 ppm1 3.827 ppm2 4.668 CV 1
ASSI { 88}
(( segid " " and resid 89 and name HD2 ))
(( segid " " and resid 88 and name HB3 ))
3.800 1.800 1.800 peak 88 spectrum 1 weight 0.10000E+01 volume 0.16926E-02 ppm1 3.831 ppm2 1.513 CV 1
ASSI { 89}
(( segid " " and resid 89 and name HD3 ))
(( segid " " and resid 88 and name HA ))
2.200 0.600 0.600 peak 89 spectrum 1 weight 0.10000E+01 volume 0.86391E-02 ppm1 3.619 ppm2 4.659 CV 1
ASSI { 92}
(( segid " " and resid 34 and name HD2 ))
(( segid " " and resid 37 and name HB3 ))
2.600 0.900 0.900 peak 92 spectrum 1 weight 0.10000E+01 volume 0.16397E-02 ppm1 3.664 ppm2 1.346 CV 1
ASSI { 95}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 37 and name HB2 ))
4.100 2.100 1.900 peak 95 spectrum 1 weight 0.10000E+01 volume 0.18512E-02 ppm1 3.540 ppm2 1.923 CV 1
ASSI { 96}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 34 and name HG3 ))
2.500 0.800 0.800 peak 96 spectrum 1 weight 0.10000E+01 volume 0.30149E-02 ppm1 3.540 ppm2 1.776 CV 1
ASSI { 99}
(( segid " " and resid 10 and name HD2 ))
(( segid " " and resid 45 and name HA ))
2.800 1.000 1.000 peak 99 spectrum 1 weight 0.10000E+01 volume 0.40552E-02 ppm1 3.320 ppm2 3.864 CV 1
ASSI { 101}
(( segid " " and resid 79 and name HA ))
( segid " " and resid 79 and name HG2%)
2.600 0.800 0.800 peak 101 spectrum 1 weight 0.10000E+01 volume 0.65823E-02 ppm1 4.217 ppm2 1.291 CV 1
ASSI { 103}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB2 ))
2.700 0.900 0.900 peak 103 spectrum 1 weight 0.10000E+01 volume 0.27975E-02 ppm1 4.135 ppm2 3.592 CV 1
ASSI { 104}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB3 ))
2.600 0.800 0.800 peak 104 spectrum 1 weight 0.10000E+01 volume 0.30031E-02 ppm1 4.130 ppm2 3.124 CV 1
ASSI { 107}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 73 and name HG2%)
2.300 0.700 0.700 peak 107 spectrum 1 weight 0.10000E+01 volume 0.51130E-02 ppm1 4.129 ppm2 0.797 CV 1
ASSI { 110}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HA ))
3.100 3.100 2.900 peak 110 spectrum 1 weight 0.10000E+01 volume 0.24331E-02 ppm1 4.060 ppm2 4.596 CV 1
ASSI { 112}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB2 ))
2.700 0.900 0.900 peak 112 spectrum 1 weight 0.10000E+01 volume 0.67585E-02 ppm1 4.427 ppm2 2.275 CV 1
ASSI { 113}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HB3 ))
3.000 1.200 1.200 peak 113 spectrum 1 weight 0.10000E+01 volume 0.13634E-02 ppm1 4.432 ppm2 1.843 CV 1
ASSI { 115}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HB ))
2.600 0.800 0.800 peak 115 spectrum 1 weight 0.10000E+01 volume 0.56949E-02 ppm1 4.228 ppm2 2.035 CV 1
ASSI { 116}
(( segid " " and resid 80 and name HA ))
( segid " " and resid 80 and name HG1%)
2.500 0.800 0.800 peak 116 spectrum 1 weight 0.10000E+01 volume 0.76991E-02 ppm1 4.229 ppm2 0.869 CV 1
ASSI { 119}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB2 ))
2.700 0.900 0.900 peak 119 spectrum 1 weight 0.10000E+01 volume 0.22685E-02 ppm1 4.382 ppm2 3.607 CV 1
ASSI { 126}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB ))
2.700 0.900 0.900 peak 126 spectrum 1 weight 0.10000E+01 volume 0.44430E-02 ppm1 3.928 ppm2 3.394 CV 1
ASSI { 127}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 5 and name HG2%)
2.700 0.900 0.900 peak 127 spectrum 1 weight 0.10000E+01 volume 0.42785E-02 ppm1 3.922 ppm2 0.641 CV 1
ASSI { 128}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HB3 ))
2.200 0.600 0.600 peak 128 spectrum 1 weight 0.10000E+01 volume 0.83456E-02 ppm1 3.101 ppm2 1.229 CV 1
OR { 128}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HB2 ))
ASSI { 129}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB3 ))
2.200 0.600 0.600 peak 129 spectrum 1 weight 0.10000E+01 volume 0.14399E-01 ppm1 4.255 ppm2 3.984 CV 1
OR { 129}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB2 ))
ASSI { 130}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HG12))
2.900 1.100 1.100 peak 130 spectrum 1 weight 0.10000E+01 volume 0.29679E-02 ppm1 4.299 ppm2 1.565 CV 1
ASSI { 131}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HG13))
3.200 1.200 1.200 peak 131 spectrum 1 weight 0.10000E+01 volume 0.10461E-02 ppm1 4.294 ppm2 1.088 CV 1
ASSI { 134}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB3 ))
2.700 0.900 0.900 peak 134 spectrum 1 weight 0.10000E+01 volume 0.43431E-02 ppm1 3.487 ppm2 1.378 CV 1
ASSI { 135}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 30 and name HG2%)
3.500 1.500 1.500 peak 135 spectrum 1 weight 0.10000E+01 volume 0.12165E-02 ppm1 3.486 ppm2 0.943 CV 1
ASSI { 137}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HB ))
2.600 0.900 0.900 peak 137 spectrum 1 weight 0.10000E+01 volume 0.39494E-02 ppm1 3.863 ppm2 2.056 CV 1
ASSI { 138}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 10 and name HD3 ))
2.600 0.900 0.900 peak 138 spectrum 1 weight 0.10000E+01 volume 0.33675E-02 ppm1 3.858 ppm2 1.846 CV 1
ASSI { 139}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 10 and name HG3 ))
3.400 1.400 1.400 peak 139 spectrum 1 weight 0.10000E+01 volume 0.17807E-02 ppm1 3.862 ppm2 1.636 CV 1
OR { 139}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 10 and name HG2 ))
ASSI { 141}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB2 ))
2.800 1.000 1.000 peak 141 spectrum 1 weight 0.10000E+01 volume 0.44606E-02 ppm1 4.334 ppm2 3.195 CV 1
ASSI { 142}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB3 ))
2.700 0.900 0.900 peak 142 spectrum 1 weight 0.10000E+01 volume 0.36262E-02 ppm1 4.332 ppm2 2.700 CV 1
ASSI { 143}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 45 and name HG2%)
2.300 0.700 0.700 peak 143 spectrum 1 weight 0.10000E+01 volume 0.69346E-02 ppm1 3.867 ppm2 0.789 CV 1
ASSI { 146}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB3 ))
2.500 0.800 0.800 peak 146 spectrum 1 weight 0.10000E+01 volume 0.66411E-02 ppm1 4.415 ppm2 3.924 CV 1
OR { 146}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 147}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 48 and name HG2%)
2.700 0.900 0.900 peak 147 spectrum 1 weight 0.10000E+01 volume 0.39259E-02 ppm1 4.610 ppm2 1.165 CV 1
ASSI { 151}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB2 ))
2.300 0.700 0.700 peak 151 spectrum 1 weight 0.10000E+01 volume 0.65823E-02 ppm1 3.991 ppm2 2.313 CV 1
ASSI { 152}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB3 ))
2.800 1.000 1.000 peak 152 spectrum 1 weight 0.10000E+01 volume 0.40434E-02 ppm1 3.993 ppm2 2.131 CV 1
ASSI { 153}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 42 and name HB3 ))
3.900 1.900 1.900 peak 153 spectrum 1 weight 0.10000E+01 volume 0.23684E-02 ppm1 4.002 ppm2 1.478 CV 1
ASSI { 155}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB2 ))
3.300 1.400 1.400 peak 155 spectrum 1 weight 0.10000E+01 volume 0.18924E-02 ppm1 4.950 ppm2 2.852 CV 1
ASSI { 157}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HG2 ))
2.800 1.000 1.000 peak 157 spectrum 1 weight 0.10000E+01 volume 0.37143E-02 ppm1 3.963 ppm2 2.274 CV 1
OR { 157}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HG3 ))
ASSI { 158}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HB2 ))
2.200 0.600 0.600 peak 158 spectrum 1 weight 0.10000E+01 volume 0.16632E-01 ppm1 3.958 ppm2 1.959 CV 1
OR { 158}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HB3 ))
ASSI { 160}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 38 and name HB3 ))
2.200 0.600 0.600 peak 160 spectrum 1 weight 0.10000E+01 volume 0.78165E-02 ppm1 4.055 ppm2 1.381 CV 1
ASSI { 161}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 35 and name HD1%)
2.700 0.900 0.900 peak 161 spectrum 1 weight 0.10000E+01 volume 0.51071E-02 ppm1 4.049 ppm2 0.987 CV 1
ASSI { 162}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB3 ))
2.300 0.600 0.600 peak 162 spectrum 1 weight 0.10000E+01 volume 0.49896E-02 ppm1 3.909 ppm2 1.487 CV 1
ASSI { 165}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 42 and name HD2%)
2.400 0.700 0.700 peak 165 spectrum 1 weight 0.10000E+01 volume 0.58006E-02 ppm1 3.909 ppm2 0.636 CV 1
ASSI { 166}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB2 ))
2.700 0.900 0.900 peak 166 spectrum 1 weight 0.10000E+01 volume 0.43666E-02 ppm1 4.361 ppm2 2.126 CV 1
ASSI { 167}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB3 ))
2.900 1.100 1.100 peak 167 spectrum 1 weight 0.10000E+01 volume 0.22039E-02 ppm1 4.350 ppm2 2.014 CV 1
ASSI { 168}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HG2 ))
3.100 1.200 1.200 peak 168 spectrum 1 weight 0.10000E+01 volume 0.26446E-02 ppm1 4.359 ppm2 1.880 CV 1
OR { 168}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HG3 ))
ASSI { 170}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HD2 ))
2.400 0.700 0.700 peak 170 spectrum 1 weight 0.10000E+01 volume 0.40434E-02 ppm1 3.849 ppm2 2.046 CV 1
ASSI { 171}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HD3 ))
2.200 0.600 0.600 peak 171 spectrum 1 weight 0.10000E+01 volume 0.70527E-02 ppm1 3.849 ppm2 1.835 CV 1
ASSI { 172}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HG13))
2.600 0.800 0.800 peak 172 spectrum 1 weight 0.10000E+01 volume 0.38553E-02 ppm1 3.848 ppm2 1.515 CV 1
ASSI { 175}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 38 and name HD2 ))
2.600 0.900 0.900 peak 175 spectrum 1 weight 0.10000E+01 volume 0.33911E-02 ppm1 4.120 ppm2 3.195 CV 1
ASSI { 176}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 30 and name HB ))
2.800 2.800 3.200 peak 176 spectrum 1 weight 0.10000E+01 volume 0.57242E-02 ppm1 4.124 ppm2 1.795 CV 1
ASSI { 177}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 38 and name HB3 ))
2.800 1.000 1.000 peak 177 spectrum 1 weight 0.10000E+01 volume 0.83456E-02 ppm1 4.123 ppm2 1.389 CV 1
ASSI { 178}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HG2 ))
2.900 1.000 1.000 peak 178 spectrum 1 weight 0.10000E+01 volume 0.23097E-02 ppm1 3.928 ppm2 2.356 CV 1
ASSI { 181}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HB ))
3.000 1.200 1.200 peak 181 spectrum 1 weight 0.10000E+01 volume 0.16867E-02 ppm1 5.369 ppm2 2.484 CV 1
ASSI { 182}
(( segid " " and resid 58 and name HA ))
( segid " " and resid 58 and name HG2%)
2.600 0.800 0.800 peak 182 spectrum 1 weight 0.10000E+01 volume 0.32970E-02 ppm1 5.367 ppm2 1.258 CV 1
ASSI { 183}
(( segid " " and resid 58 and name HA ))
( segid " " and resid 58 and name HD1%)
2.400 0.700 0.700 peak 183 spectrum 1 weight 0.10000E+01 volume 0.44842E-02 ppm1 5.366 ppm2 1.047 CV 1
ASSI { 188}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HG2 ))
2.600 0.900 0.900 peak 188 spectrum 1 weight 0.10000E+01 volume 0.50954E-02 ppm1 4.193 ppm2 1.443 CV 1
OR { 188}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HG3 ))
ASSI { 189}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB2 ))
2.700 0.900 0.900 peak 189 spectrum 1 weight 0.10000E+01 volume 0.35850E-02 ppm1 4.295 ppm2 1.495 CV 1
ASSI { 191}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
2.900 1.000 1.000 peak 191 spectrum 1 weight 0.10000E+01 volume 0.34968E-02 ppm1 3.790 ppm2 1.564 CV 1
ASSI { 192}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HG2 ))
3.300 1.400 1.400 peak 192 spectrum 1 weight 0.10000E+01 volume 0.11931E-02 ppm1 3.788 ppm2 1.475 CV 1
ASSI { 193}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HG3 ))
2.600 0.900 0.900 peak 193 spectrum 1 weight 0.10000E+01 volume 0.36731E-02 ppm1 3.789 ppm2 1.311 CV 1
ASSI { 198}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB2 ))
2.300 0.700 0.700 peak 198 spectrum 1 weight 0.10000E+01 volume 0.11519E-01 ppm1 4.261 ppm2 2.218 CV 1
ASSI { 199}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB2 ))
2.300 0.700 0.700 peak 199 spectrum 1 weight 0.10000E+01 volume 0.11460E-01 ppm1 4.237 ppm2 2.016 CV 1
ASSI { 200}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 74 and name HD2 ))
2.100 0.600 0.600 peak 200 spectrum 1 weight 0.10000E+01 volume 0.49367E-02 ppm1 4.061 ppm2 2.402 CV 1
ASSI { 204}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HG2 ))
3.300 1.300 1.300 peak 204 spectrum 1 weight 0.10000E+01 volume 0.13929E-02 ppm1 3.869 ppm2 2.468 CV 1
ASSI { 205}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HB2 ))
2.300 0.600 0.600 peak 205 spectrum 1 weight 0.10000E+01 volume 0.49191E-02 ppm1 3.870 ppm2 2.163 CV 1
ASSI { 206}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HB3 ))
3.200 1.300 1.300 peak 206 spectrum 1 weight 0.10000E+01 volume 0.14105E-02 ppm1 3.868 ppm2 1.999 CV 1
ASSI { 212}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 43 and name HG2%)
2.700 0.900 0.900 peak 212 spectrum 1 weight 0.10000E+01 volume 0.56713E-02 ppm1 4.047 ppm2 1.290 CV 1
ASSI { 213}
(( segid " " and resid 48 and name HB ))
( segid " " and resid 48 and name HG2%)
2.300 0.700 0.700 peak 213 spectrum 1 weight 0.10000E+01 volume 0.93442E-02 ppm1 4.588 ppm2 1.167 CV 1
ASSI { 214}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 7 and name HA ))
2.700 0.900 0.900 peak 214 spectrum 1 weight 0.10000E+01 volume 0.27975E-02 ppm1 3.399 ppm2 4.616 CV 1
ASSI { 216}
(( segid " " and resid 6 and name HB ))
(( segid " " and resid 6 and name HA ))
2.600 0.900 0.900 peak 216 spectrum 1 weight 0.10000E+01 volume 0.41962E-02 ppm1 4.093 ppm2 4.481 CV 1
ASSI { 217}
(( segid " " and resid 6 and name HB ))
( segid " " and resid 6 and name HG2%)
2.400 0.700 0.700 peak 217 spectrum 1 weight 0.10000E+01 volume 0.89333E-02 ppm1 4.092 ppm2 1.155 CV 1
ASSI { 220}
(( segid " " and resid 51 and name HB ))
( segid " " and resid 51 and name HG2%)
2.400 0.700 0.700 peak 220 spectrum 1 weight 0.10000E+01 volume 0.79340E-02 ppm1 4.567 ppm2 1.185 CV 1
ASSI { 222}
(( segid " " and resid 5 and name HB ))
( segid " " and resid 5 and name HG2%)
2.400 0.700 0.700 peak 222 spectrum 1 weight 0.10000E+01 volume 0.72288E-02 ppm1 3.395 ppm2 0.644 CV 1
ASSI { 224}
(( segid " " and resid 79 and name HB ))
( segid " " and resid 80 and name HG2%)
3.600 1.600 1.600 peak 224 spectrum 1 weight 0.10000E+01 volume 0.10226E-02 ppm1 4.209 ppm2 0.858 CV 1
ASSI { 226}
(( segid " " and resid 41 and name HB2 ))
(( segid " " and resid 41 and name HB3 ))
1.800 0.400 0.400 peak 226 spectrum 1 weight 0.10000E+01 volume 0.98732E-02 ppm1 3.588 ppm2 3.124 CV 1
ASSI { 227}
(( segid " " and resid 41 and name HB2 ))
( segid " " and resid 30 and name HG2%)
2.900 1.100 1.100 peak 227 spectrum 1 weight 0.10000E+01 volume 0.34204E-02 ppm1 3.590 ppm2 0.926 CV 1
ASSI { 230}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 41 and name HH2 ))
3.400 1.500 1.500 peak 230 spectrum 1 weight 0.10000E+01 volume 0.21275E-02 ppm1 1.255 ppm2 6.939 CV 1
ASSI { 233}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 62 and name HB2 ))
2.700 0.900 0.900 peak 233 spectrum 1 weight 0.10000E+01 volume 0.24860E-02 ppm1 1.264 ppm2 3.134 CV 1
ASSI { 234}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 58 and name HB ))
2.300 0.600 0.600 peak 234 spectrum 1 weight 0.10000E+01 volume 0.61708E-02 ppm1 1.260 ppm2 2.480 CV 1
ASSI { 236}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 58 and name HG13))
2.600 0.800 0.800 peak 236 spectrum 1 weight 0.10000E+01 volume 0.28915E-02 ppm1 1.259 ppm2 1.685 CV 1
ASSI { 238}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 74 and name HG3 ))
2.700 0.900 0.900 peak 238 spectrum 1 weight 0.10000E+01 volume 0.50308E-02 ppm1 1.260 ppm2 0.885 CV 1
ASSI { 242}
( segid " " and resid 44 and name HB% )
(( segid " " and resid 74 and name HD2 ))
3.700 1.700 1.700 peak 242 spectrum 1 weight 0.10000E+01 volume 0.10990E-02 ppm1 1.500 ppm2 2.405 CV 1
ASSI { 243}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 86 and name HA ))
2.400 0.700 0.700 peak 243 spectrum 1 weight 0.10000E+01 volume 0.72875E-02 ppm1 0.923 ppm2 4.491 CV 1
ASSI { 244}
( segid " " and resid 84 and name HG2%)
(( segid " " and resid 84 and name HA ))
2.600 0.800 0.800 peak 244 spectrum 1 weight 0.10000E+01 volume 0.47369E-02 ppm1 0.894 ppm2 4.299 CV 1
ASSI { 246}
( segid " " and resid 84 and name HG2%)
(( segid " " and resid 84 and name HB ))
2.000 0.500 0.500 peak 246 spectrum 1 weight 0.10000E+01 volume 0.11402E-01 ppm1 0.894 ppm2 1.605 CV 1
ASSI { 247}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 36 and name HB ))
2.200 0.600 0.600 peak 247 spectrum 1 weight 0.10000E+01 volume 0.99320E-02 ppm1 0.971 ppm2 1.903 CV 1
ASSI { 252}
( segid " " and resid 61 and name HB% )
(( segid " " and resid 14 and name HB2 ))
3.300 1.300 1.300 peak 252 spectrum 1 weight 0.10000E+01 volume 0.24096E-02 ppm1 0.137 ppm2 3.168 CV 1
ASSI { 255}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 78 and name HA ))
2.500 0.800 0.800 peak 255 spectrum 1 weight 0.10000E+01 volume 0.46311E-02 ppm1 0.489 ppm2 4.801 CV 1
ASSI { 256}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 76 and name HD2 ))
3.700 1.700 1.700 peak 256 spectrum 1 weight 0.10000E+01 volume 0.24155E-02 ppm1 0.490 ppm2 3.898 CV 1
ASSI { 266}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 45 and name HG12))
2.300 0.700 0.700 peak 266 spectrum 1 weight 0.10000E+01 volume 0.53128E-02 ppm1 0.787 ppm2 1.918 CV 1
ASSI { 268}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 45 and name HG13))
3.400 1.500 1.500 peak 268 spectrum 1 weight 0.10000E+01 volume 0.23802E-02 ppm1 0.785 ppm2 1.224 CV 1
ASSI { 270}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HB ))
2.900 1.100 1.100 peak 270 spectrum 1 weight 0.10000E+01 volume 0.59358E-02 ppm1 0.988 ppm2 1.911 CV 1
ASSI { 271}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HG12))
2.700 0.900 0.900 peak 271 spectrum 1 weight 0.10000E+01 volume 0.35967E-02 ppm1 0.990 ppm2 1.479 CV 1
ASSI { 272}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 36 and name HG13))
2.600 0.800 0.800 peak 272 spectrum 1 weight 0.10000E+01 volume 0.43372E-02 ppm1 0.987 ppm2 1.290 CV 1
ASSI { 274}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 30 and name HB ))
2.500 0.800 0.800 peak 274 spectrum 1 weight 0.10000E+01 volume 0.63472E-02 ppm1 1.016 ppm2 1.820 CV 1
ASSI { 275}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 30 and name HG12))
2.500 0.800 0.800 peak 275 spectrum 1 weight 0.10000E+01 volume 0.49308E-02 ppm1 1.016 ppm2 1.665 CV 1
ASSI { 276}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 30 and name HG13))
2.600 0.900 0.900 peak 276 spectrum 1 weight 0.10000E+01 volume 0.35967E-02 ppm1 1.021 ppm2 1.512 CV 1
ASSI { 277}
( segid " " and resid 30 and name HD1%)
( segid " " and resid 42 and name HD2%)
3.400 1.400 1.400 peak 277 spectrum 1 weight 0.10000E+01 volume 0.23978E-02 ppm1 1.026 ppm2 0.635 CV 1
ASSI { 279}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HG13))
2.200 0.600 0.600 peak 279 spectrum 1 weight 0.10000E+01 volume 0.82281E-02 ppm1 0.829 ppm2 1.078 CV 1
ASSI { 283}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HG12))
2.400 0.700 0.700 peak 283 spectrum 1 weight 0.10000E+01 volume 0.53481E-02 ppm1 1.047 ppm2 1.879 CV 1
ASSI { 284}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HG13))
2.400 0.700 0.700 peak 284 spectrum 1 weight 0.10000E+01 volume 0.51424E-02 ppm1 1.050 ppm2 1.678 CV 1
ASSI { 287}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 86 and name HB ))
2.500 0.800 0.800 peak 287 spectrum 1 weight 0.10000E+01 volume 0.46840E-02 ppm1 0.853 ppm2 1.916 CV 1
ASSI { 288}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 31 and name HB3 ))
1.800 1.800 4.200 peak 288 spectrum 1 weight 0.10000E+01 volume 0.17161E-01 ppm1 0.850 ppm2 1.187 CV 1
ASSI { 289}
(( segid " " and resid 10 and name HD3 ))
(( segid " " and resid 9 and name HA ))
2.400 0.700 0.700 peak 289 spectrum 1 weight 0.10000E+01 volume 0.47075E-02 ppm1 1.842 ppm2 4.051 CV 1
ASSI { 291}
(( segid " " and resid 65 and name HA1 ))
(( segid " " and resid 65 and name HA2 ))
1.900 0.500 0.500 peak 291 spectrum 1 weight 0.10000E+01 volume 0.13165E-01 ppm1 4.169 ppm2 3.768 CV 1
ASSI { 293}
(( segid " " and resid 8 and name HA1 ))
(( segid " " and resid 8 and name HA2 ))
1.900 0.400 0.400 peak 293 spectrum 1 weight 0.10000E+01 volume 0.11460E-01 ppm1 4.569 ppm2 3.610 CV 1
ASSI { 297}
(( segid " " and resid 25 and name HD2 ))
(( segid " " and resid 25 and name HG3 ))
2.400 0.700 0.700 peak 297 spectrum 1 weight 0.10000E+01 volume 0.56772E-02 ppm1 3.129 ppm2 1.322 CV 1
ASSI { 300}
(( segid " " and resid 15 and name HD3 ))
(( segid " " and resid 15 and name HB3 ))
2.600 0.800 0.800 peak 300 spectrum 1 weight 0.10000E+01 volume 0.71114E-02 ppm1 3.385 ppm2 2.018 CV 1
OR { 300}
(( segid " " and resid 15 and name HD2 ))
(( segid " " and resid 15 and name HB3 ))
ASSI { 302}
(( segid " " and resid 17 and name HD3 ))
(( segid " " and resid 17 and name HA ))
4.300 2.300 1.700 peak 302 spectrum 1 weight 0.10000E+01 volume 0.97558E-03 ppm1 3.069 ppm2 4.193 CV 1
OR { 302}
(( segid " " and resid 17 and name HD2 ))
(( segid " " and resid 17 and name HA ))
ASSI { 303}
(( segid " " and resid 17 and name HD2 ))
(( segid " " and resid 17 and name HB3 ))
2.800 1.000 1.000 peak 303 spectrum 1 weight 0.10000E+01 volume 0.33675E-02 ppm1 3.074 ppm2 1.681 CV 1
OR { 303}
(( segid " " and resid 17 and name HD3 ))
(( segid " " and resid 17 and name HB2 ))
OR { 303}
(( segid " " and resid 17 and name HD3 ))
(( segid " " and resid 17 and name HB3 ))
OR { 303}
(( segid " " and resid 17 and name HD2 ))
(( segid " " and resid 17 and name HB2 ))
ASSI { 305}
(( segid " " and resid 29 and name HD3 ))
(( segid " " and resid 29 and name HA ))
2.100 0.600 0.600 peak 305 spectrum 1 weight 0.10000E+01 volume 0.15633E-01 ppm1 3.245 ppm2 4.566 CV 1
OR { 305}
(( segid " " and resid 29 and name HD2 ))
(( segid " " and resid 29 and name HA ))
ASSI { 306}
(( segid " " and resid 47 and name HD2 ))
(( segid " " and resid 47 and name HD3 ))
1.600 0.300 0.600 peak 306 spectrum 1 weight 0.10000E+01 volume 0.17748E-01 ppm1 3.236 ppm2 2.974 CV 1
ASSI { 307}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HB2 ))
2.500 0.800 0.800 peak 307 spectrum 1 weight 0.10000E+01 volume 0.68759E-02 ppm1 3.223 ppm2 1.872 CV 1
OR { 307}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HB2 ))
ASSI { 312}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HA ))
3.000 1.100 1.100 peak 312 spectrum 1 weight 0.10000E+01 volume 0.32970E-02 ppm1 2.938 ppm2 4.932 CV 1
ASSI { 313}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HB3 ))
1.900 0.400 0.400 peak 313 spectrum 1 weight 0.10000E+01 volume 0.11225E-01 ppm1 2.934 ppm2 2.804 CV 1
ASSI { 315}
(( segid " " and resid 33 and name HD3 ))
(( segid " " and resid 33 and name HG2 ))
2.300 0.700 0.700 peak 315 spectrum 1 weight 0.10000E+01 volume 0.99320E-02 ppm1 3.177 ppm2 1.477 CV 1
OR { 315}
(( segid " " and resid 33 and name HD2 ))
(( segid " " and resid 33 and name HG3 ))
OR { 315}
(( segid " " and resid 33 and name HD2 ))
(( segid " " and resid 33 and name HG2 ))
OR { 315}
(( segid " " and resid 33 and name HD3 ))
(( segid " " and resid 33 and name HG3 ))
ASSI { 316}
(( segid " " and resid 47 and name HD2 ))
(( segid " " and resid 47 and name HA ))
3.600 1.600 1.600 peak 316 spectrum 1 weight 0.10000E+01 volume 0.33969E-02 ppm1 3.232 ppm2 4.830 CV 1
ASSI { 317}
(( segid " " and resid 47 and name HD3 ))
(( segid " " and resid 47 and name HB2 ))
2.700 0.900 0.900 peak 317 spectrum 1 weight 0.10000E+01 volume 0.76991E-02 ppm1 2.961 ppm2 1.919 CV 1
ASSI { 319}
(( segid " " and resid 57 and name HD3 ))
(( segid " " and resid 57 and name HB3 ))
2.700 0.900 0.900 peak 319 spectrum 1 weight 0.10000E+01 volume 0.44313E-02 ppm1 2.761 ppm2 1.689 CV 1
ASSI { 321}
(( segid " " and resid 82 and name HE2 ))
(( segid " " and resid 82 and name HG3 ))
4.200 2.200 1.800 peak 321 spectrum 1 weight 0.10000E+01 volume 0.26270E-03 ppm1 2.993 ppm2 1.425 CV 1
OR { 321}
(( segid " " and resid 82 and name HE3 ))
(( segid " " and resid 82 and name HG3 ))
ASSI { 324}
(( segid " " and resid 85 and name HE3 ))
(( segid " " and resid 85 and name HD3 ))
2.700 0.900 0.900 peak 324 spectrum 1 weight 0.10000E+01 volume 0.38906E-02 ppm1 2.897 ppm2 1.665 CV 1
OR { 324}
(( segid " " and resid 85 and name HE3 ))
(( segid " " and resid 85 and name HD2 ))
ASSI { 325}
(( segid " " and resid 85 and name HE3 ))
(( segid " " and resid 85 and name HG3 ))
3.300 1.300 1.300 peak 325 spectrum 1 weight 0.10000E+01 volume 0.13282E-02 ppm1 2.895 ppm2 1.259 CV 1
ASSI { 327}
(( segid " " and resid 69 and name HE2 ))
(( segid " " and resid 69 and name HB3 ))
3.700 1.800 1.800 peak 327 spectrum 1 weight 0.10000E+01 volume 0.14692E-02 ppm1 3.059 ppm2 1.869 CV 1
OR { 327}
(( segid " " and resid 69 and name HE2 ))
(( segid " " and resid 69 and name HB2 ))
ASSI { 329}
(( segid " " and resid 40 and name HD2 ))
(( segid " " and resid 40 and name HA ))
2.700 0.900 0.900 peak 329 spectrum 1 weight 0.10000E+01 volume 0.54362E-02 ppm1 3.326 ppm2 4.347 CV 1
OR { 329}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 40 and name HA ))
ASSI { 331}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 40 and name HB2 ))
3.600 1.600 1.600 peak 331 spectrum 1 weight 0.10000E+01 volume 0.19923E-02 ppm1 3.326 ppm2 2.280 CV 1
OR { 331}
(( segid " " and resid 40 and name HD2 ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 332}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 40 and name HG3 ))
2.600 0.800 0.800 peak 332 spectrum 1 weight 0.10000E+01 volume 0.38260E-02 ppm1 3.325 ppm2 1.888 CV 1
OR { 332}
(( segid " " and resid 40 and name HD2 ))
(( segid " " and resid 40 and name HG3 ))
ASSI { 335}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HA ))
2.900 1.000 1.000 peak 335 spectrum 1 weight 0.10000E+01 volume 0.41492E-02 ppm1 3.493 ppm2 5.084 CV 1
ASSI { 339}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HB3 ))
1.800 0.400 0.400 peak 339 spectrum 1 weight 0.10000E+01 volume 0.21334E-01 ppm1 2.945 ppm2 2.544 CV 1
ASSI { 340}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 68 and name HE3 ))
1.700 0.400 0.500 peak 340 spectrum 1 weight 0.10000E+01 volume 0.13811E-01 ppm1 2.687 ppm2 2.151 CV 1
ASSI { 341}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 68 and name HD2 ))
2.800 1.000 1.000 peak 341 spectrum 1 weight 0.10000E+01 volume 0.22156E-02 ppm1 2.681 ppm2 1.366 CV 1
ASSI { 342}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 68 and name HD3 ))
2.500 0.800 0.800 peak 342 spectrum 1 weight 0.10000E+01 volume 0.22156E-02 ppm1 2.681 ppm2 0.360 CV 1
ASSI { 344}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HB3 ))
1.600 0.300 0.600 peak 344 spectrum 1 weight 0.10000E+01 volume 0.24037E-01 ppm1 1.814 ppm2 1.662 CV 1
ASSI { 345}
(( segid " " and resid 56 and name HB2 ))
( segid " " and resid 56 and name HD2%)
2.600 0.800 0.800 peak 345 spectrum 1 weight 0.10000E+01 volume 0.82281E-02 ppm1 1.816 ppm2 0.990 CV 1
ASSI { 348}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HA ))
2.800 1.000 1.000 peak 348 spectrum 1 weight 0.10000E+01 volume 0.15104E-02 ppm1 1.929 ppm2 4.192 CV 1
ASSI { 350}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HB3 ))
1.700 0.300 0.500 peak 350 spectrum 1 weight 0.10000E+01 volume 0.11636E-01 ppm1 1.925 ppm2 1.348 CV 1
ASSI { 351}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 37 and name HD1%)
2.600 0.900 0.900 peak 351 spectrum 1 weight 0.10000E+01 volume 0.19688E-02 ppm1 1.922 ppm2 1.149 CV 1
ASSI { 353}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 37 and name HA ))
3.100 1.200 1.200 peak 353 spectrum 1 weight 0.10000E+01 volume 0.23743E-02 ppm1 1.341 ppm2 4.194 CV 1
ASSI { 354}
(( segid " " and resid 37 and name HB3 ))
( segid " " and resid 37 and name HD1%)
3.300 1.400 1.400 peak 354 spectrum 1 weight 0.10000E+01 volume 0.35380E-02 ppm1 1.343 ppm2 1.153 CV 1
ASSI { 355}
(( segid " " and resid 37 and name HB3 ))
( segid " " and resid 37 and name HD2%)
2.500 0.800 0.800 peak 355 spectrum 1 weight 0.10000E+01 volume 0.34792E-02 ppm1 1.343 ppm2 1.017 CV 1
ASSI { 356}
(( segid " " and resid 81 and name HB2 ))
(( segid " " and resid 81 and name HA ))
2.600 0.900 0.900 peak 356 spectrum 1 weight 0.10000E+01 volume 0.35438E-02 ppm1 2.538 ppm2 4.651 CV 1
ASSI { 357}
(( segid " " and resid 81 and name HB2 ))
(( segid " " and resid 81 and name HB3 ))
1.800 0.400 0.400 peak 357 spectrum 1 weight 0.10000E+01 volume 0.14105E-01 ppm1 2.541 ppm2 2.221 CV 1
ASSI { 360}
(( segid " " and resid 81 and name HB3 ))
( segid " " and resid 75 and name HG2%)
3.300 1.300 1.300 peak 360 spectrum 1 weight 0.10000E+01 volume 0.24155E-02 ppm1 2.220 ppm2 0.487 CV 1
ASSI { 364}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 13 and name HD3 ))
2.500 2.500 3.500 peak 364 spectrum 1 weight 0.10000E+01 volume 0.23919E-02 ppm1 2.506 ppm2 1.437 CV 1
OR { 364}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 13 and name HD2 ))
ASSI { 365}
(( segid " " and resid 77 and name HB3 ))
( segid " " and resid 80 and name HG2%)
3.200 1.200 1.200 peak 365 spectrum 1 weight 0.10000E+01 volume 0.15515E-02 ppm1 2.500 ppm2 0.855 CV 1
ASSI { 369}
(( segid " " and resid 88 and name HB2 ))
(( segid " " and resid 88 and name HB3 ))
1.600 0.300 0.600 peak 369 spectrum 1 weight 0.10000E+01 volume 0.23978E-01 ppm1 1.639 ppm2 1.519 CV 1
ASSI { 370}
(( segid " " and resid 88 and name HB2 ))
( segid " " and resid 88 and name HD1%)
2.400 0.700 0.700 peak 370 spectrum 1 weight 0.10000E+01 volume 0.51189E-02 ppm1 1.640 ppm2 0.914 CV 1
ASSI { 373}
(( segid " " and resid 88 and name HB3 ))
( segid " " and resid 88 and name HD1%)
2.700 0.900 0.900 peak 373 spectrum 1 weight 0.10000E+01 volume 0.12636E-01 ppm1 1.524 ppm2 0.909 CV 1
ASSI { 377}
(( segid " " and resid 35 and name HB2 ))
( segid " " and resid 36 and name HD1%)
2.500 0.800 0.800 peak 377 spectrum 1 weight 0.10000E+01 volume 0.79927E-02 ppm1 1.748 ppm2 0.976 CV 1
OR { 377}
(( segid " " and resid 35 and name HB3 ))
( segid " " and resid 36 and name HD1%)
ASSI { 378}
(( segid " " and resid 68 and name HE3 ))
(( segid " " and resid 68 and name HG3 ))
3.600 1.600 1.600 peak 378 spectrum 1 weight 0.10000E+01 volume 0.18101E-02 ppm1 2.151 ppm2 0.687 CV 1
ASSI { 379}
(( segid " " and resid 68 and name HE3 ))
(( segid " " and resid 68 and name HD3 ))
3.100 1.200 1.200 peak 379 spectrum 1 weight 0.10000E+01 volume 0.15280E-02 ppm1 2.146 ppm2 0.359 CV 1
ASSI { 380}
(( segid " " and resid 68 and name HE3 ))
(( segid " " and resid 68 and name HB2 ))
3.100 1.200 1.200 peak 380 spectrum 1 weight 0.10000E+01 volume 0.37672E-02 ppm1 2.154 ppm2 0.124 CV 1
ASSI { 381}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 73 and name HA ))
2.700 0.900 0.900 peak 381 spectrum 1 weight 0.10000E+01 volume 0.23508E-02 ppm1 1.546 ppm2 4.072 CV 1
ASSI { 382}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 73 and name HG13))
2.600 0.800 0.800 peak 382 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 1.533 ppm2 1.248 CV 1
ASSI { 383}
(( segid " " and resid 73 and name HB ))
( segid " " and resid 73 and name HD1%)
2.500 0.800 0.800 peak 383 spectrum 1 weight 0.10000E+01 volume 0.26153E-02 ppm1 1.544 ppm2 0.870 CV 1
ASSI { 384}
(( segid " " and resid 73 and name HB ))
( segid " " and resid 84 and name HD1%)
2.700 0.900 0.900 peak 384 spectrum 1 weight 0.10000E+01 volume 0.92268E-02 ppm1 1.543 ppm2 0.824 CV 1
ASSI { 385}
(( segid " " and resid 86 and name HB ))
(( segid " " and resid 86 and name HA ))
2.700 0.900 0.900 peak 385 spectrum 1 weight 0.10000E+01 volume 0.42197E-02 ppm1 1.920 ppm2 4.503 CV 1
ASSI { 386}
(( segid " " and resid 86 and name HB ))
(( segid " " and resid 86 and name HG12))
2.100 0.600 0.600 peak 386 spectrum 1 weight 0.10000E+01 volume 0.18101E-01 ppm1 1.924 ppm2 1.411 CV 1
ASSI { 387}
(( segid " " and resid 86 and name HB ))
(( segid " " and resid 86 and name HG13))
2.700 0.900 0.900 peak 387 spectrum 1 weight 0.10000E+01 volume 0.23802E-02 ppm1 1.918 ppm2 1.218 CV 1
ASSI { 395}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 39 and name HA ))
4.000 2.000 2.000 peak 395 spectrum 1 weight 0.10000E+01 volume 0.99320E-03 ppm1 1.998 ppm2 3.984 CV 1
ASSI { 396}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HB3 ))
1.700 0.400 0.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.12577E-01 ppm1 1.992 ppm2 1.477 CV 1
ASSI { 398}
(( segid " " and resid 42 and name HB2 ))
( segid " " and resid 42 and name HD2%)
3.800 1.800 1.800 peak 398 spectrum 1 weight 0.10000E+01 volume 0.18101E-02 ppm1 1.990 ppm2 0.636 CV 1
ASSI { 400}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 42 and name HG ))
2.900 1.100 1.100 peak 400 spectrum 1 weight 0.10000E+01 volume 0.28856E-02 ppm1 1.478 ppm2 1.855 CV 1
ASSI { 401}
(( segid " " and resid 42 and name HB3 ))
( segid " " and resid 42 and name HD1%)
2.800 1.000 1.000 peak 401 spectrum 1 weight 0.10000E+01 volume 0.33499E-02 ppm1 1.480 ppm2 0.776 CV 1
ASSI { 403}
(( segid " " and resid 14 and name HB2 ))
( segid " " and resid 14 and name HD% )
2.300 0.700 0.700 peak 403 spectrum 1 weight 0.10000E+01 volume 0.95210E-02 ppm1 3.188 ppm2 7.108 CV 1
ASSI { 408}
(( segid " " and resid 84 and name HB ))
(( segid " " and resid 84 and name HA ))
2.800 1.000 1.000 peak 408 spectrum 1 weight 0.10000E+01 volume 0.20805E-02 ppm1 1.630 ppm2 4.298 CV 1
ASSI { 409}
(( segid " " and resid 84 and name HB ))
(( segid " " and resid 84 and name HG13))
2.900 1.000 1.000 peak 409 spectrum 1 weight 0.10000E+01 volume 0.14105E-02 ppm1 1.628 ppm2 1.095 CV 1
ASSI { 415}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HA ))
2.600 0.800 0.800 peak 415 spectrum 1 weight 0.10000E+01 volume 0.62296E-02 ppm1 2.812 ppm2 4.776 CV 1
OR { 415}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HA ))
ASSI { 418}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 10 and name HD2 ))
3.900 1.900 1.900 peak 418 spectrum 1 weight 0.10000E+01 volume 0.18101E-02 ppm1 2.060 ppm2 3.326 CV 1
ASSI { 421}
(( segid " " and resid 45 and name HB ))
( segid " " and resid 45 and name HD1%)
2.600 0.800 0.800 peak 421 spectrum 1 weight 0.10000E+01 volume 0.40434E-02 ppm1 2.053 ppm2 0.870 CV 1
ASSI { 424}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HB3 ))
1.800 0.400 0.400 peak 424 spectrum 1 weight 0.10000E+01 volume 0.20922E-01 ppm1 2.977 ppm2 2.803 CV 1
ASSI { 427}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 36 and name HG12))
3.000 1.100 1.100 peak 427 spectrum 1 weight 0.10000E+01 volume 0.15163E-02 ppm1 1.904 ppm2 1.487 CV 1
ASSI { 428}
(( segid " " and resid 36 and name HB ))
(( segid " " and resid 36 and name HG13))
3.300 1.300 1.300 peak 428 spectrum 1 weight 0.10000E+01 volume 0.10578E-02 ppm1 1.905 ppm2 1.311 CV 1
ASSI { 430}
(( segid " " and resid 30 and name HB ))
(( segid " " and resid 30 and name HA ))
3.200 1.300 1.300 peak 430 spectrum 1 weight 0.10000E+01 volume 0.12107E-02 ppm1 1.814 ppm2 3.846 CV 1
ASSI { 431}
(( segid " " and resid 30 and name HB ))
(( segid " " and resid 30 and name HG12))
3.200 1.200 1.200 peak 431 spectrum 1 weight 0.10000E+01 volume 0.17807E-02 ppm1 1.811 ppm2 1.662 CV 1
ASSI { 432}
(( segid " " and resid 30 and name HB ))
(( segid " " and resid 30 and name HG13))
2.900 1.100 1.100 peak 432 spectrum 1 weight 0.10000E+01 volume 0.21040E-02 ppm1 1.813 ppm2 1.522 CV 1
ASSI { 433}
(( segid " " and resid 30 and name HB ))
( segid " " and resid 30 and name HG2%)
2.400 0.700 0.700 peak 433 spectrum 1 weight 0.10000E+01 volume 0.57830E-02 ppm1 1.816 ppm2 0.941 CV 1
ASSI { 436}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HB3 ))
1.600 0.300 0.600 peak 436 spectrum 1 weight 0.10000E+01 volume 0.25095E-01 ppm1 1.903 ppm2 1.639 CV 1
OR { 436}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HD2 ))
ASSI { 438}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HG3 ))
3.200 1.300 1.300 peak 438 spectrum 1 weight 0.10000E+01 volume 0.21040E-02 ppm1 1.628 ppm2 1.263 CV 1
ASSI { 445}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HG2 ))
2.200 0.600 0.600 peak 445 spectrum 1 weight 0.10000E+01 volume 0.58300E-02 ppm1 2.661 ppm2 2.082 CV 1
ASSI { 446}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HG3 ))
3.100 1.200 1.200 peak 446 spectrum 1 weight 0.10000E+01 volume 0.22215E-02 ppm1 2.658 ppm2 1.781 CV 1
ASSI { 448}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HG3 ))
2.500 0.800 0.800 peak 448 spectrum 1 weight 0.10000E+01 volume 0.28680E-02 ppm1 2.219 ppm2 1.770 CV 1
ASSI { 449}
(( segid " " and resid 34 and name HB3 ))
( segid " " and resid 36 and name HD1%)
4.200 2.200 1.800 peak 449 spectrum 1 weight 0.10000E+01 volume 0.19865E-02 ppm1 2.219 ppm2 0.973 CV 1
OR { 449}
(( segid " " and resid 34 and name HB3 ))
( segid " " and resid 36 and name HG2%)
ASSI { 452}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 47 and name HA ))
2.900 1.000 1.000 peak 452 spectrum 1 weight 0.10000E+01 volume 0.29914E-02 ppm1 1.921 ppm2 4.828 CV 1
ASSI { 453}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 47 and name HA ))
3.000 1.100 1.100 peak 453 spectrum 1 weight 0.10000E+01 volume 0.16867E-02 ppm1 1.358 ppm2 4.828 CV 1
ASSI { 454}
(( segid " " and resid 39 and name HG2 ))
(( segid " " and resid 39 and name HA ))
3.100 1.200 1.200 peak 454 spectrum 1 weight 0.10000E+01 volume 0.17807E-02 ppm1 2.584 ppm2 3.997 CV 1
ASSI { 455}
(( segid " " and resid 39 and name HG2 ))
(( segid " " and resid 39 and name HG3 ))
1.500 0.300 0.700 peak 455 spectrum 1 weight 0.10000E+01 volume 0.42256E-01 ppm1 2.583 ppm2 2.451 CV 1
ASSI { 456}
(( segid " " and resid 39 and name HG2 ))
(( segid " " and resid 39 and name HB2 ))
2.200 0.600 0.600 peak 456 spectrum 1 weight 0.10000E+01 volume 0.17572E-01 ppm1 2.582 ppm2 2.323 CV 1
ASSI { 457}
(( segid " " and resid 39 and name HG2 ))
( segid " " and resid 36 and name HG2%)
3.100 1.200 1.200 peak 457 spectrum 1 weight 0.10000E+01 volume 0.48427E-02 ppm1 2.580 ppm2 0.987 CV 1
OR { 457}
(( segid " " and resid 39 and name HG2 ))
( segid " " and resid 36 and name HD1%)
ASSI { 458}
(( segid " " and resid 53 and name HB ))
(( segid " " and resid 53 and name HA ))
2.500 0.800 0.800 peak 458 spectrum 1 weight 0.10000E+01 volume 0.64059E-02 ppm1 2.437 ppm2 4.597 CV 1
ASSI { 461}
(( segid " " and resid 53 and name HB ))
( segid " " and resid 53 and name HG1%)
2.100 0.500 0.500 peak 461 spectrum 1 weight 0.10000E+01 volume 0.19570E-01 ppm1 2.437 ppm2 0.969 CV 1
ASSI { 463}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 82 and name HG2 ))
2.200 0.600 0.600 peak 463 spectrum 1 weight 0.10000E+01 volume 0.14046E-01 ppm1 1.733 ppm2 1.474 CV 1
OR { 463}
(( segid " " and resid 82 and name HB3 ))
(( segid " " and resid 82 and name HG2 ))
ASSI { 465}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 52 and name HA ))
2.500 0.800 0.800 peak 465 spectrum 1 weight 0.10000E+01 volume 0.51247E-02 ppm1 2.132 ppm2 4.055 CV 1
ASSI { 466}
(( segid " " and resid 75 and name HB ))
( segid " " and resid 75 and name HG1%)
1.900 0.400 0.400 peak 466 spectrum 1 weight 0.10000E+01 volume 0.15398E-01 ppm1 2.124 ppm2 0.965 CV 1
ASSI { 468}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HG2 ))
2.300 0.700 0.700 peak 468 spectrum 1 weight 0.10000E+01 volume 0.87565E-02 ppm1 1.185 ppm2 0.995 CV 1
ASSI { 470}
(( segid " " and resid 3 and name HG2 ))
(( segid " " and resid 4 and name HG3 ))
3.200 1.300 1.300 peak 470 spectrum 1 weight 0.10000E+01 volume 0.59358E-02 ppm1 2.634 ppm2 1.985 CV 1
OR { 470}
(( segid " " and resid 3 and name HG2 ))
(( segid " " and resid 4 and name HG2 ))
ASSI { 471}
(( segid " " and resid 3 and name HG3 ))
(( segid " " and resid 4 and name HG3 ))
3.500 1.500 1.500 peak 471 spectrum 1 weight 0.10000E+01 volume 0.51600E-02 ppm1 2.571 ppm2 1.998 CV 1
OR { 471}
(( segid " " and resid 3 and name HG3 ))
(( segid " " and resid 4 and name HG2 ))
ASSI { 472}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 34 and name HA ))
3.500 1.500 1.500 peak 472 spectrum 1 weight 0.10000E+01 volume 0.32794E-02 ppm1 1.834 ppm2 4.725 CV 1
ASSI { 474}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HB3 ))
1.800 0.400 0.400 peak 474 spectrum 1 weight 0.10000E+01 volume 0.13106E-01 ppm1 1.829 ppm2 1.665 CV 1
ASSI { 475}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 34 and name HA ))
3.400 1.400 1.400 peak 475 spectrum 1 weight 0.10000E+01 volume 0.37496E-02 ppm1 1.663 ppm2 4.727 CV 1
ASSI { 477}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name HG2 ))
2.300 0.700 0.700 peak 477 spectrum 1 weight 0.10000E+01 volume 0.95210E-02 ppm1 1.671 ppm2 1.481 CV 1
OR { 477}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name HG3 ))
ASSI { 479}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HB3 ))
1.600 0.300 0.600 peak 479 spectrum 1 weight 0.10000E+01 volume 0.26446E-01 ppm1 1.496 ppm2 1.385 CV 1
ASSI { 480}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HG2 ))
2.800 1.000 1.000 peak 480 spectrum 1 weight 0.10000E+01 volume 0.38201E-02 ppm1 1.494 ppm2 1.106 CV 1
ASSI { 481}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HG3 ))
2.900 1.000 1.000 peak 481 spectrum 1 weight 0.10000E+01 volume 0.17984E-02 ppm1 1.495 ppm2 0.746 CV 1
ASSI { 483}
(( segid " " and resid 13 and name HB3 ))
(( segid " " and resid 13 and name HG2 ))
2.500 0.800 0.800 peak 483 spectrum 1 weight 0.10000E+01 volume 0.41668E-02 ppm1 1.380 ppm2 1.105 CV 1
ASSI { 485}
(( segid " " and resid 74 and name HB2 ))
( segid " " and resid 9 and name HE% )
2.500 0.800 0.800 peak 485 spectrum 1 weight 0.10000E+01 volume 0.31266E-02 ppm1 1.231 ppm2 6.900 CV 1
OR { 485}
(( segid " " and resid 74 and name HB3 ))
( segid " " and resid 9 and name HE% )
ASSI { 487}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HG2 ))
2.100 0.600 0.600 peak 487 spectrum 1 weight 0.10000E+01 volume 0.92855E-02 ppm1 1.234 ppm2 1.518 CV 1
OR { 487}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 74 and name HG2 ))
ASSI { 488}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HB3 ))
1.800 0.400 0.400 peak 488 spectrum 1 weight 0.10000E+01 volume 0.12107E-01 ppm1 2.068 ppm2 1.742 CV 1
ASSI { 489}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HA ))
3.100 1.200 1.200 peak 489 spectrum 1 weight 0.10000E+01 volume 0.14516E-02 ppm1 1.635 ppm2 4.561 CV 1
ASSI { 490}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HD2 ))
2.800 1.000 1.000 peak 490 spectrum 1 weight 0.10000E+01 volume 0.48191E-02 ppm1 1.636 ppm2 3.225 CV 1
OR { 490}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HD3 ))
ASSI { 491}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HB2 ))
1.500 0.300 0.700 peak 491 spectrum 1 weight 0.10000E+01 volume 0.43196E-01 ppm1 1.637 ppm2 1.894 CV 1
ASSI { 492}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HA ))
2.900 1.100 1.100 peak 492 spectrum 1 weight 0.10000E+01 volume 0.31501E-02 ppm1 2.898 ppm2 4.715 CV 1
ASSI { 494}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 26 and name HA ))
2.800 1.000 1.000 peak 494 spectrum 1 weight 0.10000E+01 volume 0.33382E-02 ppm1 2.632 ppm2 4.713 CV 1
ASSI { 495}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 60 and name HB3 ))
3.000 1.100 1.100 peak 495 spectrum 1 weight 0.10000E+01 volume 0.25389E-02 ppm1 2.632 ppm2 3.324 CV 1
ASSI { 497}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HB3 ))
2.000 0.500 0.500 peak 497 spectrum 1 weight 0.10000E+01 volume 0.89333E-02 ppm1 2.501 ppm2 2.229 CV 1
OR { 497}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HG3 ))
ASSI { 498}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HA ))
3.000 1.100 1.100 peak 498 spectrum 1 weight 0.10000E+01 volume 0.30443E-02 ppm1 2.391 ppm2 4.735 CV 1
ASSI { 500}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HG3 ))
2.700 0.900 0.900 peak 500 spectrum 1 weight 0.10000E+01 volume 0.34087E-02 ppm1 2.396 ppm2 2.096 CV 1
OR { 500}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HG2 ))
ASSI { 502}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HG2 ))
2.100 0.600 0.600 peak 502 spectrum 1 weight 0.10000E+01 volume 0.15221E-01 ppm1 1.684 ppm2 1.469 CV 1
OR { 502}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HG3 ))
OR { 502}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HG2 ))
OR { 502}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HG3 ))
ASSI { 504}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HG2 ))
2.300 0.600 0.600 peak 504 spectrum 1 weight 0.10000E+01 volume 0.98145E-02 ppm1 1.808 ppm2 1.632 CV 1
ASSI { 505}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HG2 ))
2.400 0.700 0.700 peak 505 spectrum 1 weight 0.10000E+01 volume 0.73462E-02 ppm1 1.882 ppm2 1.642 CV 1
ASSI { 506}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HA ))
3.300 1.400 1.400 peak 506 spectrum 1 weight 0.10000E+01 volume 0.14575E-02 ppm1 2.277 ppm2 4.348 CV 1
ASSI { 508}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HG3 ))
2.300 0.700 0.700 peak 508 spectrum 1 weight 0.10000E+01 volume 0.12342E-01 ppm1 2.071 ppm2 2.331 CV 1
OR { 508}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HG2 ))
ASSI { 509}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HB3 ))
1.600 0.300 0.600 peak 509 spectrum 1 weight 0.10000E+01 volume 0.24507E-01 ppm1 2.071 ppm2 1.927 CV 1
ASSI { 514}
(( segid " " and resid 13 and name HD3 ))
(( segid " " and resid 13 and name HG3 ))
2.700 0.900 0.900 peak 514 spectrum 1 weight 0.10000E+01 volume 0.36379E-02 ppm1 1.432 ppm2 0.746 CV 1
OR { 514}
(( segid " " and resid 13 and name HD2 ))
(( segid " " and resid 13 and name HG3 ))
ASSI { 517}
(( segid " " and resid 36 and name HG12))
( segid " " and resid 36 and name HD1%)
2.200 0.600 0.600 peak 517 spectrum 1 weight 0.10000E+01 volume 0.12812E-01 ppm1 1.497 ppm2 0.987 CV 1
OR { 517}
(( segid " " and resid 36 and name HG12))
( segid " " and resid 36 and name HG2%)
ASSI { 523}
(( segid " " and resid 68 and name HD3 ))
(( segid " " and resid 68 and name HD2 ))
1.700 0.300 0.500 peak 523 spectrum 1 weight 0.10000E+01 volume 0.95797E-02 ppm1 0.363 ppm2 1.372 CV 1
ASSI { 534}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HB3 ))
1.500 0.300 0.700 peak 534 spectrum 1 weight 0.10000E+01 volume 0.27328E-01 ppm1 2.323 ppm2 2.134 CV 1
ASSI { 536}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HG3 ))
2.000 0.500 0.500 peak 536 spectrum 1 weight 0.10000E+01 volume 0.21863E-01 ppm1 2.212 ppm2 2.433 CV 1
OR { 536}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HG2 ))
ASSI { 537}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HB3 ))
1.600 0.300 0.600 peak 537 spectrum 1 weight 0.10000E+01 volume 0.31971E-01 ppm1 2.211 ppm2 2.080 CV 1
ASSI { 538}
(( segid " " and resid 58 and name HG12))
(( segid " " and resid 58 and name HB ))
2.400 0.700 0.700 peak 538 spectrum 1 weight 0.10000E+01 volume 0.47545E-02 ppm1 1.876 ppm2 2.496 CV 1
ASSI { 539}
(( segid " " and resid 58 and name HG12))
(( segid " " and resid 58 and name HG13))
1.600 0.300 0.600 peak 539 spectrum 1 weight 0.10000E+01 volume 0.17396E-01 ppm1 1.881 ppm2 1.682 CV 1
ASSI { 542}
(( segid " " and resid 15 and name HG2 ))
(( segid " " and resid 15 and name HD2 ))
2.300 0.700 0.700 peak 542 spectrum 1 weight 0.10000E+01 volume 0.82869E-02 ppm1 1.883 ppm2 3.378 CV 1
OR { 542}
(( segid " " and resid 15 and name HG3 ))
(( segid " " and resid 15 and name HD3 ))
OR { 542}
(( segid " " and resid 15 and name HG2 ))
(( segid " " and resid 15 and name HD3 ))
OR { 542}
(( segid " " and resid 15 and name HG3 ))
(( segid " " and resid 15 and name HD2 ))
ASSI { 544}
(( segid " " and resid 84 and name HG12))
( segid " " and resid 84 and name HD1%)
1.900 0.400 0.400 peak 544 spectrum 1 weight 0.10000E+01 volume 0.23861E-01 ppm1 1.560 ppm2 0.848 CV 1
ASSI { 552}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 68 and name HD2 ))
3.200 1.300 1.300 peak 552 spectrum 1 weight 0.10000E+01 volume 0.16867E-02 ppm1 0.971 ppm2 1.372 CV 1
ASSI { 557}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 37 and name HG ))
3.600 1.600 1.600 peak 557 spectrum 1 weight 0.10000E+01 volume 0.30208E-02 ppm1 0.722 ppm2 1.385 CV 1
ASSI { 559}
(( segid " " and resid 86 and name HG12))
( segid " " and resid 73 and name HD1%)
2.500 0.800 0.800 peak 559 spectrum 1 weight 0.10000E+01 volume 0.76404E-02 ppm1 1.415 ppm2 0.873 CV 1
ASSI { 560}
(( segid " " and resid 86 and name HG13))
(( segid " " and resid 86 and name HG12))
1.600 0.300 0.600 peak 560 spectrum 1 weight 0.10000E+01 volume 0.13634E-01 ppm1 1.220 ppm2 1.412 CV 1
ASSI { 561}
(( segid " " and resid 86 and name HG13))
( segid " " and resid 73 and name HD1%)
2.100 0.500 0.500 peak 561 spectrum 1 weight 0.10000E+01 volume 0.76404E-02 ppm1 1.222 ppm2 0.876 CV 1
ASSI { 562}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 74 and name HG2 ))
1.800 0.400 0.400 peak 562 spectrum 1 weight 0.10000E+01 volume 0.81688E-02 ppm1 0.886 ppm2 1.534 CV 1
ASSI { 564}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 48 and name HA ))
3.300 1.400 1.400 peak 564 spectrum 1 weight 0.10000E+01 volume 0.11519E-02 ppm1 0.778 ppm2 4.604 CV 1
ASSI { 567}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 42 and name HB2 ))
2.600 0.800 0.800 peak 567 spectrum 1 weight 0.10000E+01 volume 0.41316E-02 ppm1 0.776 ppm2 1.984 CV 1
ASSI { 570}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HD2 ))
2.500 0.800 0.800 peak 570 spectrum 1 weight 0.10000E+01 volume 0.28445E-02 ppm1 2.093 ppm2 3.651 CV 1
ASSI { 571}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HD3 ))
3.000 1.100 1.100 peak 571 spectrum 1 weight 0.10000E+01 volume 0.38906E-02 ppm1 2.091 ppm2 3.543 CV 1
ASSI { 573}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HB3 ))
3.400 1.500 1.500 peak 573 spectrum 1 weight 0.10000E+01 volume 0.17396E-02 ppm1 2.087 ppm2 2.226 CV 1
ASSI { 574}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 34 and name HD2 ))
3.000 1.100 1.100 peak 574 spectrum 1 weight 0.10000E+01 volume 0.29914E-02 ppm1 1.779 ppm2 3.654 CV 1
ASSI { 578}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 34 and name HG2 ))
1.800 0.400 0.400 peak 578 spectrum 1 weight 0.10000E+01 volume 0.11872E-01 ppm1 1.772 ppm2 2.089 CV 1
ASSI { 579}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 37 and name HB3 ))
3.500 1.500 1.500 peak 579 spectrum 1 weight 0.10000E+01 volume 0.54362E-02 ppm1 1.779 ppm2 1.346 CV 1
ASSI { 580}
(( segid " " and resid 45 and name HG12))
(( segid " " and resid 45 and name HB ))
2.700 0.900 0.900 peak 580 spectrum 1 weight 0.10000E+01 volume 0.46017E-02 ppm1 1.923 ppm2 2.048 CV 1
ASSI { 582}
(( segid " " and resid 45 and name HG12))
( segid " " and resid 45 and name HD1%)
2.400 0.700 0.700 peak 582 spectrum 1 weight 0.10000E+01 volume 0.46781E-02 ppm1 1.937 ppm2 0.886 CV 1
ASSI { 584}
(( segid " " and resid 45 and name HG13))
(( segid " " and resid 45 and name HG12))
1.800 0.400 0.400 peak 584 spectrum 1 weight 0.10000E+01 volume 0.86391E-02 ppm1 1.215 ppm2 1.933 CV 1
ASSI { 587}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 8 and name HA2 ))
3.200 1.300 1.300 peak 587 spectrum 1 weight 0.10000E+01 volume 0.19159E-02 ppm1 1.067 ppm2 3.611 CV 1
ASSI { 589}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 56 and name HB3 ))
6.000 5.100 0.000 peak 589 spectrum 1 weight 0.10000E+01 volume 0.62884E-04 ppm1 1.065 ppm2 1.655 CV 1
ASSI { 590}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HB3 ))
2.600 0.800 0.800 peak 590 spectrum 1 weight 0.10000E+01 volume 0.55244E-02 ppm1 1.264 ppm2 1.638 CV 1
OR { 590}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HD3 ))
OR { 590}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HD2 ))
ASSI { 593}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 71 and name HA2 ))
3.600 1.600 1.600 peak 593 spectrum 1 weight 0.10000E+01 volume 0.27504E-02 ppm1 1.140 ppm2 3.893 CV 1
ASSI { 595}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HG ))
2.000 0.500 0.500 peak 595 spectrum 1 weight 0.10000E+01 volume 0.13870E-01 ppm1 1.148 ppm2 1.380 CV 1
ASSI { 596}
( segid " " and resid 37 and name HD1%)
( segid " " and resid 37 and name HD2%)
1.800 0.400 0.400 peak 596 spectrum 1 weight 0.10000E+01 volume 0.40316E-01 ppm1 1.148 ppm2 1.004 CV 1
ASSI { 597}
( segid " " and resid 37 and name HD1%)
( segid " " and resid 73 and name HD1%)
3.100 1.200 1.200 peak 597 spectrum 1 weight 0.10000E+01 volume 0.71114E-02 ppm1 1.148 ppm2 0.886 CV 1
ASSI { 598}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HA ))
3.200 1.300 1.300 peak 598 spectrum 1 weight 0.10000E+01 volume 0.38553E-02 ppm1 1.100 ppm2 4.292 CV 1
ASSI { 599}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HD2 ))
2.100 0.500 0.500 peak 599 spectrum 1 weight 0.10000E+01 volume 0.16867E-01 ppm1 1.098 ppm2 1.438 CV 1
OR { 599}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HD3 ))
ASSI { 604}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 42 and name HG ))
2.200 0.600 0.600 peak 604 spectrum 1 weight 0.10000E+01 volume 0.72288E-02 ppm1 0.636 ppm2 1.855 CV 1
ASSI { 607}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 45 and name HG13))
3.700 1.700 1.700 peak 607 spectrum 1 weight 0.10000E+01 volume 0.15163E-02 ppm1 0.612 ppm2 1.193 CV 1
ASSI { 609}
( segid " " and resid 42 and name HD2%)
( segid " " and resid 42 and name HD1%)
1.800 0.400 0.400 peak 609 spectrum 1 weight 0.10000E+01 volume 0.40316E-01 ppm1 0.636 ppm2 0.781 CV 1
ASSI { 611}
( segid " " and resid 52 and name HG1%)
(( segid " " and resid 52 and name HB ))
2.400 0.700 0.700 peak 611 spectrum 1 weight 0.10000E+01 volume 0.50718E-02 ppm1 0.987 ppm2 2.129 CV 1
ASSI { 613}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 6 and name HA ))
2.500 0.800 0.800 peak 613 spectrum 1 weight 0.10000E+01 volume 0.93442E-02 ppm1 1.158 ppm2 4.487 CV 1
ASSI { 616}
( segid " " and resid 80 and name HG1%)
(( segid " " and resid 80 and name HB ))
2.100 0.600 0.600 peak 616 spectrum 1 weight 0.10000E+01 volume 0.12753E-01 ppm1 0.880 ppm2 2.035 CV 1
ASSI { 617}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 75 and name HA ))
2.300 0.700 0.700 peak 617 spectrum 1 weight 0.10000E+01 volume 0.43843E-02 ppm1 0.968 ppm2 4.824 CV 1
ASSI { 619}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 31 and name HG3 ))
4.100 2.100 1.900 peak 619 spectrum 1 weight 0.10000E+01 volume 0.20746E-02 ppm1 0.129 ppm2 0.708 CV 1
ASSI { 621}
(( segid " " and resid 68 and name HB3 ))
(( segid " " and resid 31 and name HG3 ))
4.000 2.000 2.000 peak 621 spectrum 1 weight 0.10000E+01 volume 0.22626E-02 ppm1 0.064 ppm2 0.706 CV 1
ASSI { 622}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HG2 ))
3.100 1.200 1.200 peak 622 spectrum 1 weight 0.10000E+01 volume 0.30737E-02 ppm1 4.131 ppm2 2.338 CV 1
OR { 622}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HG3 ))
ASSI { 623}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB2 ))
2.700 0.900 0.900 peak 623 spectrum 1 weight 0.10000E+01 volume 0.36143E-02 ppm1 4.136 ppm2 2.075 CV 1
ASSI { 624}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB3 ))
2.700 0.900 0.900 peak 624 spectrum 1 weight 0.10000E+01 volume 0.31324E-02 ppm1 4.136 ppm2 1.923 CV 1
ASSI { 625}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 42 and name HD1%)
3.000 1.100 1.100 peak 625 spectrum 1 weight 0.10000E+01 volume 0.18572E-02 ppm1 4.135 ppm2 0.778 CV 1
ASSI { 629}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HG2 ))
2.300 0.600 0.600 peak 629 spectrum 1 weight 0.10000E+01 volume 0.14340E-01 ppm1 0.794 ppm2 1.523 CV 1
ASSI { 630}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HG13))
3.000 1.100 1.100 peak 630 spectrum 1 weight 0.10000E+01 volume 0.46899E-02 ppm1 0.795 ppm2 1.243 CV 1
ASSI { 635}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 57 and name HB2 ))
3.200 1.300 1.300 peak 635 spectrum 1 weight 0.10000E+01 volume 0.12400E-02 ppm1 0.639 ppm2 1.944 CV 1
ASSI { 637}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 57 and name HG3 ))
3.300 1.400 1.400 peak 637 spectrum 1 weight 0.10000E+01 volume 0.10226E-02 ppm1 0.638 ppm2 1.555 CV 1
ASSI { 639}
(( segid " " and resid 73 and name HG13))
( segid " " and resid 73 and name HD1%)
2.000 0.500 0.500 peak 639 spectrum 1 weight 0.10000E+01 volume 0.12929E-01 ppm1 1.245 ppm2 0.885 CV 1
ASSI { 640}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 73 and name HG13))
1.700 0.400 0.500 peak 640 spectrum 1 weight 0.10000E+01 volume 0.10461E-01 ppm1 1.557 ppm2 1.252 CV 1
ASSI { 641}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HG2 ))
2.300 0.600 0.600 peak 641 spectrum 1 weight 0.10000E+01 volume 0.10167E-01 ppm1 1.921 ppm2 2.326 CV 1
OR { 641}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HG3 ))
ASSI { 642}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 73 and name HA ))
2.500 0.800 0.800 peak 642 spectrum 1 weight 0.10000E+01 volume 0.38260E-02 ppm1 1.393 ppm2 4.067 CV 1
ASSI { 643}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 74 and name HD2 ))
1.800 0.400 0.400 peak 643 spectrum 1 weight 0.10000E+01 volume 0.76991E-02 ppm1 1.392 ppm2 2.402 CV 1
ASSI { 644}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 74 and name HG2 ))
3.000 1.100 1.100 peak 644 spectrum 1 weight 0.10000E+01 volume 0.35438E-02 ppm1 1.394 ppm2 1.527 CV 1
ASSI { 646}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 74 and name HG3 ))
2.500 0.800 0.800 peak 646 spectrum 1 weight 0.10000E+01 volume 0.23214E-02 ppm1 1.393 ppm2 0.887 CV 1
ASSI { 651}
(( segid " " and resid 74 and name HD2 ))
(( segid " " and resid 73 and name HG13))
3.400 1.500 1.500 peak 651 spectrum 1 weight 0.10000E+01 volume 0.20687E-02 ppm1 2.401 ppm2 1.244 CV 1
ASSI { 655}
(( segid " " and resid 13 and name HE3 ))
(( segid " " and resid 13 and name HD3 ))
2.400 0.700 0.700 peak 655 spectrum 1 weight 0.10000E+01 volume 0.75811E-02 ppm1 2.788 ppm2 1.446 CV 1
OR { 655}
(( segid " " and resid 13 and name HE2 ))
(( segid " " and resid 13 and name HD2 ))
OR { 655}
(( segid " " and resid 13 and name HE3 ))
(( segid " " and resid 13 and name HD2 ))
OR { 655}
(( segid " " and resid 13 and name HE2 ))
(( segid " " and resid 13 and name HD3 ))
ASSI { 659}
(( segid " " and resid 41 and name HB3 ))
( segid " " and resid 30 and name HG2%)
2.700 0.900 0.900 peak 659 spectrum 1 weight 0.10000E+01 volume 0.30031E-02 ppm1 3.120 ppm2 0.928 CV 1
ASSI { 664}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HB3 ))
2.000 0.500 0.500 peak 664 spectrum 1 weight 0.10000E+01 volume 0.57360E-02 ppm1 2.847 ppm2 2.538 CV 1
ASSI { 672}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 17 and name HG3 ))
3.200 1.300 1.300 peak 672 spectrum 1 weight 0.10000E+01 volume 0.62296E-03 ppm1 7.163 ppm2 1.463 CV 1
OR { 672}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 17 and name HG2 ))
ASSI { 675}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 18 and name HB2 ))
4.000 2.000 2.000 peak 675 spectrum 1 weight 0.10000E+01 volume 0.17396E-02 ppm1 6.798 ppm2 3.171 CV 1
ASSI { 678}
( segid " " and resid 18 and name HE% )
( segid " " and resid 61 and name HB% )
3.700 1.700 1.700 peak 678 spectrum 1 weight 0.10000E+01 volume 0.79340E-03 ppm1 6.795 ppm2 0.136 CV 1
ASSI { 685}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 68 and name HE2 ))
3.200 1.300 1.300 peak 685 spectrum 1 weight 0.10000E+01 volume 0.13634E-02 ppm1 7.216 ppm2 2.690 CV 1
ASSI { 686}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 68 and name HD3 ))
3.200 1.300 1.300 peak 686 spectrum 1 weight 0.10000E+01 volume 0.89920E-03 ppm1 7.221 ppm2 0.361 CV 1
ASSI { 688}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 41 and name HH2 ))
3.900 1.900 1.900 peak 688 spectrum 1 weight 0.10000E+01 volume 0.13694E-02 ppm1 6.488 ppm2 6.936 CV 1
ASSI { 689}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 28 and name HA ))
5.100 3.300 0.900 peak 689 spectrum 1 weight 0.10000E+01 volume 0.61708E-03 ppm1 6.485 ppm2 5.075 CV 1
ASSI { 692}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 68 and name HE3 ))
3.700 1.700 1.700 peak 692 spectrum 1 weight 0.10000E+01 volume 0.13047E-02 ppm1 6.493 ppm2 2.151 CV 1
ASSI { 693}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 68 and name HB2 ))
2.300 0.700 0.700 peak 693 spectrum 1 weight 0.10000E+01 volume 0.59358E-02 ppm1 6.491 ppm2 0.136 CV 1
ASSI { 705}
( segid " " and resid 14 and name HE% )
( segid " " and resid 14 and name HD% )
2.200 0.600 0.600 peak 705 spectrum 1 weight 0.10000E+01 volume 0.92855E-02 ppm1 7.266 ppm2 7.110 CV 1
ASSI { 714}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 74 and name HA ))
2.600 2.600 3.400 peak 714 spectrum 1 weight 0.10000E+01 volume 0.49191E-02 ppm1 7.304 ppm2 3.081 CV 1
ASSI { 716}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 72 and name HB3 ))
2.000 0.500 0.500 peak 716 spectrum 1 weight 0.10000E+01 volume 0.13106E-01 ppm1 7.299 ppm2 2.805 CV 1
ASSI { 722}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 27 and name HA ))
3.800 1.800 1.800 peak 722 spectrum 1 weight 0.10000E+01 volume 0.10637E-02 ppm1 7.077 ppm2 4.631 CV 1
ASSI { 723}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 27 and name HB2 ))
4.400 2.500 1.600 peak 723 spectrum 1 weight 0.10000E+01 volume 0.74049E-03 ppm1 7.090 ppm2 2.846 CV 1
ASSI { 724}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 27 and name HB3 ))
4.400 2.400 1.600 peak 724 spectrum 1 weight 0.10000E+01 volume 0.93442E-03 ppm1 7.071 ppm2 2.569 CV 1
ASSI { 726}
(( segid " " and resid 41 and name HZ2 ))
(( segid " " and resid 63 and name HZ ))
3.200 1.300 1.300 peak 726 spectrum 1 weight 0.10000E+01 volume 0.12342E-02 ppm1 7.446 ppm2 6.732 CV 1
ASSI { 730}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 41 and name HA ))
2.700 0.900 0.900 peak 730 spectrum 1 weight 0.10000E+01 volume 0.25036E-02 ppm1 7.604 ppm2 4.137 CV 1
ASSI { 732}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 40 and name HB2 ))
3.300 1.300 1.300 peak 732 spectrum 1 weight 0.10000E+01 volume 0.91094E-03 ppm1 7.607 ppm2 2.279 CV 1
ASSI { 733}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 31 and name HD2 ))
3.400 1.400 1.400 peak 733 spectrum 1 weight 0.10000E+01 volume 0.98732E-03 ppm1 7.605 ppm2 2.039 CV 1
ASSI { 735}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 37 and name HG ))
2.700 0.900 0.900 peak 735 spectrum 1 weight 0.10000E+01 volume 0.33793E-02 ppm1 7.606 ppm2 1.388 CV 1
ASSI { 736}
(( segid " " and resid 41 and name HD1 ))
( segid " " and resid 37 and name HD1%)
2.700 0.900 0.900 peak 736 spectrum 1 weight 0.10000E+01 volume 0.46193E-02 ppm1 7.605 ppm2 1.152 CV 1
ASSI { 744}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 68 and name HE2 ))
4.300 2.300 1.700 peak 744 spectrum 1 weight 0.10000E+01 volume 0.73462E-03 ppm1 6.952 ppm2 2.690 CV 1
ASSI { 747}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HB2 ))
2.800 1.000 1.000 peak 747 spectrum 1 weight 0.10000E+01 volume 0.13341E-02 ppm1 7.957 ppm2 3.127 CV 1
ASSI { 748}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HB3 ))
3.500 1.500 1.500 peak 748 spectrum 1 weight 0.10000E+01 volume 0.20628E-02 ppm1 7.951 ppm2 1.871 CV 1
ASSI { 755}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 31 and name HD3 ))
3.500 1.500 1.500 peak 755 spectrum 1 weight 0.10000E+01 volume 0.17748E-02 ppm1 7.526 ppm2 1.843 CV 1
ASSI { 765}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 60 and name HB2 ))
4.300 2.300 1.700 peak 765 spectrum 1 weight 0.10000E+01 volume 0.40493E-03 ppm1 6.881 ppm2 4.359 CV 1
ASSI { 766}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 26 and name HB2 ))
3.600 1.600 1.600 peak 766 spectrum 1 weight 0.10000E+01 volume 0.84630E-03 ppm1 6.883 ppm2 2.900 CV 1
ASSI { 776}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 41 and name HH2 ))
3.500 1.500 1.500 peak 776 spectrum 1 weight 0.10000E+01 volume 0.83456E-03 ppm1 1.398 ppm2 6.936 CV 1
ASSI { 779}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 40 and name HG3 ))
4.400 2.400 1.600 peak 779 spectrum 1 weight 0.10000E+01 volume 0.59946E-03 ppm1 7.608 ppm2 1.890 CV 1
ASSI { 781}
(( segid " " and resid 8 and name HA2 ))
(( segid " " and resid 56 and name HG ))
2.600 0.900 0.900 peak 781 spectrum 1 weight 0.10000E+01 volume 0.24977E-02 ppm1 3.612 ppm2 1.796 CV 1
ASSI { 784}
(( segid " " and resid 29 and name HD3 ))
(( segid " " and resid 57 and name HA ))
5.600 4.000 0.400 peak 784 spectrum 1 weight 0.10000E+01 volume 0.95797E-04 ppm1 3.245 ppm2 5.352 CV 1
OR { 784}
(( segid " " and resid 29 and name HD2 ))
(( segid " " and resid 57 and name HA ))
ASSI { 785}
(( segid " " and resid 72 and name HB2 ))
( segid " " and resid 63 and name HD% )
3.600 1.600 1.600 peak 785 spectrum 1 weight 0.10000E+01 volume 0.20217E-02 ppm1 2.938 ppm2 7.296 CV 1
ASSI { 787}
(( segid " " and resid 56 and name HB3 ))
( segid " " and resid 30 and name HD1%)
2.600 0.800 0.800 peak 787 spectrum 1 weight 0.10000E+01 volume 0.29738E-02 ppm1 1.661 ppm2 1.020 CV 1
ASSI { 789}
(( segid " " and resid 57 and name HD3 ))
(( segid " " and resid 57 and name HA ))
2.600 0.900 0.900 peak 789 spectrum 1 weight 0.10000E+01 volume 0.34968E-02 ppm1 2.759 ppm2 5.349 CV 1
ASSI { 790}
(( segid " " and resid 57 and name HD3 ))
(( segid " " and resid 29 and name HA ))
2.800 1.000 1.000 peak 790 spectrum 1 weight 0.10000E+01 volume 0.24448E-02 ppm1 2.759 ppm2 4.570 CV 1
ASSI { 791}
(( segid " " and resid 81 and name HB2 ))
(( segid " " and resid 75 and name HB ))
3.400 1.400 1.400 peak 791 spectrum 1 weight 0.10000E+01 volume 0.34204E-02 ppm1 2.542 ppm2 2.100 CV 1
ASSI { 792}
(( segid " " and resid 81 and name HB3 ))
(( segid " " and resid 75 and name HB ))
2.100 0.600 0.600 peak 792 spectrum 1 weight 0.10000E+01 volume 0.91681E-02 ppm1 2.220 ppm2 2.100 CV 1
ASSI { 793}
(( segid " " and resid 81 and name HB2 ))
( segid " " and resid 75 and name HG1%)
4.900 3.000 1.100 peak 793 spectrum 1 weight 0.10000E+01 volume 0.54245E-03 ppm1 2.539 ppm2 0.965 CV 1
ASSI { 794}
(( segid " " and resid 81 and name HB3 ))
( segid " " and resid 75 and name HG1%)
4.600 2.600 1.400 peak 794 spectrum 1 weight 0.10000E+01 volume 0.20394E-03 ppm1 2.217 ppm2 0.962 CV 1
ASSI { 795}
(( segid " " and resid 81 and name HB3 ))
(( segid " " and resid 78 and name HA ))
3.500 1.600 1.600 peak 795 spectrum 1 weight 0.10000E+01 volume 0.69933E-03 ppm1 2.220 ppm2 4.796 CV 1
ASSI { 801}
(( segid " " and resid 82 and name HE3 ))
(( segid " " and resid 82 and name HD2 ))
2.300 0.600 0.600 peak 801 spectrum 1 weight 0.10000E+01 volume 0.10755E-01 ppm1 2.993 ppm2 1.683 CV 1
OR { 801}
(( segid " " and resid 82 and name HE2 ))
(( segid " " and resid 82 and name HD3 ))
OR { 801}
(( segid " " and resid 82 and name HE2 ))
(( segid " " and resid 82 and name HD2 ))
OR { 801}
(( segid " " and resid 82 and name HE3 ))
(( segid " " and resid 82 and name HD3 ))
ASSI { 802}
(( segid " " and resid 9 and name HB3 ))
( segid " " and resid 58 and name HD1%)
4.200 2.200 1.800 peak 802 spectrum 1 weight 0.10000E+01 volume 0.22392E-02 ppm1 2.404 ppm2 1.041 CV 1
ASSI { 804}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HA ))
2.800 1.000 1.000 peak 804 spectrum 1 weight 0.10000E+01 volume 0.22921E-02 ppm1 2.404 ppm2 4.050 CV 1
ASSI { 806}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 68 and name HB2 ))
4.000 2.000 2.000 peak 806 spectrum 1 weight 0.10000E+01 volume 0.12342E-02 ppm1 2.684 ppm2 0.121 CV 1
ASSI { 807}
(( segid " " and resid 68 and name HE2 ))
(( segid " " and resid 68 and name HG3 ))
3.900 1.900 1.900 peak 807 spectrum 1 weight 0.10000E+01 volume 0.18748E-02 ppm1 2.687 ppm2 0.685 CV 1
ASSI { 808}
(( segid " " and resid 68 and name HE3 ))
(( segid " " and resid 68 and name HD2 ))
3.300 1.400 1.400 peak 808 spectrum 1 weight 0.10000E+01 volume 0.11578E-02 ppm1 2.142 ppm2 1.375 CV 1
ASSI { 810}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HA ))
2.800 1.000 1.000 peak 810 spectrum 1 weight 0.10000E+01 volume 0.48662E-02 ppm1 1.993 ppm2 3.922 CV 1
ASSI { 812}
(( segid " " and resid 14 and name HB3 ))
( segid " " and resid 61 and name HB% )
3.000 1.100 1.100 peak 812 spectrum 1 weight 0.10000E+01 volume 0.18278E-02 ppm1 2.700 ppm2 0.142 CV 1
ASSI { 816}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HD2 ))
4.100 2.100 1.900 peak 816 spectrum 1 weight 0.10000E+01 volume 0.86391E-03 ppm1 2.664 ppm2 3.644 CV 1
ASSI { 817}
(( segid " " and resid 34 and name HB2 ))
( segid " " and resid 36 and name HD1%)
4.000 2.000 2.000 peak 817 spectrum 1 weight 0.10000E+01 volume 0.12459E-02 ppm1 2.660 ppm2 0.978 CV 1
OR { 817}
(( segid " " and resid 34 and name HB2 ))
( segid " " and resid 36 and name HG2%)
ASSI { 818}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 45 and name HG13))
3.700 1.700 1.700 peak 818 spectrum 1 weight 0.10000E+01 volume 0.21628E-02 ppm1 1.358 ppm2 1.220 CV 1
ASSI { 819}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 45 and name HD1%)
3.600 1.600 1.600 peak 819 spectrum 1 weight 0.10000E+01 volume 0.18630E-02 ppm1 1.358 ppm2 0.890 CV 1
ASSI { 822}
(( segid " " and resid 55 and name HG3 ))
(( segid " " and resid 55 and name HA ))
2.600 0.800 0.800 peak 822 spectrum 1 weight 0.10000E+01 volume 0.71701E-02 ppm1 2.436 ppm2 4.264 CV 1
OR { 822}
(( segid " " and resid 55 and name HG2 ))
(( segid " " and resid 55 and name HA ))
ASSI { 826}
(( segid " " and resid 7 and name HB3 ))
( segid " " and resid 27 and name HE% )
4.100 2.100 1.900 peak 826 spectrum 1 weight 0.10000E+01 volume 0.16103E-02 ppm1 3.114 ppm2 7.077 CV 1
ASSI { 829}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 47 and name HD3 ))
3.100 1.200 1.200 peak 829 spectrum 1 weight 0.10000E+01 volume 0.97558E-03 ppm1 4.567 ppm2 2.971 CV 1
ASSI { 830}
(( segid " " and resid 51 and name HB ))
(( segid " " and resid 47 and name HD2 ))
3.900 1.900 1.900 peak 830 spectrum 1 weight 0.10000E+01 volume 0.97558E-03 ppm1 4.567 ppm2 3.245 CV 1
ASSI { 833}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 43 and name HA ))
2.500 0.800 0.800 peak 833 spectrum 1 weight 0.10000E+01 volume 0.71114E-02 ppm1 4.204 ppm2 4.040 CV 1
ASSI { 835}
(( segid " " and resid 68 and name HD3 ))
(( segid " " and resid 68 and name HB3 ))
3.800 1.800 1.800 peak 835 spectrum 1 weight 0.10000E+01 volume 0.40199E-03 ppm1 0.365 ppm2 0.056 CV 1
ASSI { 839}
(( segid " " and resid 68 and name HD2 ))
(( segid " " and resid 41 and name HH2 ))
3.100 1.200 1.200 peak 839 spectrum 1 weight 0.10000E+01 volume 0.17278E-02 ppm1 1.369 ppm2 6.952 CV 1
ASSI { 841}
(( segid " " and resid 76 and name HG3 ))
(( segid " " and resid 76 and name HD3 ))
2.300 0.700 0.700 peak 841 spectrum 1 weight 0.10000E+01 volume 0.40316E-02 ppm1 2.231 ppm2 3.708 CV 1
ASSI { 843}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 9 and name HZ ))
4.300 2.300 1.700 peak 843 spectrum 1 weight 0.10000E+01 volume 0.11636E-02 ppm1 2.340 ppm2 6.987 CV 1
ASSI { 845}
(( segid " " and resid 76 and name HG3 ))
(( segid " " and resid 9 and name HZ ))
3.500 1.600 1.600 peak 845 spectrum 1 weight 0.10000E+01 volume 0.13694E-02 ppm1 2.228 ppm2 6.983 CV 1
ASSI { 848}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 9 and name HD% )
3.600 1.600 1.600 peak 848 spectrum 1 weight 0.10000E+01 volume 0.15809E-02 ppm1 3.804 ppm2 6.646 CV 1
ASSI { 849}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 9 and name HZ ))
2.500 0.800 0.800 peak 849 spectrum 1 weight 0.10000E+01 volume 0.62884E-02 ppm1 3.804 ppm2 6.970 CV 1
ASSI { 851}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 42 and name HG ))
2.800 1.000 1.000 peak 851 spectrum 1 weight 0.10000E+01 volume 0.17514E-02 ppm1 0.772 ppm2 1.853 CV 1
ASSI { 853}
(( segid " " and resid 45 and name HG13))
(( segid " " and resid 45 and name HB ))
2.400 0.700 0.700 peak 853 spectrum 1 weight 0.10000E+01 volume 0.33087E-02 ppm1 1.217 ppm2 2.042 CV 1
ASSI { 854}
(( segid " " and resid 45 and name HG12))
(( segid " " and resid 42 and name HA ))
2.800 0.900 0.900 peak 854 spectrum 1 weight 0.10000E+01 volume 0.41021E-02 ppm1 1.928 ppm2 3.898 CV 1
ASSI { 855}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HA ))
3.300 1.400 1.400 peak 855 spectrum 1 weight 0.10000E+01 volume 0.27563E-02 ppm1 2.093 ppm2 4.728 CV 1
ASSI { 856}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HG2 ))
1.600 0.300 0.600 peak 856 spectrum 1 weight 0.10000E+01 volume 0.20452E-01 ppm1 1.261 ppm2 1.519 CV 1
ASSI { 859}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HG2 ))
3.700 1.700 1.700 peak 859 spectrum 1 weight 0.10000E+01 volume 0.20628E-02 ppm1 4.424 ppm2 2.006 CV 1
OR { 859}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HG3 ))
ASSI { 860}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 13 and name HE3 ))
3.100 1.200 1.200 peak 860 spectrum 1 weight 0.10000E+01 volume 0.20628E-02 ppm1 0.753 ppm2 2.785 CV 1
OR { 860}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 13 and name HE2 ))
ASSI { 861}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HE2 ))
3.100 1.200 1.200 peak 861 spectrum 1 weight 0.10000E+01 volume 0.22274E-02 ppm1 1.103 ppm2 2.790 CV 1
OR { 861}
(( segid " " and resid 13 and name HG2 ))
(( segid " " and resid 13 and name HE3 ))
ASSI { 863}
(( segid " " and resid 13 and name HG3 ))
(( segid " " and resid 13 and name HA ))
3.700 1.700 1.700 peak 863 spectrum 1 weight 0.10000E+01 volume 0.17278E-02 ppm1 0.746 ppm2 4.292 CV 1
ASSI { 865}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 47 and name HD2 ))
3.000 1.100 1.100 peak 865 spectrum 1 weight 0.10000E+01 volume 0.21451E-02 ppm1 4.053 ppm2 3.243 CV 1
ASSI { 869}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 26 and name HB2 ))
3.400 1.400 1.400 peak 869 spectrum 1 weight 0.10000E+01 volume 0.84043E-03 ppm1 3.317 ppm2 2.890 CV 1
ASSI { 870}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 9 and name HD% )
3.200 1.300 1.300 peak 870 spectrum 1 weight 0.10000E+01 volume 0.17690E-02 ppm1 4.380 ppm2 6.658 CV 1
ASSI { 871}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HG2 ))
3.300 1.400 1.400 peak 871 spectrum 1 weight 0.10000E+01 volume 0.23214E-02 ppm1 3.099 ppm2 1.533 CV 1
ASSI { 872}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 62 and name HB3 ))
3.200 1.300 1.300 peak 872 spectrum 1 weight 0.10000E+01 volume 0.18748E-02 ppm1 3.104 ppm2 1.880 CV 1
ASSI { 874}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 27 and name HB2 ))
3.800 1.800 1.800 peak 874 spectrum 1 weight 0.10000E+01 volume 0.58711E-03 ppm1 0.647 ppm2 2.825 CV 1
ASSI { 876}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 53 and name HG1%)
2.600 0.800 0.800 peak 876 spectrum 1 weight 0.10000E+01 volume 0.57066E-02 ppm1 4.596 ppm2 0.977 CV 1
ASSI { 877}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 31 and name HG3 ))
4.100 2.100 1.900 peak 877 spectrum 1 weight 0.10000E+01 volume 0.11695E-02 ppm1 3.486 ppm2 0.725 CV 1
ASSI { 883}
( segid " " and resid 80 and name HG2%)
(( segid " " and resid 77 and name HB2 ))
2.900 1.100 1.100 peak 883 spectrum 1 weight 0.10000E+01 volume 0.63472E-02 ppm1 0.857 ppm2 2.911 CV 1
ASSI { 884}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 27 and name HA ))
2.900 1.100 1.100 peak 884 spectrum 1 weight 0.10000E+01 volume 0.16514E-02 ppm1 4.950 ppm2 4.639 CV 1
ASSI { 885}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 27 and name HD% )
3.100 1.200 1.200 peak 885 spectrum 1 weight 0.10000E+01 volume 0.14987E-02 ppm1 4.945 ppm2 6.891 CV 1
ASSI { 886}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 42 and name HD2%)
3.400 1.500 1.500 peak 886 spectrum 1 weight 0.10000E+01 volume 0.22333E-02 ppm1 4.135 ppm2 0.631 CV 1
ASSI { 887}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 53 and name HG2%)
2.700 0.900 0.900 peak 887 spectrum 1 weight 0.10000E+01 volume 0.48015E-02 ppm1 4.135 ppm2 0.960 CV 1
ASSI { 888}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 52 and name HG1%)
4.300 2.300 1.700 peak 888 spectrum 1 weight 0.10000E+01 volume 0.11107E-02 ppm1 3.910 ppm2 1.009 CV 1
ASSI { 890}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 78 and name HB3 ))
2.600 0.900 0.900 peak 890 spectrum 1 weight 0.10000E+01 volume 0.31384E-02 ppm1 3.926 ppm2 1.902 CV 1
ASSI { 891}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 78 and name HG2 ))
3.800 1.800 1.800 peak 891 spectrum 1 weight 0.10000E+01 volume 0.72288E-03 ppm1 3.926 ppm2 1.725 CV 1
ASSI { 892}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 78 and name HB2 ))
3.300 1.300 1.300 peak 892 spectrum 1 weight 0.10000E+01 volume 0.13694E-02 ppm1 3.926 ppm2 2.009 CV 1
ASSI { 893}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 38 and name HD3 ))
2.800 1.000 1.000 peak 893 spectrum 1 weight 0.10000E+01 volume 0.32500E-02 ppm1 4.123 ppm2 2.995 CV 1
ASSI { 894}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 88 and name HG ))
2.000 2.000 4.000 peak 894 spectrum 1 weight 0.10000E+01 volume 0.88746E-02 ppm1 4.123 ppm2 1.715 CV 1
ASSI { 895}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HG13))
4.000 2.000 2.000 peak 895 spectrum 1 weight 0.10000E+01 volume 0.75811E-03 ppm1 5.365 ppm2 1.688 CV 1
ASSI { 896}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HG12))
3.600 1.600 1.600 peak 896 spectrum 1 weight 0.10000E+01 volume 0.82869E-03 ppm1 5.365 ppm2 1.884 CV 1
ASSI { 897}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 45 and name HG2%)
2.400 0.700 0.700 peak 897 spectrum 1 weight 0.10000E+01 volume 0.40375E-02 ppm1 4.050 ppm2 0.785 CV 1
ASSI { 900}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 36 and name HG2%)
3.200 1.300 1.300 peak 900 spectrum 1 weight 0.10000E+01 volume 0.18101E-02 ppm1 4.193 ppm2 0.972 CV 1
OR { 900}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 36 and name HD1%)
ASSI { 901}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 86 and name HD1%)
2.700 0.900 0.900 peak 901 spectrum 1 weight 0.10000E+01 volume 0.25506E-02 ppm1 4.192 ppm2 0.852 CV 1
ASSI { 906}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 73 and name HG2%)
2.600 0.900 0.900 peak 906 spectrum 1 weight 0.10000E+01 volume 0.48427E-02 ppm1 4.062 ppm2 0.793 CV 1
ASSI { 908}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 58 and name HD1%)
2.300 0.700 0.700 peak 908 spectrum 1 weight 0.10000E+01 volume 0.76404E-02 ppm1 0.787 ppm2 1.040 CV 1
ASSI { 909}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 10 and name HD2 ))
3.000 1.200 1.200 peak 909 spectrum 1 weight 0.10000E+01 volume 0.37848E-02 ppm1 0.787 ppm2 3.325 CV 1
ASSI { 911}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 9 and name HE% )
2.600 0.800 0.800 peak 911 spectrum 1 weight 0.10000E+01 volume 0.51247E-02 ppm1 0.788 ppm2 6.890 CV 1
ASSI { 912}
(( segid " " and resid 83 and name HA ))
( segid " " and resid 75 and name HG2%)
2.900 1.100 1.100 peak 912 spectrum 1 weight 0.10000E+01 volume 0.13929E-02 ppm1 3.869 ppm2 0.494 CV 1
ASSI { 914}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HB3 ))
2.700 0.900 0.900 peak 914 spectrum 1 weight 0.10000E+01 volume 0.24390E-02 ppm1 5.042 ppm2 2.421 CV 1
ASSI { 915}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 75 and name HG2%)
3.700 1.700 1.700 peak 915 spectrum 1 weight 0.10000E+01 volume 0.69933E-03 ppm1 3.969 ppm2 0.490 CV 1
ASSI { 916}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 68 and name HE3 ))
3.900 1.900 1.900 peak 916 spectrum 1 weight 0.10000E+01 volume 0.81101E-03 ppm1 7.225 ppm2 2.148 CV 1
ASSI { 917}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HG3 ))
3.400 1.500 1.500 peak 917 spectrum 1 weight 0.10000E+01 volume 0.15280E-02 ppm1 5.351 ppm2 1.560 CV 1
ASSI { 918}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HB2 ))
3.900 1.900 1.900 peak 918 spectrum 1 weight 0.10000E+01 volume 0.30796E-02 ppm1 4.209 ppm2 2.666 CV 1
ASSI { 921}
(( segid " " and resid 78 and name HD3 ))
(( segid " " and resid 78 and name HB3 ))
4.600 2.600 1.400 peak 921 spectrum 1 weight 0.10000E+01 volume 0.33793E-03 ppm1 3.408 ppm2 1.910 CV 1
ASSI { 922}
(( segid " " and resid 78 and name HD3 ))
(( segid " " and resid 78 and name HB2 ))
4.600 2.700 1.400 peak 922 spectrum 1 weight 0.10000E+01 volume 0.52835E-03 ppm1 3.408 ppm2 2.014 CV 1
ASSI { 923}
(( segid " " and resid 78 and name HD2 ))
(( segid " " and resid 78 and name HB3 ))
4.200 2.200 1.800 peak 923 spectrum 1 weight 0.10000E+01 volume 0.89333E-03 ppm1 3.964 ppm2 1.906 CV 1
ASSI { 924}
(( segid " " and resid 78 and name HD2 ))
(( segid " " and resid 78 and name HB2 ))
4.700 2.800 1.300 peak 924 spectrum 1 weight 0.10000E+01 volume 0.22509E-03 ppm1 3.964 ppm2 2.010 CV 1
ASSI { 927}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 78 and name HG3 ))
4.200 2.200 1.800 peak 927 spectrum 1 weight 0.10000E+01 volume 0.17102E-02 ppm1 5.043 ppm2 1.486 CV 1
ASSI { 930}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 37 and name HB3 ))
4.400 2.500 1.600 peak 930 spectrum 1 weight 0.10000E+01 volume 0.13341E-02 ppm1 3.539 ppm2 1.345 CV 1
ASSI { 932}
(( segid " " and resid 34 and name HD3 ))
(( segid " " and resid 34 and name HB2 ))
4.500 2.500 1.500 peak 932 spectrum 1 weight 0.10000E+01 volume 0.68172E-03 ppm1 3.539 ppm2 2.667 CV 1
ASSI { 935}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 30 and name HA ))
3.400 1.400 1.400 peak 935 spectrum 1 weight 0.10000E+01 volume 0.75224E-03 ppm1 7.027 ppm2 3.853 CV 1
ASSI { 938}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 31 and name HD2 ))
3.300 1.300 1.300 peak 938 spectrum 1 weight 0.10000E+01 volume 0.12107E-02 ppm1 7.525 ppm2 2.040 CV 1
ASSI { 939}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 48 and name HA ))
3.500 1.500 1.500 peak 939 spectrum 1 weight 0.10000E+01 volume 0.90507E-03 ppm1 1.472 ppm2 4.595 CV 1
ASSI { 941}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 26 and name HB2 ))
3.700 1.700 1.700 peak 941 spectrum 1 weight 0.10000E+01 volume 0.10402E-02 ppm1 6.493 ppm2 2.900 CV 1
ASSI { 942}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 68 and name HE2 ))
3.400 1.400 1.400 peak 942 spectrum 1 weight 0.10000E+01 volume 0.18630E-02 ppm1 6.493 ppm2 2.664 CV 1
ASSI { 943}
( segid " " and resid 28 and name HE% )
(( segid " " and resid 67 and name HA ))
3.700 1.700 1.700 peak 943 spectrum 1 weight 0.10000E+01 volume 0.14928E-02 ppm1 6.485 ppm2 4.600 CV 1
ASSI { 945}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HB3 ))
6.000 6.000 0.000 peak 945 spectrum 1 weight 0.10000E+01 volume 0.56596E-05 ppm1 2.369 ppm2 2.007 CV 1
ASSI { 946}
(( segid " " and resid 50 and name HG3 ))
(( segid " " and resid 50 and name HB2 ))
2.300 0.700 0.700 peak 946 spectrum 1 weight 0.10000E+01 volume 0.73462E-02 ppm1 2.282 ppm2 2.097 CV 1
ASSI { 947}
(( segid " " and resid 50 and name HG3 ))
(( segid " " and resid 50 and name HB3 ))
2.900 1.000 1.000 peak 947 spectrum 1 weight 0.10000E+01 volume 0.42550E-02 ppm1 2.281 ppm2 2.005 CV 1
ASSI { 948}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HA ))
2.900 1.000 1.000 peak 948 spectrum 1 weight 0.10000E+01 volume 0.31971E-02 ppm1 2.362 ppm2 4.286 CV 1
ASSI { 953}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 67 and name HB3 ))
3.000 1.100 1.100 peak 953 spectrum 1 weight 0.10000E+01 volume 0.45430E-02 ppm1 2.066 ppm2 1.775 CV 1
ASSI { 955}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 67 and name HB2 ))
2.300 0.700 0.700 peak 955 spectrum 1 weight 0.10000E+01 volume 0.81101E-02 ppm1 2.068 ppm2 1.866 CV 1
ASSI { 956}
(( segid " " and resid 83 and name HG3 ))
(( segid " " and resid 83 and name HA ))
3.300 1.400 1.400 peak 956 spectrum 1 weight 0.10000E+01 volume 0.10755E-02 ppm1 2.135 ppm2 3.873 CV 1
ASSI { 959}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HA ))
2.500 0.800 0.800 peak 959 spectrum 1 weight 0.10000E+01 volume 0.44606E-02 ppm1 1.744 ppm2 4.135 CV 1
ASSI { 960}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HA ))
2.600 0.900 0.900 peak 960 spectrum 1 weight 0.10000E+01 volume 0.81688E-02 ppm1 2.071 ppm2 4.132 CV 1
ASSI { 963}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 39 and name HB2 ))
2.400 0.700 0.700 peak 963 spectrum 1 weight 0.10000E+01 volume 0.50660E-02 ppm1 4.168 ppm2 2.322 CV 1
ASSI { 964}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HG13))
2.900 1.100 1.100 peak 964 spectrum 1 weight 0.10000E+01 volume 0.45664E-02 ppm1 4.168 ppm2 1.305 CV 1
ASSI { 967}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HB3 ))
2.900 1.000 1.000 peak 967 spectrum 1 weight 0.10000E+01 volume 0.31618E-02 ppm1 4.282 ppm2 2.005 CV 1
ASSI { 969}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 36 and name HA ))
2.400 0.700 0.700 peak 969 spectrum 1 weight 0.10000E+01 volume 0.71701E-02 ppm1 0.970 ppm2 4.167 CV 1
ASSI { 970}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HB2 ))
2.800 1.000 1.000 peak 970 spectrum 1 weight 0.10000E+01 volume 0.33264E-02 ppm1 4.192 ppm2 1.681 CV 1
OR { 970}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HB3 ))
ASSI { 971}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 86 and name HG12))
2.000 0.500 0.500 peak 971 spectrum 1 weight 0.10000E+01 volume 0.11931E-01 ppm1 0.853 ppm2 1.407 CV 1
ASSI { 972}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 75 and name HG2%)
3.900 1.900 1.900 peak 972 spectrum 1 weight 0.10000E+01 volume 0.73462E-03 ppm1 5.044 ppm2 0.489 CV 1
ASSI { 973}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HB2 ))
2.300 0.700 0.700 peak 973 spectrum 1 weight 0.10000E+01 volume 0.45841E-02 ppm1 3.851 ppm2 0.123 CV 1
ASSI { 974}
(( segid " " and resid 68 and name HD3 ))
(( segid " " and resid 68 and name HB2 ))
3.000 1.100 1.100 peak 974 spectrum 1 weight 0.10000E+01 volume 0.74049E-03 ppm1 0.365 ppm2 0.122 CV 1
ASSI { 979}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 27 and name HB3 ))
3.900 1.900 1.900 peak 979 spectrum 1 weight 0.10000E+01 volume 0.47251E-03 ppm1 0.638 ppm2 2.572 CV 1
ASSI { 980}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HG ))
3.700 1.700 1.700 peak 980 spectrum 1 weight 0.10000E+01 volume 0.59358E-03 ppm1 4.654 ppm2 1.695 CV 1
#Ambiguous NOEs for CtBP THAP domain
ASSI { 17}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 37 and name HG ))
3.100 1.200 1.200 peak 17 spectrum 1 weight 0.10000E+01 volume 0.15648E-02 ppm1 10.352 ppm2 1.386 CV 1
OR { 17}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 74 and name HD3 ))
ASSI { 26}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HA2 ))
3.100 1.200 1.200 peak 26 spectrum 1 weight 0.10000E+01 volume 0.14943E-02 ppm1 10.078 ppm2 3.613 CV 1
OR { 26}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 12 and name HB2 ))
ASSI { 57}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HB3 ))
4.200 2.200 1.800 peak 57 spectrum 1 weight 0.10000E+01 volume 0.63155E-03 ppm1 8.928 ppm2 3.161 CV 1
OR { 57}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 77}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HB3 ))
2.800 1.000 1.000 peak 77 spectrum 1 weight 0.10000E+01 volume 0.33128E-02 ppm1 8.362 ppm2 1.637 CV 1
OR { 77}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 84 and name HB ))
ASSI { 136}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 53 and name HG1%)
2.900 2.900 3.100 peak 136 spectrum 1 weight 0.10000E+01 volume 0.40599E-02 ppm1 7.668 ppm2 0.969 CV 1
OR { 136}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 56 and name HD2%)
ASSI { 158}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HB3 ))
2.800 1.000 1.000 peak 158 spectrum 1 weight 0.10000E+01 volume 0.30450E-02 ppm1 9.648 ppm2 1.698 CV 1
OR { 158}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HG13))
ASSI { 185}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 30 and name HG2%)
4.000 2.000 2.000 peak 185 spectrum 1 weight 0.10000E+01 volume 0.10841E-02 ppm1 8.885 ppm2 0.928 CV 1
OR { 185}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 52 and name HG2%)
ASSI { 200}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB ))
2.400 0.700 0.700 peak 200 spectrum 1 weight 0.10000E+01 volume 0.72743E-02 ppm1 8.701 ppm2 1.829 CV 1
OR { 200}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HD3 ))
ASSI { 202}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 57 and name HG3 ))
3.300 3.300 2.700 peak 202 spectrum 1 weight 0.10000E+01 volume 0.26785E-02 ppm1 8.700 ppm2 1.532 CV 1
OR { 202}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 38 and name HG2 ))
ASSI { 227}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HB ))
2.700 0.900 0.900 peak 227 spectrum 1 weight 0.10000E+01 volume 0.25657E-02 ppm1 8.543 ppm2 1.913 CV 1
OR { 227}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HB2 ))
ASSI { 255}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HB2 ))
2.500 0.800 0.800 peak 255 spectrum 1 weight 0.10000E+01 volume 0.43983E-02 ppm1 7.757 ppm2 2.947 CV 1
OR { 255}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 23 and name HB2 ))
ASSI { 256}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HB3 ))
3.200 1.200 1.200 peak 256 spectrum 1 weight 0.10000E+01 volume 0.29463E-02 ppm1 7.759 ppm2 2.815 CV 1
OR { 256}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HB2 ))
ASSI { 257}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 86 and name HB ))
3.900 1.900 1.900 peak 257 spectrum 1 weight 0.10000E+01 volume 0.88528E-03 ppm1 7.757 ppm2 1.901 CV 1
OR { 257}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 85 and name HB2 ))
ASSI { 262}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 15 and name HG2 ))
2.700 2.700 3.300 peak 262 spectrum 1 weight 0.10000E+01 volume 0.63860E-02 ppm1 7.524 ppm2 1.858 CV 1
OR { 262}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 15 and name HG3 ))
OR { 262}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 42 and name HG ))
ASSI { 288}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.400 3.400 2.600 peak 288 spectrum 1 weight 0.10000E+01 volume 0.12899E-02 ppm1 8.062 ppm2 1.910 CV 1
OR { 288}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 86 and name HB ))
ASSI { 324}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HG12))
3.500 1.500 1.500 peak 324 spectrum 1 weight 0.10000E+01 volume 0.25234E-02 ppm1 7.698 ppm2 1.926 CV 1
OR { 324}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HB2 ))
ASSI { 363}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 36 and name HD1%)
3.800 1.800 1.800 peak 363 spectrum 1 weight 0.10000E+01 volume 0.76688E-03 ppm1 8.823 ppm2 0.995 CV 1
OR { 363}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 52 and name HG1%)
ASSI { 381}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HB3 ))
3.500 1.600 1.600 peak 381 spectrum 1 weight 0.10000E+01 volume 0.18608E-02 ppm1 8.361 ppm2 1.492 CV 1
OR { 381}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 44 and name HB% )
ASSI { 383}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 73 and name HG2%)
3.800 1.800 1.800 peak 383 spectrum 1 weight 0.10000E+01 volume 0.78099E-03 ppm1 8.361 ppm2 0.793 CV 1
OR { 383}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 42 and name HD1%)
ASSI { 401}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HB3 ))
2.600 0.900 0.900 peak 401 spectrum 1 weight 0.10000E+01 volume 0.31155E-02 ppm1 8.279 ppm2 2.519 CV 1
OR { 401}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HB2 ))
ASSI { 420}
(( segid " " and resid 55 and name HE22))
(( segid " " and resid 55 and name HE21))
1.800 0.400 0.400 peak 420 spectrum 1 weight 0.10000E+01 volume 0.17904E-01 ppm1 6.879 ppm2 7.547 CV 1
OR { 420}
(( segid " " and resid 24 and name HD22))
(( segid " " and resid 24 and name HD21))
ASSI { 477}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 23 and name HB2 ))
2.900 2.900 3.100 peak 477 spectrum 1 weight 0.10000E+01 volume 0.17057E-02 ppm1 8.089 ppm2 2.939 CV 1
OR { 477}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 63 and name HB2 ))
ASSI { 506}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 30 and name HG2%)
3.400 1.500 1.500 peak 506 spectrum 1 weight 0.10000E+01 volume 0.30027E-02 ppm1 8.601 ppm2 0.935 CV 1
OR { 506}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 52 and name HG2%)
ASSI { 3}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 73 and name HG12))
4.500 2.500 1.500 peak 3 spectrum 1 weight 0.10000E+01 volume 0.60263E-03 ppm1 10.358 ppm2 1.551 CV 1
OR { 3}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 73 and name HB ))
OR { 3}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 74 and name HG2 ))
ASSI { 8}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 73 and name HG13))
4.000 2.000 2.000 peak 8 spectrum 1 weight 0.10000E+01 volume 0.44436E-03 ppm1 10.358 ppm2 1.239 CV 1
OR { 8}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 74 and name HB3 ))
ASSI { 15}
(( segid " " and resid 41 and name HE1 ))
( segid " " and resid 73 and name HD1%)
4.000 2.000 2.000 peak 15 spectrum 1 weight 0.10000E+01 volume 0.10318E-02 ppm1 10.359 ppm2 0.884 CV 1
OR { 15}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 74 and name HG3 ))
ASSI { 17}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 68 and name HG2 ))
5.300 3.500 0.700 peak 17 spectrum 1 weight 0.10000E+01 volume 0.26570E-03 ppm1 10.359 ppm2 0.727 CV 1
OR { 17}
(( segid " " and resid 41 and name HE1 ))
(( segid " " and resid 31 and name HG3 ))
ASSI { 65}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 57 and name HB3 ))
4.600 2.700 1.400 peak 65 spectrum 1 weight 0.10000E+01 volume 0.33479E-03 ppm1 9.302 ppm2 1.705 CV 1
OR { 65}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HD3 ))
OR { 65}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HD2 ))
ASSI { 70}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB3 ))
2.900 1.000 1.000 peak 70 spectrum 1 weight 0.10000E+01 volume 0.63002E-02 ppm1 8.364 ppm2 1.656 CV 1
OR { 70}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HB2 ))
OR { 70}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HD3 ))
OR { 70}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HD2 ))
ASSI { 72}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HB2 ))
2.900 1.100 1.100 peak 72 spectrum 1 weight 0.10000E+01 volume 0.35306E-02 ppm1 8.456 ppm2 1.640 CV 1
OR { 72}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HG2 ))
ASSI { 78}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HB2 ))
3.400 1.400 1.400 peak 78 spectrum 1 weight 0.10000E+01 volume 0.25992E-02 ppm1 8.939 ppm2 1.505 CV 1
OR { 78}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HB2 ))
ASSI { 79}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 38 and name HG2 ))
4.500 2.500 1.500 peak 79 spectrum 1 weight 0.10000E+01 volume 0.34088E-03 ppm1 8.893 ppm2 1.500 CV 1
OR { 79}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 44 and name HB% )
ASSI { 81}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HG2 ))
3.900 1.900 1.900 peak 81 spectrum 1 weight 0.10000E+01 volume 0.47480E-03 ppm1 8.829 ppm2 1.496 CV 1
OR { 81}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HG13))
ASSI { 82}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HG12))
2.600 0.800 0.800 peak 82 spectrum 1 weight 0.10000E+01 volume 0.32566E-02 ppm1 8.611 ppm2 1.484 CV 1
OR { 82}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB3 ))
ASSI { 83}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HG3 ))
3.500 1.600 1.600 peak 83 spectrum 1 weight 0.10000E+01 volume 0.23010E-02 ppm1 8.567 ppm2 1.478 CV 1
OR { 83}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HG2 ))
ASSI { 84}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HG12))
4.000 2.000 2.000 peak 84 spectrum 1 weight 0.10000E+01 volume 0.14883E-02 ppm1 8.554 ppm2 1.418 CV 1
OR { 84}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HG3 ))
ASSI { 86}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 37 and name HG ))
4.600 2.600 1.400 peak 86 spectrum 1 weight 0.10000E+01 volume 0.31653E-03 ppm1 8.893 ppm2 1.389 CV 1
OR { 86}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 74 and name HD3 ))
ASSI { 89}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 37 and name HB3 ))
4.200 2.200 1.800 peak 89 spectrum 1 weight 0.10000E+01 volume 0.80962E-03 ppm1 8.830 ppm2 1.329 CV 1
OR { 89}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HG3 ))
ASSI { 98}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 37 and name HD1%)
4.200 2.200 1.800 peak 98 spectrum 1 weight 0.10000E+01 volume 0.86134E-03 ppm1 8.553 ppm2 1.155 CV 1
OR { 98}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 37 and name HD1%)
ASSI { 99}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HG2 ))
2.800 0.900 0.900 peak 99 spectrum 1 weight 0.10000E+01 volume 0.24288E-02 ppm1 8.940 ppm2 1.102 CV 1
OR { 99}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 13 and name HG2 ))
ASSI { 102}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 37 and name HD2%)
5.100 3.300 0.900 peak 102 spectrum 1 weight 0.10000E+01 volume 0.33479E-03 ppm1 8.891 ppm2 1.009 CV 1
OR { 102}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 52 and name HG1%)
ASSI { 103}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 36 and name HD1%)
4.400 2.400 1.600 peak 103 spectrum 1 weight 0.10000E+01 volume 0.56610E-03 ppm1 8.830 ppm2 0.999 CV 1
OR { 103}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 37 and name HD2%)
OR { 103}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 30 and name HD1%)
OR { 103}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 31 and name HG2 ))
ASSI { 107}
(( segid " " and resid 88 and name HN ))
( segid " " and resid 88 and name HD1%)
3.700 1.700 1.700 peak 107 spectrum 1 weight 0.10000E+01 volume 0.15613E-02 ppm1 8.456 ppm2 0.910 CV 1
OR { 107}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 21 and name HD1%)
ASSI { 108}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 84 and name HG2%)
2.700 0.900 0.900 peak 108 spectrum 1 weight 0.10000E+01 volume 0.42610E-02 ppm1 8.370 ppm2 0.895 CV 1
OR { 108}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 73 and name HD1%)
ASSI { 109}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 73 and name HD1%)
4.700 2.700 1.300 peak 109 spectrum 1 weight 0.10000E+01 volume 0.50828E-03 ppm1 8.892 ppm2 0.885 CV 1
OR { 109}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 74 and name HG3 ))
OR { 109}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 45 and name HD1%)
ASSI { 112}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 73 and name HG2%)
4.600 2.700 1.400 peak 112 spectrum 1 weight 0.10000E+01 volume 0.60263E-03 ppm1 8.892 ppm2 0.788 CV 1
OR { 112}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 42 and name HD1%)
ASSI { 118}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 42 and name HD2%)
5.000 3.200 1.000 peak 118 spectrum 1 weight 0.10000E+01 volume 0.42306E-03 ppm1 8.370 ppm2 0.636 CV 1
OR { 118}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 5 and name HG2%)
ASSI { 164}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HB3 ))
3.100 1.200 1.200 peak 164 spectrum 1 weight 0.10000E+01 volume 0.37436E-02 ppm1 8.633 ppm2 2.228 CV 1
OR { 164}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 34 and name HB3 ))
ASSI { 165}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 81 and name HB3 ))
2.700 0.900 0.900 peak 165 spectrum 1 weight 0.10000E+01 volume 0.55393E-02 ppm1 8.288 ppm2 2.228 CV 1
OR { 165}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HB3 ))
OR { 165}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HG3 ))
ASSI { 166}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HB2 ))
3.500 1.600 1.600 peak 166 spectrum 1 weight 0.10000E+01 volume 0.70613E-03 ppm1 8.445 ppm2 2.209 CV 1
OR { 166}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HG3 ))
ASSI { 174}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HB2 ))
3.700 1.700 1.700 peak 174 spectrum 1 weight 0.10000E+01 volume 0.10774E-02 ppm1 9.092 ppm2 2.071 CV 1
OR { 174}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HG2 ))
ASSI { 178}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HB ))
2.400 0.700 0.700 peak 178 spectrum 1 weight 0.10000E+01 volume 0.55697E-02 ppm1 8.632 ppm2 2.032 CV 1
OR { 178}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 31 and name HB2 ))
ASSI { 180}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HB3 ))
3.400 1.500 1.500 peak 180 spectrum 1 weight 0.10000E+01 volume 0.22005E-02 ppm1 8.308 ppm2 2.025 CV 1
OR { 180}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HB2 ))
OR { 180}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 80 and name HB ))
ASSI { 181}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 78 and name HB2 ))
4.300 2.300 1.700 peak 181 spectrum 1 weight 0.10000E+01 volume 0.84610E-03 ppm1 9.429 ppm2 2.009 CV 1
OR { 181}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 83 and name HB3 ))
ASSI { 185}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 22 and name HB3 ))
2.400 0.700 0.700 peak 185 spectrum 1 weight 0.10000E+01 volume 0.94353E-02 ppm1 8.366 ppm2 1.994 CV 1
OR { 185}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HB2 ))
ASSI { 194}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HB3 ))
2.700 0.900 0.900 peak 194 spectrum 1 weight 0.10000E+01 volume 0.73654E-02 ppm1 8.385 ppm2 1.912 CV 1
OR { 194}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HB ))
ASSI { 196}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB2 ))
3.000 1.100 1.100 peak 196 spectrum 1 weight 0.10000E+01 volume 0.41089E-02 ppm1 8.708 ppm2 1.900 CV 1
OR { 196}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 58 and name HG12))
ASSI { 201}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HB2 ))
3.000 1.100 1.100 peak 201 spectrum 1 weight 0.10000E+01 volume 0.46567E-02 ppm1 8.830 ppm2 1.826 CV 1
OR { 201}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 31 and name HD3 ))
ASSI { 228}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HA ))
3.100 1.200 1.200 peak 228 spectrum 1 weight 0.10000E+01 volume 0.17318E-02 ppm1 9.103 ppm2 4.621 CV 1
OR { 228}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 7 and name HA ))
ASSI { 234}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB ))
4.300 2.300 1.700 peak 234 spectrum 1 weight 0.10000E+01 volume 0.54176E-03 ppm1 7.674 ppm2 4.581 CV 1
OR { 234}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 53 and name HA ))
ASSI { 246}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HA ))
2.600 0.900 0.900 peak 246 spectrum 1 weight 0.10000E+01 volume 0.50219E-02 ppm1 7.849 ppm2 4.426 CV 1
OR { 246}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HA ))
ASSI { 252}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 15 and name HA ))
3.400 1.500 1.500 peak 252 spectrum 1 weight 0.10000E+01 volume 0.11687E-02 ppm1 7.869 ppm2 4.348 CV 1
OR { 252}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 40 and name HA ))
ASSI { 253}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA ))
2.900 1.000 1.000 peak 253 spectrum 1 weight 0.10000E+01 volume 0.28031E-02 ppm1 7.825 ppm2 4.353 CV 1
OR { 253}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HA ))
OR { 253}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 14 and name HA ))
ASSI { 257}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 71 and name HA1 ))
3.300 1.300 1.300 peak 257 spectrum 1 weight 0.10000E+01 volume 0.17623E-02 ppm1 8.550 ppm2 4.309 CV 1
OR { 257}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 71 and name HA1 ))
ASSI { 263}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HA ))
3.000 1.200 1.200 peak 263 spectrum 1 weight 0.10000E+01 volume 0.21183E-02 ppm1 7.797 ppm2 4.291 CV 1
OR { 263}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 13 and name HA ))
ASSI { 265}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA ))
2.700 0.900 0.900 peak 265 spectrum 1 weight 0.10000E+01 volume 0.50523E-02 ppm1 8.306 ppm2 4.244 CV 1
OR { 265}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 80 and name HA ))
ASSI { 270}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 22 and name HA ))
2.500 0.800 0.800 peak 270 spectrum 1 weight 0.10000E+01 volume 0.77611E-02 ppm1 8.333 ppm2 4.222 CV 1
OR { 270}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HA ))
OR { 270}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HB ))
ASSI { 271}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HB ))
2.500 0.800 0.800 peak 271 spectrum 1 weight 0.10000E+01 volume 0.62393E-02 ppm1 7.873 ppm2 4.208 CV 1
OR { 271}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA ))
ASSI { 272}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 37 and name HA ))
4.000 2.000 2.000 peak 272 spectrum 1 weight 0.10000E+01 volume 0.57219E-03 ppm1 8.891 ppm2 4.190 CV 1
OR { 272}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 43 and name HB ))
ASSI { 293}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 43 and name HA ))
3.800 1.800 1.800 peak 293 spectrum 1 weight 0.10000E+01 volume 0.63002E-03 ppm1 8.139 ppm2 4.052 CV 1
OR { 293}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 9 and name HA ))
OR { 293}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 52 and name HA ))
ASSI { 310}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HD2 ))
3.100 1.200 1.200 peak 310 spectrum 1 weight 0.10000E+01 volume 0.13574E-02 ppm1 8.293 ppm2 3.932 CV 1
OR { 310}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HB3 ))
OR { 310}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 313}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HA ))
3.100 1.200 1.200 peak 313 spectrum 1 weight 0.10000E+01 volume 0.21305E-02 ppm1 7.813 ppm2 3.914 CV 1
OR { 313}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 314}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
2.800 1.000 1.000 peak 314 spectrum 1 weight 0.10000E+01 volume 0.22401E-02 ppm1 8.609 ppm2 3.910 CV 1
OR { 314}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 76 and name HD2 ))
ASSI { 318}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HA2 ))
2.900 1.000 1.000 peak 318 spectrum 1 weight 0.10000E+01 volume 0.40480E-02 ppm1 7.708 ppm2 3.885 CV 1
OR { 318}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 83 and name HA ))
ASSI { 331}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 12 and name HB2 ))
4.000 2.000 2.000 peak 331 spectrum 1 weight 0.10000E+01 volume 0.13605E-02 ppm1 8.934 ppm2 3.597 CV 1
OR { 331}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HB2 ))
ASSI { 337}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HA ))
3.400 1.400 1.400 peak 337 spectrum 1 weight 0.10000E+01 volume 0.23983E-02 ppm1 8.819 ppm2 3.491 CV 1
OR { 337}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB2 ))
ASSI { 345}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 60 and name HB3 ))
3.100 1.200 1.200 peak 345 spectrum 1 weight 0.10000E+01 volume 0.20636E-02 ppm1 8.079 ppm2 3.323 CV 1
OR { 345}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HD2 ))
OR { 345}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HD3 ))
ASSI { 349}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HB2 ))
3.700 1.700 1.700 peak 349 spectrum 1 weight 0.10000E+01 volume 0.61480E-03 ppm1 7.823 ppm2 3.173 CV 1
OR { 349}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HB2 ))
ASSI { 351}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 25 and name HD2 ))
3.800 1.800 1.800 peak 351 spectrum 1 weight 0.10000E+01 volume 0.68482E-03 ppm1 7.816 ppm2 3.129 CV 1
OR { 351}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 352}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 74 and name HA ))
2.100 0.500 0.500 peak 352 spectrum 1 weight 0.10000E+01 volume 0.11535E-01 ppm1 7.951 ppm2 3.106 CV 1
OR { 352}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 372}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 23 and name HA ))
3.400 1.400 1.400 peak 372 spectrum 1 weight 0.10000E+01 volume 0.13179E-02 ppm1 7.165 ppm2 4.478 CV 1
OR { 372}
(( segid " " and resid 27 and name HZ ))
(( segid " " and resid 6 and name HA ))
ASSI { 379}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 60 and name HB2 ))
4.500 2.500 1.500 peak 379 spectrum 1 weight 0.10000E+01 volume 0.34392E-03 ppm1 6.895 ppm2 4.377 CV 1
OR { 379}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 12 and name HA ))
ASSI { 385}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 84 and name HA ))
2.900 1.100 1.100 peak 385 spectrum 1 weight 0.10000E+01 volume 0.16709E-02 ppm1 6.952 ppm2 4.294 CV 1
OR { 385}
(( segid " " and resid 11 and name HD22))
(( segid " " and resid 11 and name HA ))
ASSI { 391}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HA ))
2.600 0.900 0.900 peak 391 spectrum 1 weight 0.10000E+01 volume 0.45654E-02 ppm1 7.573 ppm2 4.225 CV 1
OR { 391}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HA ))
ASSI { 396}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 36 and name HA ))
2.900 1.000 1.000 peak 396 spectrum 1 weight 0.10000E+01 volume 0.58133E-02 ppm1 7.521 ppm2 4.138 CV 1
OR { 396}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 41 and name HA ))
OR { 396}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 32 and name HA ))
ASSI { 401}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 35 and name HA ))
3.200 1.300 1.300 peak 401 spectrum 1 weight 0.10000E+01 volume 0.17623E-02 ppm1 7.530 ppm2 4.052 CV 1
OR { 401}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 73 and name HA ))
ASSI { 406}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 78 and name HD2 ))
3.300 1.400 1.400 peak 406 spectrum 1 weight 0.10000E+01 volume 0.19814E-02 ppm1 7.264 ppm2 3.963 CV 1
OR { 406}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 62 and name HA ))
ASSI { 409}
(( segid " " and resid 27 and name HZ ))
(( segid " " and resid 5 and name HA ))
3.400 3.400 2.600 peak 409 spectrum 1 weight 0.10000E+01 volume 0.41393E-03 ppm1 7.171 ppm2 3.935 CV 1
OR { 409}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 16 and name HB3 ))
OR { 409}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 16 and name HB2 ))
ASSI { 410}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 61 and name HA ))
2.900 1.100 1.100 peak 410 spectrum 1 weight 0.10000E+01 volume 0.28914E-02 ppm1 7.058 ppm2 3.918 CV 1
OR { 410}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 66 and name HA2 ))
ASSI { 411}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 76 and name HD2 ))
4.000 2.000 2.000 peak 411 spectrum 1 weight 0.10000E+01 volume 0.13514E-02 ppm1 6.894 ppm2 3.923 CV 1
OR { 411}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 5 and name HA ))
ASSI { 415}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HA ))
2.900 1.100 1.100 peak 415 spectrum 1 weight 0.10000E+01 volume 0.21457E-02 ppm1 7.579 ppm2 3.871 CV 1
OR { 415}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HA2 ))
ASSI { 427}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 8 and name HA2 ))
4.000 2.000 2.000 peak 427 spectrum 1 weight 0.10000E+01 volume 0.94353E-03 ppm1 6.649 ppm2 3.602 CV 1
OR { 427}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 12 and name HB2 ))
ASSI { 437}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 5 and name HB ))
3.000 1.100 1.100 peak 437 spectrum 1 weight 0.10000E+01 volume 0.18140E-02 ppm1 7.078 ppm2 3.397 CV 1
OR { 437}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 7 and name HB2 ))
ASSI { 438}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 5 and name HB ))
4.100 2.100 1.900 peak 438 spectrum 1 weight 0.10000E+01 volume 0.35915E-03 ppm1 6.878 ppm2 3.397 CV 1
OR { 438}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 7 and name HB2 ))
ASSI { 442}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 10 and name HD2 ))
3.800 1.800 1.800 peak 442 spectrum 1 weight 0.10000E+01 volume 0.55088E-03 ppm1 6.894 ppm2 3.321 CV 1
OR { 442}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 60 and name HB3 ))
ASSI { 444}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HD2 ))
2.500 2.500 3.500 peak 444 spectrum 1 weight 0.10000E+01 volume 0.15126E-01 ppm1 7.487 ppm2 3.183 CV 1
OR { 444}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HD3 ))
OR { 444}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 38 and name HD2 ))
ASSI { 453}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 7 and name HB3 ))
2.900 1.100 1.100 peak 453 spectrum 1 weight 0.10000E+01 volume 0.29218E-02 ppm1 7.078 ppm2 3.117 CV 1
OR { 453}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 25 and name HD2 ))
OR { 453}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 62 and name HB2 ))
ASSI { 454}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 41 and name HB3 ))
4.100 2.100 1.900 peak 454 spectrum 1 weight 0.10000E+01 volume 0.12509E-02 ppm1 7.025 ppm2 3.115 CV 1
OR { 454}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 74 and name HA ))
ASSI { 455}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 62 and name HB2 ))
4.200 2.200 1.800 peak 455 spectrum 1 weight 0.10000E+01 volume 0.94353E-03 ppm1 6.885 ppm2 3.112 CV 1
OR { 455}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 74 and name HA ))
ASSI { 457}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 62 and name HB2 ))
3.100 1.200 1.200 peak 457 spectrum 1 weight 0.10000E+01 volume 0.13422E-02 ppm1 7.291 ppm2 3.105 CV 1
OR { 457}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 74 and name HA ))
ASSI { 458}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 74 and name HA ))
3.700 1.700 1.700 peak 458 spectrum 1 weight 0.10000E+01 volume 0.13118E-02 ppm1 6.940 ppm2 3.100 CV 1
OR { 458}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 41 and name HB3 ))
OR { 458}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 459}
(( segid " " and resid 63 and name HZ ))
(( segid " " and resid 74 and name HA ))
4.300 2.300 1.700 peak 459 spectrum 1 weight 0.10000E+01 volume 0.27088E-03 ppm1 6.716 ppm2 3.103 CV 1
OR { 459}
(( segid " " and resid 63 and name HZ ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 470}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 63 and name HB2 ))
2.400 0.700 0.700 peak 470 spectrum 1 weight 0.10000E+01 volume 0.77915E-02 ppm1 7.292 ppm2 2.945 CV 1
OR { 470}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 72 and name HB2 ))
ASSI { 473}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 27 and name HB2 ))
3.500 1.600 1.600 peak 473 spectrum 1 weight 0.10000E+01 volume 0.23831E-02 ppm1 7.078 ppm2 2.844 CV 1
OR { 473}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 59 and name HB2 ))
ASSI { 478}
(( segid " " and resid 11 and name HD22))
(( segid " " and resid 11 and name HB3 ))
3.500 1.600 1.600 peak 478 spectrum 1 weight 0.10000E+01 volume 0.28762E-02 ppm1 6.928 ppm2 2.810 CV 1
OR { 478}
(( segid " " and resid 24 and name HD22))
(( segid " " and resid 24 and name HB3 ))
OR { 478}
(( segid " " and resid 24 and name HD22))
(( segid " " and resid 24 and name HB2 ))
ASSI { 483}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 68 and name HE2 ))
3.400 1.400 1.400 peak 483 spectrum 1 weight 0.10000E+01 volume 0.13301E-02 ppm1 7.217 ppm2 2.694 CV 1
OR { 483}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HE2 ))
ASSI { 491}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 23 and name HB3 ))
3.400 1.500 1.500 peak 491 spectrum 1 weight 0.10000E+01 volume 0.92525E-03 ppm1 7.167 ppm2 2.549 CV 1
OR { 491}
(( segid " " and resid 27 and name HZ ))
(( segid " " and resid 59 and name HB3 ))
ASSI { 492}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 27 and name HB3 ))
3.700 1.700 1.700 peak 492 spectrum 1 weight 0.10000E+01 volume 0.17440E-02 ppm1 7.079 ppm2 2.552 CV 1
OR { 492}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 59 and name HB3 ))
ASSI { 493}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 77 and name HB3 ))
3.900 1.900 1.900 peak 493 spectrum 1 weight 0.10000E+01 volume 0.74260E-03 ppm1 7.263 ppm2 2.509 CV 1
OR { 493}
( segid " " and resid 14 and name HE% )
(( segid " " and resid 76 and name HB2 ))
ASSI { 518}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HG3 ))
3.700 1.700 1.700 peak 518 spectrum 1 weight 0.10000E+01 volume 0.98000E-03 ppm1 6.937 ppm2 2.134 CV 1
OR { 518}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 68 and name HE3 ))
ASSI { 522}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 10 and name HB2 ))
4.600 2.600 1.400 peak 522 spectrum 1 weight 0.10000E+01 volume 0.60871E-03 ppm1 6.648 ppm2 2.059 CV 1
OR { 522}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 45 and name HB ))
ASSI { 523}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HB ))
2.600 0.900 0.900 peak 523 spectrum 1 weight 0.10000E+01 volume 0.45045E-02 ppm1 7.576 ppm2 2.042 CV 1
OR { 523}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB ))
ASSI { 528}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.500 1.500 1.500 peak 528 spectrum 1 weight 0.10000E+01 volume 0.23740E-02 ppm1 7.530 ppm2 1.910 CV 1
OR { 528}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 36 and name HB ))
ASSI { 529}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HB ))
2.400 0.700 0.700 peak 529 spectrum 1 weight 0.10000E+01 volume 0.48089E-02 ppm1 6.606 ppm2 1.914 CV 1
OR { 529}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
ASSI { 530}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB2 ))
4.300 2.300 1.700 peak 530 spectrum 1 weight 0.10000E+01 volume 0.80349E-03 ppm1 7.230 ppm2 1.869 CV 1
OR { 530}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 58 and name HG12))
ASSI { 538}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 31 and name HD3 ))
2.800 2.800 3.200 peak 538 spectrum 1 weight 0.10000E+01 volume 0.84003E-02 ppm1 7.595 ppm2 1.841 CV 1
OR { 538}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 42 and name HG ))
ASSI { 541}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB2 ))
3.100 1.200 1.200 peak 541 spectrum 1 weight 0.10000E+01 volume 0.16496E-02 ppm1 7.486 ppm2 1.812 CV 1
OR { 541}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 38 and name HB2 ))
ASSI { 547}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 57 and name HB3 ))
4.000 2.000 2.000 peak 547 spectrum 1 weight 0.10000E+01 volume 0.90091E-03 ppm1 7.097 ppm2 1.683 CV 1
OR { 547}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 17 and name HB2 ))
ASSI { 549}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 58 and name HG13))
2.900 1.000 1.000 peak 549 spectrum 1 weight 0.10000E+01 volume 0.19844E-02 ppm1 7.522 ppm2 1.674 CV 1
OR { 549}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 30 and name HG12))
ASSI { 555}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 25 and name HB2 ))
3.500 1.500 1.500 peak 555 spectrum 1 weight 0.10000E+01 volume 0.78832E-03 ppm1 7.078 ppm2 1.573 CV 1
OR { 555}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 25 and name HB2 ))
ASSI { 556}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 84 and name HG12))
3.500 1.500 1.500 peak 556 spectrum 1 weight 0.10000E+01 volume 0.24105E-02 ppm1 6.956 ppm2 1.551 CV 1
OR { 556}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 73 and name HB ))
ASSI { 558}
(( segid " " and resid 83 and name HE22))
(( segid " " and resid 73 and name HB ))
3.100 3.100 2.900 peak 558 spectrum 1 weight 0.10000E+01 volume 0.23344E-02 ppm1 6.686 ppm2 1.532 CV 1
OR { 558}
(( segid " " and resid 83 and name HE22))
(( segid " " and resid 85 and name HG2 ))
ASSI { 559}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 30 and name HG13))
3.200 1.300 1.300 peak 559 spectrum 1 weight 0.10000E+01 volume 0.32566E-02 ppm1 7.524 ppm2 1.512 CV 1
OR { 559}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HG2 ))
ASSI { 560}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 30 and name HG13))
3.200 1.300 1.300 peak 560 spectrum 1 weight 0.10000E+01 volume 0.24349E-02 ppm1 7.024 ppm2 1.521 CV 1
OR { 560}
(( segid " " and resid 41 and name HZ3 ))
(( segid " " and resid 74 and name HG2 ))
ASSI { 568}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 17 and name HG3 ))
3.300 1.400 1.400 peak 568 spectrum 1 weight 0.10000E+01 volume 0.60567E-03 ppm1 6.793 ppm2 1.468 CV 1
OR { 568}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 17 and name HG2 ))
OR { 568}
( segid " " and resid 18 and name HE% )
(( segid " " and resid 25 and name HG2 ))
ASSI { 573}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB3 ))
2.300 0.700 0.700 peak 573 spectrum 1 weight 0.10000E+01 volume 0.56306E-02 ppm1 7.530 ppm2 1.388 CV 1
OR { 573}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 74 and name HD3 ))
ASSI { 574}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 38 and name HB3 ))
2.800 2.800 3.200 peak 574 spectrum 1 weight 0.10000E+01 volume 0.96180E-02 ppm1 7.484 ppm2 1.391 CV 1
OR { 574}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 37 and name HG ))
ASSI { 577}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 68 and name HD2 ))
3.000 1.100 1.100 peak 577 spectrum 1 weight 0.10000E+01 volume 0.20423E-02 ppm1 6.946 ppm2 1.376 CV 1
OR { 577}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 74 and name HD3 ))
ASSI { 583}
(( segid " " and resid 41 and name HH2 ))
( segid " " and resid 58 and name HG2%)
3.200 1.300 1.300 peak 583 spectrum 1 weight 0.10000E+01 volume 0.31653E-02 ppm1 6.940 ppm2 1.254 CV 1
OR { 583}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 73 and name HG13))
ASSI { 602}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 37 and name HD2%)
2.900 1.100 1.100 peak 602 spectrum 1 weight 0.10000E+01 volume 0.49306E-02 ppm1 7.524 ppm2 1.015 CV 1
OR { 602}
(( segid " " and resid 41 and name HE3 ))
( segid " " and resid 30 and name HD1%)
ASSI { 609}
(( segid " " and resid 56 and name HN ))
( segid " " and resid 53 and name HG2%)
2.600 2.600 3.400 peak 609 spectrum 1 weight 0.10000E+01 volume 0.22127E-02 ppm1 7.358 ppm2 0.950 CV 1
OR { 609}
(( segid " " and resid 56 and name HN ))
( segid " " and resid 30 and name HG2%)
ASSI { 614}
(( segid " " and resid 84 and name HN ))
( segid " " and resid 84 and name HG2%)
3.300 1.400 1.400 peak 614 spectrum 1 weight 0.10000E+01 volume 0.31653E-02 ppm1 6.952 ppm2 0.899 CV 1
OR { 614}
(( segid " " and resid 84 and name HN ))
( segid " " and resid 73 and name HD1%)
ASSI { 615}
(( segid " " and resid 41 and name HD1 ))
( segid " " and resid 73 and name HD1%)
3.300 1.400 1.400 peak 615 spectrum 1 weight 0.10000E+01 volume 0.31957E-02 ppm1 7.599 ppm2 0.880 CV 1
OR { 615}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 74 and name HG3 ))
ASSI { 617}
( segid " " and resid 9 and name HD% )
( segid " " and resid 45 and name HD1%)
4.000 2.000 2.000 peak 617 spectrum 1 weight 0.10000E+01 volume 0.11383E-02 ppm1 6.647 ppm2 0.883 CV 1
OR { 617}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 74 and name HG3 ))
ASSI { 618}
(( segid " " and resid 80 and name HN ))
( segid " " and resid 80 and name HG2%)
2.700 0.900 0.900 peak 618 spectrum 1 weight 0.10000E+01 volume 0.57219E-02 ppm1 7.575 ppm2 0.862 CV 1
OR { 618}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 45 and name HD1%)
ASSI { 621}
(( segid " " and resid 9 and name HZ ))
( segid " " and resid 45 and name HG2%)
3.600 1.700 1.700 peak 621 spectrum 1 weight 0.10000E+01 volume 0.11596E-02 ppm1 6.979 ppm2 0.789 CV 1
OR { 621}
(( segid " " and resid 9 and name HZ ))
( segid " " and resid 73 and name HG2%)
ASSI { 623}
(( segid " " and resid 41 and name HE3 ))
( segid " " and resid 73 and name HG2%)
4.300 2.300 1.700 peak 623 spectrum 1 weight 0.10000E+01 volume 0.97393E-03 ppm1 7.524 ppm2 0.783 CV 1
OR { 623}
(( segid " " and resid 41 and name HE3 ))
( segid " " and resid 45 and name HG2%)
OR { 623}
(( segid " " and resid 38 and name HN ))
( segid " " and resid 42 and name HD1%)
ASSI { 627}
(( segid " " and resid 41 and name HZ2 ))
(( segid " " and resid 68 and name HG2 ))
3.800 1.800 1.800 peak 627 spectrum 1 weight 0.10000E+01 volume 0.16375E-02 ppm1 7.443 ppm2 0.729 CV 1
OR { 627}
(( segid " " and resid 41 and name HZ2 ))
(( segid " " and resid 31 and name HG3 ))
ASSI { 628}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 68 and name HG2 ))
4.300 2.300 1.700 peak 628 spectrum 1 weight 0.10000E+01 volume 0.82783E-03 ppm1 7.292 ppm2 0.713 CV 1
OR { 628}
( segid " " and resid 63 and name HD% )
(( segid " " and resid 31 and name HG3 ))
ASSI { 629}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 68 and name HG2 ))
5.100 3.200 0.900 peak 629 spectrum 1 weight 0.10000E+01 volume 0.36219E-03 ppm1 6.946 ppm2 0.729 CV 1
OR { 629}
(( segid " " and resid 41 and name HH2 ))
(( segid " " and resid 31 and name HG3 ))
ASSI { 632}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HG3 ))
4.000 2.000 2.000 peak 632 spectrum 1 weight 0.10000E+01 volume 0.12083E-02 ppm1 7.231 ppm2 0.685 CV 1
OR { 632}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 68 and name HG3 ))
ASSI { 637}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HB ))
2.700 0.900 0.900 peak 637 spectrum 1 weight 0.10000E+01 volume 0.72743E-02 ppm1 7.769 ppm2 2.130 CV 1
OR { 637}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 52 and name HB ))
ASSI { 643}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB2 ))
2.700 0.900 0.900 peak 643 spectrum 1 weight 0.10000E+01 volume 0.20605E-02 ppm1 8.139 ppm2 1.921 CV 1
OR { 643}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 45 and name HG12))
ASSI { 648}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 62 and name HB3 ))
2.700 0.900 0.900 peak 648 spectrum 1 weight 0.10000E+01 volume 0.36219E-02 ppm1 7.949 ppm2 1.862 CV 1
OR { 648}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HB3 ))
ASSI { 653}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 84 and name HB ))
4.500 2.500 1.500 peak 653 spectrum 1 weight 0.10000E+01 volume 0.46567E-03 ppm1 8.251 ppm2 1.636 CV 1
OR { 653}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 85 and name HB3 ))
ASSI { 654}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 84 and name HB ))
3.700 1.700 1.700 peak 654 spectrum 1 weight 0.10000E+01 volume 0.48697E-03 ppm1 7.709 ppm2 1.634 CV 1
OR { 654}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 85 and name HB3 ))
ASSI { 657}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HB2 ))
2.600 0.900 0.900 peak 657 spectrum 1 weight 0.10000E+01 volume 0.29066E-02 ppm1 7.769 ppm2 1.574 CV 1
OR { 657}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HG2 ))
ASSI { 659}
(( segid " " and resid 75 and name HN ))
( segid " " and resid 44 and name HB% )
4.100 2.100 1.900 peak 659 spectrum 1 weight 0.10000E+01 volume 0.50219E-03 ppm1 7.951 ppm2 1.505 CV 1
OR { 659}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 78 and name HG3 ))
ASSI { 661}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 44 and name HB% )
4.400 2.400 1.600 peak 661 spectrum 1 weight 0.10000E+01 volume 0.55088E-03 ppm1 7.709 ppm2 1.509 CV 1
OR { 661}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 47 and name HG3 ))
ASSI { 662}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 42 and name HB3 ))
2.700 0.900 0.900 peak 662 spectrum 1 weight 0.10000E+01 volume 0.45958E-02 ppm1 8.126 ppm2 1.479 CV 1
OR { 662}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 82 and name HG2 ))
ASSI { 668}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 25 and name HB3 ))
2.700 0.900 0.900 peak 668 spectrum 1 weight 0.10000E+01 volume 0.24257E-02 ppm1 7.995 ppm2 1.270 CV 1
OR { 668}
(( segid " " and resid 60 and name HN ))
( segid " " and resid 58 and name HG2%)
ASSI { 674}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 48 and name HG2%)
3.000 1.200 1.200 peak 674 spectrum 1 weight 0.10000E+01 volume 0.32870E-02 ppm1 7.766 ppm2 1.172 CV 1
OR { 674}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 51 and name HG2%)
ASSI { 676}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 52 and name HG1%)
3.800 1.800 1.800 peak 676 spectrum 1 weight 0.10000E+01 volume 0.91609E-03 ppm1 7.765 ppm2 0.996 CV 1
OR { 676}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 56 and name HD2%)
ASSI { 678}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 52 and name HG2%)
4.300 2.300 1.700 peak 678 spectrum 1 weight 0.10000E+01 volume 0.77004E-03 ppm1 7.765 ppm2 0.916 CV 1
OR { 678}
(( segid " " and resid 72 and name HN ))
( segid " " and resid 86 and name HG2%)
ASSI { 680}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 73 and name HD1%)
3.300 1.400 1.400 peak 680 spectrum 1 weight 0.10000E+01 volume 0.13848E-02 ppm1 8.253 ppm2 0.886 CV 1
OR { 680}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 84 and name HG2%)
ASSI { 681}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 45 and name HD1%)
4.500 2.500 1.500 peak 681 spectrum 1 weight 0.10000E+01 volume 0.73350E-03 ppm1 7.708 ppm2 0.886 CV 1
OR { 681}
(( segid " " and resid 83 and name HE21))
( segid " " and resid 84 and name HG2%)
ASSI { 684}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 73 and name HG2%)
3.600 1.600 1.600 peak 684 spectrum 1 weight 0.10000E+01 volume 0.81873E-03 ppm1 7.870 ppm2 0.789 CV 1
OR { 684}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 45 and name HG2%)
ASSI { 685}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 45 and name HG2%)
5.000 3.100 1.000 peak 685 spectrum 1 weight 0.10000E+01 volume 0.37132E-03 ppm1 8.138 ppm2 0.781 CV 1
OR { 685}
(( segid " " and resid 47 and name HN ))
( segid " " and resid 42 and name HD1%)
ASSI { 686}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 45 and name HG2%)
4.300 2.300 1.700 peak 686 spectrum 1 weight 0.10000E+01 volume 0.69392E-03 ppm1 7.707 ppm2 0.786 CV 1
OR { 686}
(( segid " " and resid 83 and name HE21))
( segid " " and resid 73 and name HG2%)
ASSI { 691}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 25 and name HD3 ))
2.800 2.800 3.200 peak 691 spectrum 1 weight 0.10000E+01 volume 0.34088E-02 ppm1 7.806 ppm2 2.972 CV 1
OR { 691}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 47 and name HD3 ))
ASSI { 701}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HB2 ))
3.400 1.500 1.500 peak 701 spectrum 1 weight 0.10000E+01 volume 0.20909E-02 ppm1 8.123 ppm2 2.552 CV 1
OR { 701}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HB3 ))
ASSI { 704}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 63 and name HB3 ))
4.100 2.100 1.900 peak 704 spectrum 1 weight 0.10000E+01 volume 0.50523E-03 ppm1 7.949 ppm2 2.399 CV 1
OR { 704}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 9 and name HB3 ))
OR { 704}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 63 and name HB3 ))
OR { 704}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 74 and name HD2 ))
ASSI { 710}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HG13))
4.600 2.600 1.400 peak 710 spectrum 1 weight 0.10000E+01 volume 0.53871E-03 ppm1 8.380 ppm2 1.225 CV 1
OR { 710}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 86 and name HG13))
ASSI { 719}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 58 and name HA ))
4.200 2.200 1.800 peak 719 spectrum 1 weight 0.10000E+01 volume 0.49914E-03 ppm1 9.330 ppm2 5.352 CV 1
OR { 719}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 57 and name HA ))
ASSI { 720}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 52 and name HG2%)
5.000 3.200 1.000 peak 720 spectrum 1 weight 0.10000E+01 volume 0.48089E-03 ppm1 8.892 ppm2 0.916 CV 1
OR { 720}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 86 and name HG2%)
ASSI { 722}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HG2 ))
4.800 2.900 1.200 peak 722 spectrum 1 weight 0.10000E+01 volume 0.32870E-03 ppm1 8.555 ppm2 1.532 CV 1
OR { 722}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HG2 ))
OR { 722}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 73 and name HG12))
ASSI { 730}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 42 and name HA ))
3.500 1.600 1.600 peak 730 spectrum 1 weight 0.10000E+01 volume 0.14822E-02 ppm1 7.579 ppm2 3.911 CV 1
OR { 730}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HA1 ))
ASSI { 732}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HA2 ))
3.200 1.300 1.300 peak 732 spectrum 1 weight 0.10000E+01 volume 0.20970E-02 ppm1 8.139 ppm2 3.884 CV 1
OR { 732}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 42 and name HA ))
ASSI { 735}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 73 and name HB ))
4.300 2.300 1.700 peak 735 spectrum 1 weight 0.10000E+01 volume 0.37436E-03 ppm1 7.712 ppm2 1.547 CV 1
OR { 735}
(( segid " " and resid 83 and name HE21))
(( segid " " and resid 84 and name HG12))
ASSI { 741}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB3 ))
3.200 1.300 1.300 peak 741 spectrum 1 weight 0.10000E+01 volume 0.86741E-03 ppm1 7.531 ppm2 1.335 CV 1
OR { 741}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HG3 ))
ASSI { 743}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HG2 ))
4.500 2.500 1.500 peak 743 spectrum 1 weight 0.10000E+01 volume 0.70613E-03 ppm1 7.231 ppm2 0.718 CV 1
OR { 743}
( segid " " and resid 28 and name HD% )
(( segid " " and resid 68 and name HG2 ))
ASSI { 747}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 10 and name HG2 ))
3.000 1.100 1.100 peak 747 spectrum 1 weight 0.10000E+01 volume 0.36827E-02 ppm1 6.892 ppm2 1.644 CV 1
OR { 747}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 56 and name HB3 ))
OR { 747}
( segid " " and resid 9 and name HE% )
(( segid " " and resid 10 and name HG3 ))
ASSI { 750}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HA2 ))
3.700 1.700 1.700 peak 750 spectrum 1 weight 0.10000E+01 volume 0.20118E-02 ppm1 6.986 ppm2 3.924 CV 1
OR { 750}
(( segid " " and resid 9 and name HZ ))
(( segid " " and resid 76 and name HD2 ))
ASSI { 752}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 62 and name HB2 ))
6.000 6.000 0.000 peak 752 spectrum 1 weight 0.10000E+01 volume 0.94049E-05 ppm1 6.649 ppm2 3.121 CV 1
OR { 752}
( segid " " and resid 9 and name HD% )
(( segid " " and resid 7 and name HB3 ))
ASSI { 757}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 58 and name HA ))
4.500 2.600 1.500 peak 757 spectrum 1 weight 0.10000E+01 volume 0.42306E-03 ppm1 6.876 ppm2 5.357 CV 1
OR { 757}
( segid " " and resid 27 and name HD% )
(( segid " " and resid 57 and name HA ))
ASSI { 779}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 38 and name HN ))
4.900 3.000 1.100 peak 779 spectrum 1 weight 0.10000E+01 volume 0.48393E-03 ppm1 8.891 ppm2 7.529 CV 1
OR { 779}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HE3 ))
ASSI { 824}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 9 and name HD% )
3.800 1.800 1.800 peak 824 spectrum 1 weight 0.10000E+01 volume 0.10927E-02 ppm1 7.557 ppm2 6.644 CV 1
OR { 824}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 9 and name HD% )
ASSI { 836}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HN ))
2.800 2.800 3.200 peak 836 spectrum 1 weight 0.10000E+01 volume 0.76088E-02 ppm1 8.541 ppm2 8.376 CV 1
OR { 836}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 87 and name HN ))
ASSI { 837}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HN ))
2.900 1.100 1.100 peak 837 spectrum 1 weight 0.10000E+01 volume 0.20057E-02 ppm1 8.938 ppm2 8.194 CV 1
OR { 837}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 62 and name HE1 ))
ASSI { 847}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 83 and name HE22))
4.300 2.300 1.700 peak 847 spectrum 1 weight 0.10000E+01 volume 0.32262E-03 ppm1 7.950 ppm2 6.660 CV 1
OR { 847}
(( segid " " and resid 62 and name HD2 ))
( segid " " and resid 9 and name HD% )
ASSI { 860}
(( segid " " and resid 62 and name HE1 ))
( segid " " and resid 9 and name HE% )
4.200 2.200 1.800 peak 860 spectrum 1 weight 0.10000E+01 volume 0.55088E-03 ppm1 8.187 ppm2 6.897 CV 1
OR { 860}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 53 and name HN ))
ASSI { 879}
(( segid " " and resid 47 and name HD2 ))
(( segid " " and resid 51 and name HB ))
2.900 2.900 3.100 peak 879 spectrum 1 weight 0.10000E+01 volume 0.52350E-02 ppm1 3.248 ppm2 4.568 CV 1
OR { 879}
(( segid " " and resid 47 and name HD2 ))
(( segid " " and resid 8 and name HA1 ))
ASSI { 886}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 40 and name HA ))
3.400 1.400 1.400 peak 886 spectrum 1 weight 0.10000E+01 volume 0.10409E-02 ppm1 4.204 ppm2 4.342 CV 1
OR { 886}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 14 and name HA ))
ASSI { 902}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 75 and name HA ))
5.200 3.300 0.800 peak 902 spectrum 1 weight 0.10000E+01 volume 0.17714E-03 ppm1 3.102 ppm2 4.832 CV 1
OR { 902}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 75 and name HA ))
ASSI { 919}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 60 and name HA ))
3.400 1.400 1.400 peak 919 spectrum 1 weight 0.10000E+01 volume 0.11779E-02 ppm1 2.937 ppm2 4.242 CV 1
OR { 919}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 22 and name HA ))
ASSI { 920}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 60 and name HA ))
4.200 2.200 1.800 peak 920 spectrum 1 weight 0.10000E+01 volume 0.64220E-03 ppm1 2.537 ppm2 4.245 CV 1
OR { 920}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 22 and name HA ))
ASSI { 929}
(( segid " " and resid 74 and name HD2 ))
(( segid " " and resid 73 and name HA ))
2.100 0.600 0.600 peak 929 spectrum 1 weight 0.10000E+01 volume 0.73047E-02 ppm1 2.398 ppm2 4.063 CV 1
OR { 929}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 66 and name HA1 ))
ASSI { 930}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HA ))
3.000 1.100 1.100 peak 930 spectrum 1 weight 0.10000E+01 volume 0.18840E-02 ppm1 3.168 ppm2 4.050 CV 1
OR { 930}
(( segid " " and resid 38 and name HD2 ))
(( segid " " and resid 35 and name HA ))
ASSI { 940}
(( segid " " and resid 4 and name HD3 ))
(( segid " " and resid 4 and name HD2 ))
1.600 0.300 0.600 peak 940 spectrum 1 weight 0.10000E+01 volume 0.26601E-01 ppm1 3.676 ppm2 3.834 CV 1
OR { 940}
(( segid " " and resid 90 and name HD3 ))
(( segid " " and resid 90 and name HD2 ))
ASSI { 951}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 77 and name HA ))
4.700 2.800 1.300 peak 951 spectrum 1 weight 0.10000E+01 volume 0.60567E-03 ppm1 2.006 ppm2 5.033 CV 1
OR { 951}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 63 and name HA ))
ASSI { 955}
(( segid " " and resid 78 and name HB3 ))
(( segid " " and resid 63 and name HA ))
3.000 3.000 3.000 peak 955 spectrum 1 weight 0.10000E+01 volume 0.34392E-02 ppm1 1.894 ppm2 5.026 CV 1
OR { 955}
(( segid " " and resid 78 and name HB3 ))
(( segid " " and resid 77 and name HA ))
ASSI { 960}
(( segid " " and resid 76 and name HG3 ))
(( segid " " and resid 75 and name HA ))
4.000 2.000 2.000 peak 960 spectrum 1 weight 0.10000E+01 volume 0.18809E-02 ppm1 2.224 ppm2 4.833 CV 1
OR { 960}
(( segid " " and resid 81 and name HB3 ))
(( segid " " and resid 75 and name HA ))
ASSI { 963}
( segid " " and resid 44 and name HB% )
(( segid " " and resid 75 and name HA ))
3.800 1.800 1.800 peak 963 spectrum 1 weight 0.10000E+01 volume 0.66655E-03 ppm1 1.502 ppm2 4.830 CV 1
OR { 963}
(( segid " " and resid 47 and name HG3 ))
(( segid " " and resid 47 and name HA ))
ASSI { 966}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 89 and name HA ))
3.700 1.700 1.700 peak 966 spectrum 1 weight 0.10000E+01 volume 0.13514E-02 ppm1 2.084 ppm2 4.731 CV 1
OR { 966}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HA ))
OR { 966}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name HA ))
ASSI { 971}
(( segid " " and resid 88 and name HG ))
(( segid " " and resid 88 and name HA ))
3.100 1.200 1.200 peak 971 spectrum 1 weight 0.10000E+01 volume 0.23557E-02 ppm1 1.713 ppm2 4.658 CV 1
OR { 971}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 27 and name HA ))
OR { 971}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 81 and name HA ))
ASSI { 977}
(( segid " " and resid 67 and name HG3 ))
(( segid " " and resid 67 and name HA ))
3.600 1.600 1.600 peak 977 spectrum 1 weight 0.10000E+01 volume 0.11596E-02 ppm1 2.076 ppm2 4.605 CV 1
OR { 977}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 48 and name HA ))
ASSI { 978}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 48 and name HB ))
4.100 2.100 1.900 peak 978 spectrum 1 weight 0.10000E+01 volume 0.75784E-03 ppm1 1.991 ppm2 4.606 CV 1
OR { 978}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 48 and name HA ))
ASSI { 985}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 2 and name HA ))
3.900 1.900 1.900 peak 985 spectrum 1 weight 0.10000E+01 volume 0.14214E-02 ppm1 1.977 ppm2 4.507 CV 1
OR { 985}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 21 and name HA ))
OR { 985}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 86 and name HA ))
OR { 985}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 69 and name HA ))
ASSI { 986}
(( segid " " and resid 86 and name HB ))
(( segid " " and resid 86 and name HA ))
2.700 0.900 0.900 peak 986 spectrum 1 weight 0.10000E+01 volume 0.51741E-02 ppm1 1.916 ppm2 4.495 CV 1
OR { 986}
(( segid " " and resid 87 and name HB3 ))
(( segid " " and resid 86 and name HA ))
ASSI { 992}
(( segid " " and resid 90 and name HB3 ))
(( segid " " and resid 90 and name HA ))
2.900 1.000 1.000 peak 992 spectrum 1 weight 0.10000E+01 volume 0.24166E-02 ppm1 1.980 ppm2 4.429 CV 1
OR { 992}
(( segid " " and resid 4 and name HG3 ))
(( segid " " and resid 4 and name HA ))
ASSI { 995}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 63 and name HA ))
3.300 1.400 1.400 peak 995 spectrum 1 weight 0.10000E+01 volume 0.10013E-02 ppm1 0.485 ppm2 5.033 CV 1
OR { 995}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 77 and name HA ))
ASSI { 999}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 59 and name HA ))
4.200 2.200 1.800 peak 999 spectrum 1 weight 0.10000E+01 volume 0.59046E-03 ppm1 1.256 ppm2 4.938 CV 1
OR { 999}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 59 and name HA ))
OR { 999}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 72 and name HA ))
ASSI { 1000}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 72 and name HA ))
4.800 2.900 1.200 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.33784E-03 ppm1 0.887 ppm2 4.933 CV 1
OR { 1000}
( segid " " and resid 84 and name HG2%)
(( segid " " and resid 72 and name HA ))
ASSI { 1004}
( segid " " and resid 80 and name HG1%)
(( segid " " and resid 81 and name HA ))
3.000 1.100 1.100 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.49610E-02 ppm1 0.887 ppm2 4.660 CV 1
OR { 1004}
( segid " " and resid 88 and name HD2%)
(( segid " " and resid 88 and name HA ))
ASSI { 1007}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 48 and name HA ))
3.900 1.900 1.900 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.10835E-02 ppm1 0.631 ppm2 4.610 CV 1
OR { 1007}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 7 and name HA ))
OR { 1007}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 53 and name HA ))
ASSI { 1014}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 86 and name HA ))
2.700 0.900 0.900 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.46262E-02 ppm1 0.912 ppm2 4.496 CV 1
OR { 1014}
( segid " " and resid 21 and name HD2%)
(( segid " " and resid 21 and name HA ))
ASSI { 1018}
(( segid " " and resid 13 and name HB2 ))
(( segid " " and resid 13 and name HA ))
2.600 0.800 0.800 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.54176E-02 ppm1 1.506 ppm2 4.312 CV 1
OR { 1018}
(( segid " " and resid 88 and name HB3 ))
(( segid " " and resid 87 and name HA ))
ASSI { 1024}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 71 and name HA1 ))
3.200 1.300 1.300 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.12661E-02 ppm1 0.830 ppm2 4.295 CV 1
OR { 1024}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HA ))
ASSI { 1027}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 43 and name HB ))
2.100 0.500 0.500 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.19205E-01 ppm1 1.292 ppm2 4.216 CV 1
OR { 1027}
( segid " " and resid 79 and name HG2%)
(( segid " " and resid 79 and name HB ))
OR { 1027}
( segid " " and resid 79 and name HG2%)
(( segid " " and resid 79 and name HA ))
ASSI { 1029}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 17 and name HA ))
2.700 0.900 0.900 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.43523E-02 ppm1 1.472 ppm2 4.203 CV 1
OR { 1029}
(( segid " " and resid 17 and name HG3 ))
(( segid " " and resid 17 and name HA ))
OR { 1029}
(( segid " " and resid 33 and name HG3 ))
(( segid " " and resid 33 and name HA ))
ASSI { 1035}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 49 and name HA ))
3.600 1.600 1.600 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.24622E-02 ppm1 0.920 ppm2 4.136 CV 1
OR { 1035}
( segid " " and resid 30 and name HG2%)
(( segid " " and resid 32 and name HA ))
OR { 1035}
( segid " " and resid 30 and name HG2%)
(( segid " " and resid 41 and name HA ))
ASSI { 1036}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 41 and name HA ))
2.300 0.700 0.700 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.53567E-02 ppm1 0.782 ppm2 4.137 CV 1
OR { 1036}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 49 and name HA ))
ASSI { 1037}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 49 and name HA ))
4.100 2.100 1.900 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.74570E-03 ppm1 0.631 ppm2 4.135 CV 1
OR { 1037}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 41 and name HA ))
ASSI { 1039}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 73 and name HA ))
2.600 0.800 0.800 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.31653E-02 ppm1 1.388 ppm2 4.061 CV 1
OR { 1039}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 35 and name HA ))
ASSI { 1043}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 52 and name HA ))
3.000 1.100 1.100 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.28488E-02 ppm1 1.055 ppm2 4.058 CV 1
OR { 1043}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 9 and name HA ))
ASSI { 1044}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 52 and name HA ))
2.300 0.700 0.700 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.12326E-01 ppm1 0.989 ppm2 4.061 CV 1
OR { 1044}
( segid " " and resid 35 and name HD1%)
(( segid " " and resid 35 and name HA ))
OR { 1044}
( segid " " and resid 52 and name HG1%)
(( segid " " and resid 52 and name HA ))
ASSI { 1047}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HA ))
4.300 2.300 1.700 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.67262E-03 ppm1 0.885 ppm2 4.063 CV 1
OR { 1047}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 73 and name HA ))
OR { 1047}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 52 and name HA ))
ASSI { 1048}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 9 and name HA ))
2.400 0.700 0.700 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.52654E-02 ppm1 0.786 ppm2 4.058 CV 1
OR { 1048}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HA ))
ASSI { 1050}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 62 and name HA ))
3.300 1.400 1.400 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.19996E-02 ppm1 0.485 ppm2 3.960 CV 1
OR { 1050}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 78 and name HD2 ))
ASSI { 1051}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 42 and name HA ))
2.300 0.700 0.700 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.56002E-02 ppm1 1.482 ppm2 3.917 CV 1
OR { 1051}
(( segid " " and resid 78 and name HG3 ))
(( segid " " and resid 64 and name HA ))
OR { 1051}
( segid " " and resid 44 and name HB% )
(( segid " " and resid 76 and name HD2 ))
ASSI { 1052}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 5 and name HA ))
2.400 0.700 0.700 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.76088E-02 ppm1 0.632 ppm2 3.918 CV 1
OR { 1052}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 42 and name HA ))
ASSI { 1061}
(( segid " " and resid 68 and name HG2 ))
(( segid " " and resid 68 and name HA ))
2.900 1.100 1.100 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.51741E-02 ppm1 0.727 ppm2 3.853 CV 1
OR { 1061}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 30 and name HA ))
ASSI { 1065}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 40 and name HA ))
2.200 0.600 0.600 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.89175E-02 ppm1 2.007 ppm2 4.347 CV 1
OR { 1065}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HA ))
ASSI { 1066}
(( segid " " and resid 87 and name HG2 ))
(( segid " " and resid 87 and name HA ))
4.200 2.200 1.800 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.31653E-03 ppm1 2.260 ppm2 4.329 CV 1
OR { 1066}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HA ))
ASSI { 1068}
(( segid " " and resid 56 and name HG ))
(( segid " " and resid 56 and name HA ))
2.300 0.700 0.700 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.73957E-02 ppm1 1.804 ppm2 4.301 CV 1
OR { 1068}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HA ))
OR { 1068}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HA ))
ASSI { 1069}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HA ))
2.500 0.800 0.800 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.89788E-02 ppm1 1.647 ppm2 4.301 CV 1
OR { 1069}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 56 and name HA ))
OR { 1069}
(( segid " " and resid 88 and name HB2 ))
(( segid " " and resid 87 and name HA ))
ASSI { 1073}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 22 and name HA ))
2.400 0.700 0.700 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.89175E-02 ppm1 2.036 ppm2 4.239 CV 1
OR { 1073}
(( segid " " and resid 80 and name HB ))
(( segid " " and resid 80 and name HA ))
ASSI { 1075}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HA ))
2.300 0.700 0.700 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.89478E-02 ppm1 1.669 ppm2 4.205 CV 1
OR { 1075}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name HA ))
OR { 1075}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HA ))
ASSI { 1079}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 36 and name HA ))
2.700 0.900 0.900 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.41089E-02 ppm1 2.340 ppm2 4.142 CV 1
OR { 1079}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 49 and name HA ))
OR { 1079}
(( segid " " and resid 49 and name HG3 ))
(( segid " " and resid 49 and name HA ))
ASSI { 1080}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HA ))
2.400 0.700 0.700 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.92525E-02 ppm1 2.070 ppm2 4.137 CV 1
OR { 1080}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HA ))
ASSI { 1081}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HA ))
2.100 0.600 0.600 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.12996E-01 ppm1 1.736 ppm2 4.132 CV 1
OR { 1081}
(( segid " " and resid 82 and name HB3 ))
(( segid " " and resid 82 and name HA ))
OR { 1081}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 82 and name HA ))
ASSI { 1083}
(( segid " " and resid 30 and name HB ))
(( segid " " and resid 32 and name HA ))
3.000 3.000 3.000 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.40175E-02 ppm1 1.805 ppm2 4.124 CV 1
OR { 1083}
(( segid " " and resid 30 and name HB ))
(( segid " " and resid 49 and name HA ))
OR { 1083}
(( segid " " and resid 30 and name HB ))
(( segid " " and resid 41 and name HA ))
ASSI { 1085}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 73 and name HA ))
2.600 0.800 0.800 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.56002E-02 ppm1 1.540 ppm2 4.065 CV 1
OR { 1085}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 73 and name HA ))
OR { 1085}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 73 and name HA ))
ASSI { 1087}
(( segid " " and resid 10 and name HD3 ))
(( segid " " and resid 9 and name HA ))
2.400 0.700 0.700 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.63611E-02 ppm1 1.837 ppm2 4.052 CV 1
OR { 1087}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 35 and name HA ))
ASSI { 1089}
(( segid " " and resid 35 and name HG ))
(( segid " " and resid 35 and name HA ))
3.000 1.100 1.100 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.34697E-02 ppm1 1.651 ppm2 4.054 CV 1
OR { 1089}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 52 and name HA ))
OR { 1089}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 9 and name HA ))
OR { 1089}
(( segid " " and resid 10 and name HG3 ))
(( segid " " and resid 9 and name HA ))
ASSI { 1099}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 76 and name HD2 ))
2.400 0.700 0.700 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.35610E-02 ppm1 2.348 ppm2 3.928 CV 1
OR { 1099}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 64 and name HA ))
ASSI { 1100}
(( segid " " and resid 81 and name HB3 ))
(( segid " " and resid 76 and name HD2 ))
2.400 0.700 0.700 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.74260E-02 ppm1 2.225 ppm2 3.927 CV 1
OR { 1100}
(( segid " " and resid 76 and name HG3 ))
(( segid " " and resid 76 and name HD2 ))
OR { 1100}
(( segid " " and resid 64 and name HG3 ))
(( segid " " and resid 64 and name HA ))
ASSI { 1101}
(( segid " " and resid 78 and name HB3 ))
(( segid " " and resid 64 and name HA ))
2.600 0.800 0.800 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.43827E-02 ppm1 1.913 ppm2 3.920 CV 1
OR { 1101}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 42 and name HA ))
ASSI { 1103}
(( segid " " and resid 10 and name HG3 ))
(( segid " " and resid 45 and name HA ))
2.900 1.100 1.100 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.46567E-02 ppm1 1.638 ppm2 3.864 CV 1
OR { 1103}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 45 and name HA ))
OR { 1103}
(( segid " " and resid 84 and name HB ))
(( segid " " and resid 83 and name HA ))
ASSI { 1104}
(( segid " " and resid 31 and name HD2 ))
(( segid " " and resid 30 and name HA ))
2.100 0.500 0.500 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.13909E-01 ppm1 2.045 ppm2 3.849 CV 1
OR { 1104}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 90 and name HD2 ))
OR { 1104}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 45 and name HA ))
OR { 1104}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 90 and name HD2 ))
ASSI { 1105}
(( segid " " and resid 31 and name HD3 ))
(( segid " " and resid 30 and name HA ))
2.100 0.500 0.500 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.10805E-01 ppm1 1.834 ppm2 3.852 CV 1
OR { 1105}
(( segid " " and resid 10 and name HD3 ))
(( segid " " and resid 45 and name HA ))
ASSI { 1108}
(( segid " " and resid 30 and name HG13))
(( segid " " and resid 30 and name HA ))
2.800 1.000 1.000 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.30162E-02 ppm1 1.515 ppm2 3.846 CV 1
OR { 1108}
(( segid " " and resid 88 and name HB3 ))
(( segid " " and resid 89 and name HD2 ))
ASSI { 1115}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 8 and name HA2 ))
2.900 1.000 1.000 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.27240E-02 ppm1 1.061 ppm2 3.612 CV 1
OR { 1115}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 8 and name HA2 ))
ASSI { 1120}
(( segid " " and resid 68 and name HG2 ))
(( segid " " and resid 28 and name HB2 ))
4.300 2.300 1.700 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.13392E-02 ppm1 0.721 ppm2 3.489 CV 1
OR { 1120}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 38 and name HA ))
OR { 1120}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 28 and name HB2 ))
ASSI { 1150}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HD2 ))
2.300 0.700 0.700 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.63915E-02 ppm1 2.085 ppm2 3.632 CV 1
OR { 1150}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 89 and name HD3 ))
OR { 1150}
(( segid " " and resid 89 and name HG3 ))
(( segid " " and resid 89 and name HD3 ))
ASSI { 1152}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 12 and name HB2 ))
3.900 1.900 1.900 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.47480E-03 ppm1 2.113 ppm2 3.605 CV 1
OR { 1152}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 8 and name HA2 ))
ASSI { 1162}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HD3 ))
3.000 1.100 1.100 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.32262E-02 ppm1 2.011 ppm2 3.390 CV 1
OR { 1162}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HD2 ))
OR { 1162}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 78 and name HD3 ))
ASSI { 1164}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HD2 ))
2.400 0.700 0.700 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.56306E-02 ppm1 2.047 ppm2 3.327 CV 1
OR { 1164}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 40 and name HD3 ))
OR { 1164}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HD2 ))
ASSI { 1168}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 57 and name HD2 ))
3.000 1.100 1.100 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.17014E-02 ppm1 1.547 ppm2 3.308 CV 1
OR { 1168}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 40 and name HD3 ))
ASSI { 1169}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HD3 ))
2.500 0.800 0.800 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.66958E-02 ppm1 1.891 ppm2 3.231 CV 1
OR { 1169}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HD2 ))
OR { 1169}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HD3 ))
OR { 1169}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HD2 ))
ASSI { 1171}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HD2 ))
2.000 0.500 0.500 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.21944E-01 ppm1 1.630 ppm2 3.230 CV 1
OR { 1171}
(( segid " " and resid 29 and name HG3 ))
(( segid " " and resid 29 and name HD2 ))
OR { 1171}
(( segid " " and resid 29 and name HG3 ))
(( segid " " and resid 29 and name HD3 ))
OR { 1171}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HD3 ))
ASSI { 1173}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HD2 ))
2.800 1.000 1.000 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.39262E-02 ppm1 1.830 ppm2 3.188 CV 1
OR { 1173}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HD2 ))
OR { 1173}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HD3 ))
ASSI { 1177}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 74 and name HA ))
2.300 0.600 0.600 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.71826E-02 ppm1 1.238 ppm2 3.106 CV 1
OR { 1177}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 62 and name HB2 ))
OR { 1177}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HA ))
OR { 1177}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 74 and name HA ))
ASSI { 1180}
(( segid " " and resid 82 and name HD2 ))
(( segid " " and resid 82 and name HE3 ))
2.200 0.600 0.600 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.11291E-01 ppm1 1.660 ppm2 3.003 CV 1
OR { 1180}
(( segid " " and resid 85 and name HD2 ))
(( segid " " and resid 85 and name HE2 ))
OR { 1180}
(( segid " " and resid 82 and name HD2 ))
(( segid " " and resid 82 and name HE2 ))
OR { 1180}
(( segid " " and resid 82 and name HD3 ))
(( segid " " and resid 82 and name HE3 ))
OR { 1180}
(( segid " " and resid 85 and name HD3 ))
(( segid " " and resid 85 and name HE2 ))
ASSI { 1181}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 38 and name HD3 ))
3.000 1.100 1.100 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.20118E-02 ppm1 1.527 ppm2 2.998 CV 1
OR { 1181}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HE2 ))
OR { 1181}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HE3 ))
ASSI { 1184}
(( segid " " and resid 25 and name HG3 ))
(( segid " " and resid 25 and name HD3 ))
2.600 0.800 0.800 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.56915E-02 ppm1 1.336 ppm2 2.988 CV 1
OR { 1184}
(( segid " " and resid 38 and name HG3 ))
(( segid " " and resid 38 and name HD3 ))
ASSI { 1190}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 62 and name HB2 ))
2.900 1.100 1.100 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.34088E-02 ppm1 2.535 ppm2 3.123 CV 1
OR { 1190}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 25 and name HD2 ))
OR { 1190}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 25 and name HD2 ))
ASSI { 1201}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 81 and name HB3 ))
3.300 1.400 1.400 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.22309E-02 ppm1 0.965 ppm2 2.223 CV 1
OR { 1201}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 76 and name HG3 ))
OR { 1201}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 34 and name HB3 ))
ASSI { 1202}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 81 and name HB3 ))
3.300 1.400 1.400 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.28640E-02 ppm1 0.485 ppm2 2.229 CV 1
OR { 1202}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 76 and name HG3 ))
ASSI { 1203}
( segid " " and resid 52 and name HG1%)
(( segid " " and resid 52 and name HB ))
2.400 0.700 0.700 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.58133E-02 ppm1 0.982 ppm2 2.125 CV 1
OR { 1203}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 39 and name HB3 ))
ASSI { 1209}
( segid " " and resid 30 and name HG2%)
(( segid " " and resid 31 and name HD2 ))
2.800 0.900 0.900 peak 1209 spectrum 1 weight 0.10000E+01 volume 0.39262E-02 ppm1 0.927 ppm2 2.044 CV 1
OR { 1209}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 45 and name HB ))
ASSI { 1210}
( segid " " and resid 80 and name HG1%)
(( segid " " and resid 80 and name HB ))
2.100 0.600 0.600 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.11140E-01 ppm1 0.879 ppm2 2.043 CV 1
OR { 1210}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 40 and name HB3 ))
OR { 1210}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name HB ))
ASSI { 1215}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 83 and name HB3 ))
3.700 1.700 1.700 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.25535E-02 ppm1 0.485 ppm2 2.008 CV 1
OR { 1215}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 78 and name HB2 ))
ASSI { 1218}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name HG12))
2.100 0.500 0.500 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.11353E-01 ppm1 0.866 ppm2 1.919 CV 1
OR { 1218}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 86 and name HB ))
OR { 1218}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 47 and name HB2 ))
ASSI { 1219}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 45 and name HG12))
2.000 0.500 0.500 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.15857E-01 ppm1 0.780 ppm2 1.923 CV 1
OR { 1219}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 49 and name HB3 ))
ASSI { 1220}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 57 and name HB2 ))
2.500 0.800 0.800 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.82176E-02 ppm1 0.634 ppm2 1.927 CV 1
OR { 1220}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 47 and name HB2 ))
OR { 1220}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 45 and name HG12))
ASSI { 1224}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 42 and name HG ))
2.400 0.700 0.700 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.55393E-02 ppm1 0.772 ppm2 1.851 CV 1
OR { 1224}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 10 and name HD3 ))
ASSI { 1228}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 56 and name HG ))
2.000 0.500 0.500 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.20118E-01 ppm1 0.993 ppm2 1.808 CV 1
OR { 1228}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 30 and name HB ))
OR { 1228}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 56 and name HB2 ))
ASSI { 1229}
( segid " " and resid 30 and name HG2%)
(( segid " " and resid 30 and name HB ))
2.200 0.600 0.600 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.11657E-01 ppm1 0.932 ppm2 1.815 CV 1
OR { 1229}
( segid " " and resid 30 and name HG2%)
(( segid " " and resid 38 and name HB2 ))
ASSI { 1245}
(( segid " " and resid 13 and name HD3 ))
(( segid " " and resid 77 and name HB3 ))
3.200 3.200 2.800 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.13392E-02 ppm1 1.440 ppm2 2.511 CV 1
OR { 1245}
(( segid " " and resid 13 and name HD2 ))
(( segid " " and resid 77 and name HB3 ))
OR { 1245}
(( segid " " and resid 13 and name HD2 ))
(( segid " " and resid 76 and name HB2 ))
OR { 1245}
(( segid " " and resid 13 and name HD3 ))
(( segid " " and resid 76 and name HB2 ))
ASSI { 1251}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 74 and name HD2 ))
2.200 0.600 0.600 peak 1251 spectrum 1 weight 0.10000E+01 volume 0.51436E-02 ppm1 1.530 ppm2 2.402 CV 1
OR { 1251}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 74 and name HD2 ))
ASSI { 1255}
(( segid " " and resid 64 and name HG3 ))
(( segid " " and resid 64 and name HG2 ))
1.600 0.300 0.600 peak 1255 spectrum 1 weight 0.10000E+01 volume 0.27118E-01 ppm1 2.229 ppm2 2.349 CV 1
OR { 1255}
(( segid " " and resid 76 and name HG3 ))
(( segid " " and resid 76 and name HG2 ))
ASSI { 1256}
(( segid " " and resid 39 and name HB3 ))
(( segid " " and resid 39 and name HB2 ))
1.700 0.300 0.500 peak 1256 spectrum 1 weight 0.10000E+01 volume 0.25475E-01 ppm1 2.141 ppm2 2.339 CV 1
OR { 1256}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HG2 ))
OR { 1256}
(( segid " " and resid 64 and name HB3 ))
(( segid " " and resid 64 and name HG2 ))
ASSI { 1259}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 70 and name HG3 ))
2.000 0.500 0.500 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.25444E-01 ppm1 1.972 ppm2 2.276 CV 1
OR { 1259}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HG2 ))
OR { 1259}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 87 and name HG2 ))
OR { 1259}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HG3 ))
OR { 1259}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 70 and name HG2 ))
ASSI { 1262}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 55 and name HB2 ))
1.600 0.300 0.600 peak 1262 spectrum 1 weight 0.10000E+01 volume 0.31653E-01 ppm1 2.076 ppm2 2.212 CV 1
OR { 1262}
(( segid " " and resid 34 and name HG2 ))
(( segid " " and resid 34 and name HB3 ))
ASSI { 1268}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HB2 ))
1.600 0.300 0.600 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.31349E-01 ppm1 1.760 ppm2 2.078 CV 1
OR { 1268}
(( segid " " and resid 34 and name HG3 ))
(( segid " " and resid 34 and name HG2 ))
ASSI { 1271}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 42 and name HB2 ))
1.700 0.400 0.500 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.18322E-01 ppm1 1.479 ppm2 1.993 CV 1
OR { 1271}
(( segid " " and resid 78 and name HG3 ))
(( segid " " and resid 78 and name HB2 ))
ASSI { 1272}
(( segid " " and resid 45 and name HG13))
(( segid " " and resid 45 and name HG12))
1.700 0.300 0.500 peak 1272 spectrum 1 weight 0.10000E+01 volume 0.14487E-01 ppm1 1.213 ppm2 1.922 CV 1
OR { 1272}
(( segid " " and resid 86 and name HG13))
(( segid " " and resid 86 and name HB ))
ASSI { 1273}
(( segid " " and resid 37 and name HB3 ))
(( segid " " and resid 37 and name HB2 ))
1.400 0.200 0.800 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.38958E-01 ppm1 1.356 ppm2 1.917 CV 1
OR { 1273}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 47 and name HB2 ))
ASSI { 1274}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 37 and name HB2 ))
2.400 0.700 0.700 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.42002E-02 ppm1 1.144 ppm2 1.916 CV 1
OR { 1274}
( segid " " and resid 37 and name HD1%)
(( segid " " and resid 86 and name HB ))
ASSI { 1275}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HB2 ))
1.500 0.300 0.700 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.38349E-01 ppm1 1.634 ppm2 1.894 CV 1
OR { 1275}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HB2 ))
OR { 1275}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB2 ))
ASSI { 1276}
(( segid " " and resid 78 and name HG3 ))
(( segid " " and resid 78 and name HB3 ))
1.700 0.400 0.500 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.36219E-01 ppm1 1.505 ppm2 1.894 CV 1
OR { 1276}
(( segid " " and resid 36 and name HG12))
(( segid " " and resid 36 and name HB ))
OR { 1276}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HB2 ))
ASSI { 1277}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HB2 ))
2.400 0.700 0.700 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.98614E-02 ppm1 1.250 ppm2 1.883 CV 1
OR { 1277}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 58 and name HG12))
OR { 1277}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 62 and name HB3 ))
ASSI { 1278}
(( segid " " and resid 33 and name HG3 ))
(( segid " " and resid 33 and name HB2 ))
2.200 0.600 0.600 peak 1278 spectrum 1 weight 0.10000E+01 volume 0.15249E-01 ppm1 1.471 ppm2 1.843 CV 1
OR { 1278}
(( segid " " and resid 33 and name HG2 ))
(( segid " " and resid 33 and name HB2 ))
OR { 1278}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 42 and name HG ))
ASSI { 1279}
(( segid " " and resid 38 and name HG3 ))
(( segid " " and resid 38 and name HB2 ))
1.900 0.400 0.400 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.16252E-01 ppm1 1.332 ppm2 1.832 CV 1
OR { 1279}
(( segid " " and resid 38 and name HG3 ))
(( segid " " and resid 30 and name HB ))
ASSI { 1280}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 56 and name HB2 ))
1.500 0.300 0.700 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.45349E-01 ppm1 1.655 ppm2 1.815 CV 1
OR { 1280}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name HB2 ))
OR { 1280}
(( segid " " and resid 19 and name HG2 ))
(( segid " " and resid 19 and name HB3 ))
ASSI { 1282}
( segid " " and resid 79 and name HG2%)
(( segid " " and resid 78 and name HG2 ))
3.000 1.100 1.100 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.39566E-02 ppm1 1.303 ppm2 1.731 CV 1
OR { 1282}
(( segid " " and resid 36 and name HG13))
(( segid " " and resid 35 and name HB2 ))
OR { 1282}
(( segid " " and resid 36 and name HG13))
(( segid " " and resid 35 and name HB3 ))
ASSI { 1285}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 58 and name HG13))
2.100 0.600 0.600 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.11840E-01 ppm1 1.253 ppm2 1.662 CV 1
OR { 1285}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HD3 ))
OR { 1285}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HD2 ))
ASSI { 1286}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 58 and name HG13))
2.700 0.900 0.900 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.35306E-02 ppm1 1.058 ppm2 1.663 CV 1
OR { 1286}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 56 and name HB3 ))
ASSI { 1287}
(( segid " " and resid 88 and name HB3 ))
(( segid " " and resid 88 and name HB2 ))
1.300 0.200 0.900 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.97697E-01 ppm1 1.521 ppm2 1.646 CV 1
OR { 1287}
(( segid " " and resid 30 and name HG13))
(( segid " " and resid 30 and name HG12))
OR { 1287}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HD3 ))
OR { 1287}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HB3 ))
ASSI { 1288}
(( segid " " and resid 86 and name HG13))
(( segid " " and resid 84 and name HB ))
2.200 2.200 3.800 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.84610E-02 ppm1 1.200 ppm2 1.638 CV 1
OR { 1288}
(( segid " " and resid 86 and name HG13))
(( segid " " and resid 85 and name HB3 ))
OR { 1288}
(( segid " " and resid 45 and name HG13))
(( segid " " and resid 30 and name HG12))
OR { 1288}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 30 and name HG12))
OR { 1288}
(( segid " " and resid 86 and name HG13))
(( segid " " and resid 88 and name HB2 ))
OR { 1288}
(( segid " " and resid 86 and name HG13))
(( segid " " and resid 85 and name HD2 ))
ASSI { 1291}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 30 and name HG12))
1.700 0.400 0.500 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.53263E-01 ppm1 1.014 ppm2 1.664 CV 1
OR { 1291}
( segid " " and resid 35 and name HD1%)
(( segid " " and resid 35 and name HG ))
ASSI { 1292}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 30 and name HG12))
1.500 0.300 0.700 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.95566E-01 ppm1 0.993 ppm2 1.665 CV 1
OR { 1292}
( segid " " and resid 35 and name HD1%)
(( segid " " and resid 35 and name HG ))
OR { 1292}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 56 and name HB3 ))
ASSI { 1294}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 10 and name HG3 ))
3.900 1.900 1.900 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.37132E-03 ppm1 0.787 ppm2 1.644 CV 1
OR { 1294}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 10 and name HG2 ))
OR { 1294}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 56 and name HB3 ))
OR { 1294}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 30 and name HG12))
OR { 1294}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 30 and name HG12))
OR { 1294}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 85 and name HB3 ))
ASSI { 1296}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 74 and name HG2 ))
1.700 0.400 0.500 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.25535E-01 ppm1 0.884 ppm2 1.538 CV 1
OR { 1296}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HG12))
OR { 1296}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HB ))
OR { 1296}
( segid " " and resid 88 and name HD2%)
(( segid " " and resid 88 and name HB3 ))
OR { 1296}
( segid " " and resid 84 and name HG2%)
(( segid " " and resid 84 and name HG12))
ASSI { 1297}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HG12))
1.900 0.400 0.400 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.27362E-01 ppm1 0.827 ppm2 1.548 CV 1
OR { 1297}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 73 and name HB ))
ASSI { 1298}
( segid " " and resid 88 and name HD1%)
(( segid " " and resid 88 and name HB3 ))
2.700 0.900 0.900 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.11078E-01 ppm1 0.921 ppm2 1.518 CV 1
OR { 1298}
( segid " " and resid 30 and name HG2%)
(( segid " " and resid 30 and name HG13))
OR { 1298}
( segid " " and resid 30 and name HG2%)
(( segid " " and resid 38 and name HG2 ))
ASSI { 1299}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 44 and name HB% )
2.000 0.500 0.500 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.18657E-01 ppm1 0.785 ppm2 1.505 CV 1
OR { 1299}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 44 and name HB% )
OR { 1299}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 47 and name HG3 ))
ASSI { 1302}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 78 and name HG3 ))
2.900 1.000 1.000 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.25140E-02 ppm1 0.485 ppm2 1.497 CV 1
OR { 1302}
( segid " " and resid 75 and name HG2%)
( segid " " and resid 44 and name HB% )
ASSI { 1304}
(( segid " " and resid 86 and name HG13))
(( segid " " and resid 86 and name HG12))
1.500 0.300 0.700 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.23892E-01 ppm1 1.215 ppm2 1.411 CV 1
OR { 1304}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 74 and name HD3 ))
ASSI { 1305}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 86 and name HG12))
2.400 0.700 0.700 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.52654E-02 ppm1 0.887 ppm2 1.404 CV 1
OR { 1305}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 74 and name HD3 ))
ASSI { 1316}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HG13))
2.200 0.600 0.600 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.65133E-02 ppm1 0.876 ppm2 1.233 CV 1
OR { 1316}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 74 and name HB3 ))
OR { 1316}
(( segid " " and resid 74 and name HG3 ))
(( segid " " and resid 74 and name HB2 ))
OR { 1316}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 86 and name HG13))
ASSI { 1317}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 73 and name HG13))
2.900 1.000 1.000 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.58741E-02 ppm1 0.788 ppm2 1.237 CV 1
OR { 1317}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HB2 ))
OR { 1317}
( segid " " and resid 73 and name HG2%)
(( segid " " and resid 74 and name HB3 ))
ASSI { 1320}
( segid " " and resid 42 and name HD2%)
( segid " " and resid 48 and name HG2%)
4.100 2.100 1.900 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.90395E-03 ppm1 0.637 ppm2 1.175 CV 1
OR { 1320}
( segid " " and resid 42 and name HD2%)
( segid " " and resid 51 and name HG2%)
ASSI { 1329}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 45 and name HD1%)
1.800 0.400 0.400 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.64220E-01 ppm1 0.792 ppm2 0.880 CV 1
OR { 1329}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 73 and name HD1%)
OR { 1329}
( segid " " and resid 73 and name HG2%)
( segid " " and resid 84 and name HG2%)
ASSI { 1334}
(( segid " " and resid 76 and name HG3 ))
(( segid " " and resid 76 and name HD3 ))
2.400 0.700 0.700 peak 1334 spectrum 1 weight 0.10000E+01 volume 0.55393E-02 ppm1 2.223 ppm2 3.714 CV 1
OR { 1334}
(( segid " " and resid 81 and name HB3 ))
(( segid " " and resid 76 and name HD3 ))
ASSI { 1336}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HD3 ))
3.300 1.400 1.400 peak 1336 spectrum 1 weight 0.10000E+01 volume 0.14122E-02 ppm1 2.398 ppm2 3.610 CV 1
OR { 1336}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 12 and name HB2 ))
ASSI { 1338}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 62 and name HA ))
4.100 2.100 1.900 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.63002E-03 ppm1 7.955 ppm2 3.969 CV 1
OR { 1338}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HA ))
ASSI { 1353}
(( segid " " and resid 78 and name HG3 ))
(( segid " " and resid 62 and name HA ))
3.000 1.100 1.100 peak 1353 spectrum 1 weight 0.10000E+01 volume 0.30740E-02 ppm1 1.486 ppm2 3.976 CV 1
OR { 1353}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 39 and name HA ))
ASSI { 1354}
(( segid " " and resid 74 and name HG2 ))
(( segid " " and resid 41 and name HA ))
2.900 1.000 1.000 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.31045E-02 ppm1 1.543 ppm2 4.134 CV 1
OR { 1354}
(( segid " " and resid 73 and name HG12))
(( segid " " and resid 41 and name HA ))
OR { 1354}
(( segid " " and resid 73 and name HB ))
(( segid " " and resid 41 and name HA ))
ASSI { 1368}
( segid " " and resid 35 and name HD1%)
(( segid " " and resid 39 and name HG2 ))
4.100 2.100 1.900 peak 1368 spectrum 1 weight 0.10000E+01 volume 0.61784E-03 ppm1 1.005 ppm2 2.589 CV 1
OR { 1368}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 27 and name HB3 ))
OR { 1368}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 39 and name HG2 ))
ASSI { 1370}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 74 and name HD2 ))
3.600 1.600 1.600 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.20544E-02 ppm1 1.252 ppm2 2.400 CV 1
OR { 1370}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 74 and name HD2 ))
ASSI { 1371}
(( segid " " and resid 45 and name HG13))
(( segid " " and resid 74 and name HD2 ))
3.300 3.300 2.700 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.29340E-02 ppm1 1.190 ppm2 2.392 CV 1
OR { 1371}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 74 and name HD2 ))
ASSI { 1375}
(( segid " " and resid 78 and name HG3 ))
(( segid " " and resid 78 and name HG2 ))
1.800 0.400 0.400 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.18535E-01 ppm1 1.484 ppm2 1.720 CV 1
OR { 1375}
(( segid " " and resid 82 and name HG2 ))
(( segid " " and resid 82 and name HB2 ))
OR { 1375}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HD2 ))
OR { 1375}
(( segid " " and resid 82 and name HG2 ))
(( segid " " and resid 82 and name HB3 ))
ASSI { 1377}
(( segid " " and resid 73 and name HG13))
(( segid " " and resid 72 and name HA ))
6.000 6.000 0.000 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.49001E-06 ppm1 1.229 ppm2 4.928 CV 1
OR { 1377}
(( segid " " and resid 86 and name HG13))
(( segid " " and resid 72 and name HA ))
ASSI { 1382}
(( segid " " and resid 47 and name HG2 ))
(( segid " " and resid 47 and name HD3 ))
2.400 0.700 0.700 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.72130E-02 ppm1 1.580 ppm2 2.985 CV 1
OR { 1382}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HD3 ))
ASSI { 1385}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB3 ))
2.900 1.100 1.100 peak 1385 spectrum 1 weight 0.10000E+01 volume 0.19783E-02 ppm1 5.347 ppm2 1.694 CV 1
OR { 1385}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HG13))
ASSI { 1389}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HB ))
3.600 1.700 1.700 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.68482E-03 ppm1 5.352 ppm2 2.484 CV 1
OR { 1389}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 58 and name HB ))
ASSI { 1391}
(( segid " " and resid 27 and name HZ ))
(( segid " " and resid 5 and name HB ))
3.400 1.400 1.400 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.10105E-02 ppm1 7.174 ppm2 3.397 CV 1
OR { 1391}
(( segid " " and resid 27 and name HZ ))
(( segid " " and resid 7 and name HB2 ))
ASSI { 4}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 30 and name HD1%)
3.000 1.100 1.100 peak 4 spectrum 1 weight 0.10000E+01 volume 0.54539E-02 ppm1 4.297 ppm2 1.028 CV 1
OR { 4}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 58 and name HD1%)
ASSI { 9}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 85 and name HB3 ))
3.300 1.300 1.300 peak 9 spectrum 1 weight 0.10000E+01 volume 0.17690E-02 ppm1 4.931 ppm2 1.633 CV 1
OR { 9}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 84 and name HB ))
ASSI { 23}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB3 ))
1.900 0.500 0.500 peak 23 spectrum 1 weight 0.10000E+01 volume 0.29562E-01 ppm1 4.566 ppm2 1.756 CV 1
OR { 23}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HG2 ))
ASSI { 28}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HG2 ))
3.300 1.400 1.400 peak 28 spectrum 1 weight 0.10000E+01 volume 0.24155E-02 ppm1 5.045 ppm2 1.532 CV 1
OR { 28}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 73 and name HB ))
ASSI { 29}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HG3 ))
3.500 1.500 1.500 peak 29 spectrum 1 weight 0.10000E+01 volume 0.16397E-02 ppm1 5.054 ppm2 1.253 CV 1
OR { 29}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 73 and name HG13))
ASSI { 30}
(( segid " " and resid 85 and name HA ))
( segid " " and resid 73 and name HD1%)
2.900 1.000 1.000 peak 30 spectrum 1 weight 0.10000E+01 volume 0.21980E-02 ppm1 5.049 ppm2 0.898 CV 1
OR { 30}
(( segid " " and resid 85 and name HA ))
( segid " " and resid 84 and name HG2%)
ASSI { 81}
(( segid " " and resid 4 and name HD3 ))
(( segid " " and resid 3 and name HB2 ))
2.900 1.100 1.100 peak 81 spectrum 1 weight 0.10000E+01 volume 0.15868E-01 ppm1 3.677 ppm2 2.027 CV 1
OR { 81}
(( segid " " and resid 34 and name HD2 ))
(( segid " " and resid 31 and name HB2 ))
ASSI { 84}
(( segid " " and resid 76 and name HD2 ))
(( segid " " and resid 81 and name HB3 ))
2.200 0.600 0.600 peak 84 spectrum 1 weight 0.10000E+01 volume 0.86978E-02 ppm1 3.916 ppm2 2.227 CV 1
OR { 84}
(( segid " " and resid 76 and name HD2 ))
(( segid " " and resid 76 and name HG3 ))
ASSI { 87}
(( segid " " and resid 90 and name HD2 ))
(( segid " " and resid 89 and name HB2 ))
3.100 1.200 1.200 peak 87 spectrum 1 weight 0.10000E+01 volume 0.23802E-02 ppm1 3.823 ppm2 2.384 CV 1
OR { 87}
(( segid " " and resid 89 and name HD2 ))
(( segid " " and resid 89 and name HB2 ))
ASSI { 106}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HG12))
2.700 0.900 0.900 peak 106 spectrum 1 weight 0.10000E+01 volume 0.62296E-02 ppm1 4.133 ppm2 1.504 CV 1
OR { 106}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 44 and name HB% )
ASSI { 111}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 56 and name HD2%)
2.500 0.800 0.800 peak 111 spectrum 1 weight 0.10000E+01 volume 0.90507E-02 ppm1 4.057 ppm2 0.976 CV 1
OR { 111}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 52 and name HG1%)
OR { 111}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HG2 ))
ASSI { 121}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 9 and name HB2 ))
3.300 1.300 1.300 peak 121 spectrum 1 weight 0.10000E+01 volume 0.23743E-02 ppm1 4.376 ppm2 3.166 CV 1
OR { 121}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 164}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 42 and name HD1%)
4.300 2.300 1.700 peak 164 spectrum 1 weight 0.10000E+01 volume 0.12165E-02 ppm1 3.913 ppm2 0.781 CV 1
OR { 164}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 45 and name HG2%)
ASSI { 187}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 17 and name HB3 ))
3.200 1.300 1.300 peak 187 spectrum 1 weight 0.10000E+01 volume 0.23743E-02 ppm1 4.591 ppm2 1.659 CV 1
OR { 187}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 17 and name HB2 ))
OR { 187}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 19 and name HG2 ))
ASSI { 203}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 73 and name HG13))
2.700 0.900 0.900 peak 203 spectrum 1 weight 0.10000E+01 volume 0.20394E-02 ppm1 4.053 ppm2 1.233 CV 1
OR { 203}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 74 and name HB3 ))
ASSI { 223}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 43 and name HG2%)
2.000 0.500 0.500 peak 223 spectrum 1 weight 0.10000E+01 volume 0.20981E-01 ppm1 4.207 ppm2 1.294 CV 1
OR { 223}
(( segid " " and resid 79 and name HB ))
( segid " " and resid 79 and name HG2%)
ASSI { 235}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 58 and name HG12))
3.400 1.400 1.400 peak 235 spectrum 1 weight 0.10000E+01 volume 0.28386E-02 ppm1 1.259 ppm2 1.880 CV 1
OR { 235}
( segid " " and resid 58 and name HG2%)
(( segid " " and resid 62 and name HB3 ))
ASSI { 239}
( segid " " and resid 58 and name HG2%)
( segid " " and resid 45 and name HG2%)
5.800 4.200 0.200 peak 239 spectrum 1 weight 0.10000E+01 volume 0.91094E-04 ppm1 1.264 ppm2 0.790 CV 1
OR { 239}
( segid " " and resid 58 and name HG2%)
( segid " " and resid 73 and name HG2%)
ASSI { 248}
( segid " " and resid 30 and name HG2%)
(( segid " " and resid 38 and name HG3 ))
2.500 0.800 0.800 peak 248 spectrum 1 weight 0.10000E+01 volume 0.38083E-02 ppm1 0.967 ppm2 1.308 CV 1
OR { 248}
( segid " " and resid 36 and name HG2%)
(( segid " " and resid 36 and name HG13))
ASSI { 267}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 58 and name HG13))
2.800 1.000 1.000 peak 267 spectrum 1 weight 0.10000E+01 volume 0.34909E-02 ppm1 0.793 ppm2 1.660 CV 1
OR { 267}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 10 and name HG3 ))
OR { 267}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 56 and name HB3 ))
ASSI { 269}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 74 and name HG3 ))
3.200 1.300 1.300 peak 269 spectrum 1 weight 0.10000E+01 volume 0.35380E-02 ppm1 0.786 ppm2 0.910 CV 1
OR { 269}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 52 and name HG2%)
ASSI { 273}
( segid " " and resid 30 and name HD1%)
(( segid " " and resid 41 and name HE3 ))
3.500 1.600 1.600 peak 273 spectrum 1 weight 0.10000E+01 volume 0.20394E-02 ppm1 1.015 ppm2 7.538 CV 1
OR { 273}
( segid " " and resid 36 and name HD1%)
(( segid " " and resid 38 and name HN ))
ASSI { 282}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 9 and name HB3 ))
4.000 2.000 2.000 peak 282 spectrum 1 weight 0.10000E+01 volume 0.23038E-02 ppm1 1.046 ppm2 2.412 CV 1
OR { 282}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 74 and name HD2 ))
ASSI { 296}
(( segid " " and resid 71 and name HA1 ))
( segid " " and resid 88 and name HD2%)
3.500 1.500 1.500 peak 296 spectrum 1 weight 0.10000E+01 volume 0.16280E-02 ppm1 4.307 ppm2 0.904 CV 1
OR { 296}
(( segid " " and resid 71 and name HA1 ))
( segid " " and resid 88 and name HD1%)
OR { 296}
(( segid " " and resid 71 and name HA1 ))
( segid " " and resid 84 and name HG2%)
ASSI { 308}
(( segid " " and resid 19 and name HD2 ))
(( segid " " and resid 19 and name HB3 ))
2.900 1.000 1.000 peak 308 spectrum 1 weight 0.10000E+01 volume 0.51953E-02 ppm1 3.221 ppm2 1.796 CV 1
OR { 308}
(( segid " " and resid 19 and name HD3 ))
(( segid " " and resid 19 and name HB3 ))
OR { 308}
(( segid " " and resid 47 and name HD2 ))
(( segid " " and resid 56 and name HG ))
ASSI { 310}
(( segid " " and resid 38 and name HD2 ))
(( segid " " and resid 38 and name HB3 ))
2.200 0.600 0.600 peak 310 spectrum 1 weight 0.10000E+01 volume 0.16456E-01 ppm1 3.201 ppm2 1.364 CV 1
OR { 310}
(( segid " " and resid 47 and name HD2 ))
(( segid " " and resid 47 and name HB3 ))
ASSI { 311}
(( segid " " and resid 47 and name HD3 ))
( segid " " and resid 56 and name HD2%)
2.700 0.900 0.900 peak 311 spectrum 1 weight 0.10000E+01 volume 0.79340E-02 ppm1 2.977 ppm2 0.976 CV 1
OR { 311}
(( segid " " and resid 47 and name HD3 ))
( segid " " and resid 52 and name HG1%)
ASSI { 318}
(( segid " " and resid 47 and name HD3 ))
(( segid " " and resid 47 and name HG3 ))
2.500 0.800 0.800 peak 318 spectrum 1 weight 0.10000E+01 volume 0.64059E-02 ppm1 2.971 ppm2 1.513 CV 1
OR { 318}
(( segid " " and resid 38 and name HD3 ))
(( segid " " and resid 38 and name HG2 ))
ASSI { 320}
(( segid " " and resid 85 and name HE2 ))
(( segid " " and resid 85 and name HG2 ))
2.400 0.700 0.700 peak 320 spectrum 1 weight 0.10000E+01 volume 0.84043E-02 ppm1 2.993 ppm2 1.524 CV 1
OR { 320}
(( segid " " and resid 69 and name HE3 ))
(( segid " " and resid 69 and name HG2 ))
ASSI { 322}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 77 and name HA ))
2.800 1.000 1.000 peak 322 spectrum 1 weight 0.10000E+01 volume 0.36555E-02 ppm1 2.914 ppm2 5.043 CV 1
OR { 322}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HA ))
ASSI { 330}
(( segid " " and resid 40 and name HD2 ))
(( segid " " and resid 43 and name HB ))
3.600 1.600 1.600 peak 330 spectrum 1 weight 0.10000E+01 volume 0.14105E-02 ppm1 3.324 ppm2 4.199 CV 1
OR { 330}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 43 and name HB ))
OR { 330}
(( segid " " and resid 40 and name HD3 ))
(( segid " " and resid 37 and name HA ))
OR { 330}
(( segid " " and resid 40 and name HD2 ))
(( segid " " and resid 37 and name HA ))
ASSI { 333}
(( segid " " and resid 40 and name HD3 ))
( segid " " and resid 73 and name HD1%)
2.900 1.000 1.000 peak 333 spectrum 1 weight 0.10000E+01 volume 0.32911E-02 ppm1 3.324 ppm2 0.886 CV 1
OR { 333}
(( segid " " and resid 40 and name HD2 ))
( segid " " and resid 73 and name HD1%)
OR { 333}
(( segid " " and resid 40 and name HD2 ))
( segid " " and resid 84 and name HG2%)
ASSI { 410}
(( segid " " and resid 84 and name HB ))
( segid " " and resid 84 and name HG2%)
2.100 0.600 0.600 peak 410 spectrum 1 weight 0.10000E+01 volume 0.11166E-01 ppm1 1.630 ppm2 0.882 CV 1
OR { 410}
(( segid " " and resid 84 and name HB ))
( segid " " and resid 73 and name HD1%)
ASSI { 419}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 45 and name HG12))
2.600 0.800 0.800 peak 419 spectrum 1 weight 0.10000E+01 volume 0.40493E-02 ppm1 2.050 ppm2 1.922 CV 1
OR { 419}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 47 and name HB2 ))
ASSI { 459}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 39 and name HA ))
2.900 1.000 1.000 peak 459 spectrum 1 weight 0.10000E+01 volume 0.33029E-02 ppm1 2.446 ppm2 3.994 CV 1
OR { 459}
(( segid " " and resid 55 and name HG3 ))
(( segid " " and resid 54 and name HB3 ))
ASSI { 460}
(( segid " " and resid 83 and name HG2 ))
(( segid " " and resid 83 and name HG3 ))
1.400 0.200 0.800 peak 460 spectrum 1 weight 0.10000E+01 volume 0.73462E-01 ppm1 2.471 ppm2 2.134 CV 1
OR { 460}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 39 and name HB3 ))
ASSI { 464}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 37 and name HD2%)
2.200 0.600 0.600 peak 464 spectrum 1 weight 0.10000E+01 volume 0.59358E-02 ppm1 2.014 ppm2 1.002 CV 1
OR { 464}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HG2 ))
ASSI { 516}
(( segid " " and resid 36 and name HG12))
(( segid " " and resid 36 and name HG13))
1.700 0.300 0.500 peak 516 spectrum 1 weight 0.10000E+01 volume 0.17337E-01 ppm1 1.488 ppm2 1.308 CV 1
OR { 516}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 38 and name HG3 ))
ASSI { 520}
(( segid " " and resid 68 and name HD2 ))
(( segid " " and resid 31 and name HG3 ))
2.300 0.600 0.600 peak 520 spectrum 1 weight 0.10000E+01 volume 0.35674E-02 ppm1 1.374 ppm2 0.723 CV 1
OR { 520}
(( segid " " and resid 68 and name HD2 ))
(( segid " " and resid 68 and name HG2 ))
ASSI { 526}
(( segid " " and resid 62 and name HB2 ))
( segid " " and resid 58 and name HG2%)
2.600 0.900 0.900 peak 526 spectrum 1 weight 0.10000E+01 volume 0.35203E-02 ppm1 3.126 ppm2 1.239 CV 1
OR { 526}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 74 and name HB3 ))
OR { 526}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 74 and name HB2 ))
ASSI { 541}
(( segid " " and resid 15 and name HG2 ))
(( segid " " and resid 15 and name HA ))
3.000 1.100 1.100 peak 541 spectrum 1 weight 0.10000E+01 volume 0.47898E-02 ppm1 1.876 ppm2 4.352 CV 1
OR { 541}
(( segid " " and resid 15 and name HG3 ))
(( segid " " and resid 15 and name HA ))
OR { 541}
(( segid " " and resid 40 and name HG3 ))
(( segid " " and resid 40 and name HA ))
ASSI { 543}
(( segid " " and resid 78 and name HG2 ))
(( segid " " and resid 78 and name HG3 ))
1.600 0.300 0.600 peak 543 spectrum 1 weight 0.10000E+01 volume 0.29502E-01 ppm1 1.730 ppm2 1.512 CV 1
OR { 543}
(( segid " " and resid 88 and name HG ))
(( segid " " and resid 88 and name HB3 ))
ASSI { 551}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 38 and name HB2 ))
2.800 1.000 1.000 peak 551 spectrum 1 weight 0.10000E+01 volume 0.41021E-02 ppm1 0.992 ppm2 1.821 CV 1
OR { 551}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 38 and name HB2 ))
OR { 551}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 30 and name HB ))
ASSI { 553}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HG3 ))
1.700 0.400 0.500 peak 553 spectrum 1 weight 0.10000E+01 volume 0.11813E-01 ppm1 0.987 ppm2 0.724 CV 1
OR { 553}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 31 and name HG3 ))
ASSI { 554}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 38 and name HA ))
4.200 2.200 1.800 peak 554 spectrum 1 weight 0.10000E+01 volume 0.13106E-02 ppm1 0.726 ppm2 3.489 CV 1
OR { 554}
(( segid " " and resid 31 and name HG3 ))
(( segid " " and resid 28 and name HB2 ))
ASSI { 569}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 47 and name HB3 ))
3.700 1.700 1.700 peak 569 spectrum 1 weight 0.10000E+01 volume 0.12342E-02 ppm1 0.778 ppm2 1.335 CV 1
OR { 569}
( segid " " and resid 42 and name HD1%)
(( segid " " and resid 38 and name HG3 ))
ASSI { 601}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 48 and name HA ))
4.200 2.200 1.800 peak 601 spectrum 1 weight 0.10000E+01 volume 0.64647E-03 ppm1 0.631 ppm2 4.602 CV 1
OR { 601}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 53 and name HA ))
ASSI { 603}
( segid " " and resid 42 and name HD2%)
(( segid " " and resid 52 and name HB ))
2.700 0.900 0.900 peak 603 spectrum 1 weight 0.10000E+01 volume 0.75811E-02 ppm1 0.640 ppm2 2.124 CV 1
OR { 603}
(( segid " " and resid 68 and name HG3 ))
(( segid " " and resid 68 and name HE3 ))
ASSI { 645}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 74 and name HB3 ))
3.100 1.200 1.200 peak 645 spectrum 1 weight 0.10000E+01 volume 0.19982E-02 ppm1 1.392 ppm2 1.232 CV 1
OR { 645}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 74 and name HB2 ))
OR { 645}
(( segid " " and resid 74 and name HD3 ))
(( segid " " and resid 73 and name HG13))
ASSI { 661}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 59 and name HB2 ))
4.100 2.100 1.900 peak 661 spectrum 1 weight 0.10000E+01 volume 0.90507E-03 ppm1 3.115 ppm2 2.852 CV 1
OR { 661}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 27 and name HB2 ))
ASSI { 663}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 25 and name HD2 ))
3.300 1.300 1.300 peak 663 spectrum 1 weight 0.10000E+01 volume 0.24037E-02 ppm1 2.849 ppm2 3.124 CV 1
OR { 663}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 702}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 13 and name HD3 ))
3.300 1.400 1.400 peak 702 spectrum 1 weight 0.10000E+01 volume 0.15515E-02 ppm1 7.105 ppm2 1.436 CV 1
OR { 702}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 13 and name HD2 ))
OR { 702}
( segid " " and resid 14 and name HD% )
(( segid " " and resid 17 and name HG3 ))
ASSI { 737}
(( segid " " and resid 41 and name HD1 ))
(( segid " " and resid 31 and name HG2 ))
4.000 2.000 2.000 peak 737 spectrum 1 weight 0.10000E+01 volume 0.73462E-03 ppm1 7.604 ppm2 1.004 CV 1
OR { 737}
(( segid " " and resid 41 and name HD1 ))
( segid " " and resid 37 and name HD2%)
ASSI { 751}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 41 and name HA ))
4.300 2.300 1.700 peak 751 spectrum 1 weight 0.10000E+01 volume 0.59946E-03 ppm1 7.524 ppm2 4.135 CV 1
OR { 751}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 32 and name HA ))
ASSI { 753}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB2 ))
3.300 1.300 1.300 peak 753 spectrum 1 weight 0.10000E+01 volume 0.17631E-02 ppm1 7.526 ppm2 3.586 CV 1
OR { 753}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 41 and name HB2 ))
ASSI { 754}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 41 and name HB3 ))
2.700 0.900 0.900 peak 754 spectrum 1 weight 0.10000E+01 volume 0.30619E-02 ppm1 7.528 ppm2 3.124 CV 1
OR { 754}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB3 ))
ASSI { 757}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 30 and name HG13))
3.700 1.700 1.700 peak 757 spectrum 1 weight 0.10000E+01 volume 0.16397E-02 ppm1 7.527 ppm2 1.515 CV 1
OR { 757}
(( segid " " and resid 41 and name HE3 ))
(( segid " " and resid 74 and name HG2 ))
OR { 757}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HG2 ))
ASSI { 764}
(( segid " " and resid 41 and name HZ3 ))
( segid " " and resid 58 and name HD1%)
4.100 2.100 1.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.13929E-02 ppm1 7.028 ppm2 1.026 CV 1
OR { 764}
(( segid " " and resid 41 and name HZ3 ))
( segid " " and resid 30 and name HD1%)
ASSI { 773}
(( segid " " and resid 62 and name HE1 ))
(( segid " " and resid 14 and name HB2 ))
3.400 1.400 1.400 peak 773 spectrum 1 weight 0.10000E+01 volume 0.88746E-03 ppm1 8.191 ppm2 3.166 CV 1
OR { 773}
(( segid " " and resid 62 and name HE1 ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 803}
(( segid " " and resid 9 and name HB3 ))
( segid " " and resid 58 and name HG2%)
4.000 2.000 2.000 peak 803 spectrum 1 weight 0.10000E+01 volume 0.20334E-02 ppm1 2.400 ppm2 1.258 CV 1
OR { 803}
(( segid " " and resid 63 and name HB3 ))
( segid " " and resid 58 and name HG2%)
ASSI { 820}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 56 and name HD2%)
3.500 1.500 1.500 peak 820 spectrum 1 weight 0.10000E+01 volume 0.15927E-02 ppm1 1.354 ppm2 0.980 CV 1
OR { 820}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 52 and name HG1%)
ASSI { 824}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 62 and name HB2 ))
3.300 1.400 1.400 peak 824 spectrum 1 weight 0.10000E+01 volume 0.21451E-02 ppm1 2.534 ppm2 3.131 CV 1
OR { 824}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 25 and name HD2 ))
ASSI { 844}
(( segid " " and resid 76 and name HG3 ))
( segid " " and resid 9 and name HE% )
3.300 1.400 1.400 peak 844 spectrum 1 weight 0.10000E+01 volume 0.19394E-02 ppm1 2.231 ppm2 6.895 CV 1
OR { 844}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HE22))
ASSI { 868}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HD3 ))
4.000 2.000 2.000 peak 868 spectrum 1 weight 0.10000E+01 volume 0.46957E-03 ppm1 4.052 ppm2 1.829 CV 1
OR { 868}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 38 and name HB2 ))
ASSI { 878}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 31 and name HD2 ))
3.600 1.600 1.600 peak 878 spectrum 1 weight 0.10000E+01 volume 0.65235E-03 ppm1 3.479 ppm2 2.045 CV 1
OR { 878}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 40 and name HB3 ))
ASSI { 907}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 73 and name HD1%)
3.600 1.700 1.700 peak 907 spectrum 1 weight 0.10000E+01 volume 0.26799E-02 ppm1 4.053 ppm2 0.896 CV 1
OR { 907}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 74 and name HG3 ))
ASSI { 931}
(( segid " " and resid 34 and name HD3 ))
( segid " " and resid 88 and name HD1%)
3.600 1.600 1.600 peak 931 spectrum 1 weight 0.10000E+01 volume 0.66411E-03 ppm1 3.539 ppm2 0.914 CV 1
OR { 931}
(( segid " " and resid 34 and name HD3 ))
( segid " " and resid 86 and name HG2%)
ASSI { 961}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HD2 ))
2.100 0.500 0.500 peak 961 spectrum 1 weight 0.10000E+01 volume 0.93442E-02 ppm1 0.990 ppm2 2.032 CV 1
OR { 961}
( segid " " and resid 37 and name HD2%)
(( segid " " and resid 31 and name HB2 ))
OR { 961}
(( segid " " and resid 31 and name HG2 ))
(( segid " " and resid 31 and name HB2 ))
ASSI { 966}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 62 and name HB2 ))
3.600 1.700 1.700 peak 966 spectrum 1 weight 0.10000E+01 volume 0.17161E-02 ppm1 4.943 ppm2 3.125 CV 1
OR { 966}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 25 and name HD2 ))
ASSI { 976}
(( segid " " and resid 69 and name HD2 ))
(( segid " " and resid 69 and name HG3 ))
1.600 0.300 0.600 peak 976 spectrum 1 weight 0.10000E+01 volume 0.76991E-01 ppm1 1.685 ppm2 1.451 CV 1
OR { 976}
(( segid " " and resid 82 and name HD2 ))
(( segid " " and resid 82 and name HG2 ))
OR { 976}
(( segid " " and resid 82 and name HD3 ))
(( segid " " and resid 82 and name HG2 ))
OR { 976}
(( segid " " and resid 69 and name HD3 ))
(( segid " " and resid 69 and name HG3 ))
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