NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
13438 |
1uqv   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 431}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 75 and name HD1%)
2.700 .900 .900 peak 431 spectrum 1 weight .10000E+01 volume .31949E-02 ppm1 2.049 ppm2 .897 CV 1
OR { 431}
(( segid " " and resid 93 and name HB1 ))
( segid " " and resid 90 and name HG2%)
OR { 431}
(( segid " " and resid 93 and name HB1 ))
( segid " " and resid 75 and name HD1%)
OR { 431}
(( segid " " and resid 93 and name HB1 ))
( segid " " and resid 94 and name HD1%)
OR { 431}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 90 and name HG2%)
OR { 431}
(( segid " " and resid 93 and name HB1 ))
( segid " " and resid 94 and name HG2%)
OR { 431}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 94 and name HD1%)
ASSI { 608}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 69 and name HD2%)
2.100 2.100 3.900 peak 608 spectrum 1 weight .10000E+01 volume .63899E-02 ppm1 .786 ppm2 1.087 CV 1
OR { 608}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 37 and name HG2%)
OR { 608}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 70 and name HB1 ))
ASSI { 733}
(( segid " " and resid 74 and name HB2 ))
( segid " " and resid 75 and name HD1%)
4.400 2.400 1.600 peak 733 spectrum 1 weight .10000E+01 volume .50131E-03 ppm1 3.284 ppm2 .887 CV 1
OR { 733}
(( segid " " and resid 74 and name HB2 ))
( segid " " and resid 75 and name HD2%)
OR { 733}
(( segid " " and resid 74 and name HB1 ))
( segid " " and resid 75 and name HD2%)
OR { 733}
(( segid " " and resid 74 and name HB1 ))
( segid " " and resid 75 and name HD1%)
OR { 733}
(( segid " " and resid 74 and name HB2 ))
( segid " " and resid 73 and name HD2%)
ASSI { 756}
(( segid " " and resid 82 and name HB1 ))
(( segid " " and resid 85 and name HN ))
3.100 1.200 1.200 peak 756 spectrum 1 weight .10000E+01 volume .17299E-02 ppm1 2.917 ppm2 7.284 CV 1
OR { 756}
(( segid " " and resid 82 and name HB1 ))
(( segid " " and resid 82 and name HN ))
ASSI { 778}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 61 and name HG2 ))
3.300 1.300 1.300 peak 778 spectrum 1 weight .10000E+01 volume .20338E-02 ppm1 1.065 ppm2 1.765 CV 1
OR { 778}
( segid " " and resid 66 and name HG2%)
(( segid " " and resid 70 and name HG ))
OR { 778}
( segid " " and resid 66 and name HG2%)
(( segid " " and resid 69 and name HG ))
ASSI { 829}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HB1 ))
2.500 .800 .800 peak 829 spectrum 1 weight .10000E+01 volume .70108E-02 ppm1 4.414 ppm2 2.771 CV 1
OR { 829}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HB1 ))
ASSI { 867}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 56 and name HG ))
2.300 .600 .600 peak 867 spectrum 1 weight .10000E+01 volume .10291E-01 ppm1 .862 ppm2 1.233 CV 1
OR { 867}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 41 and name HG11))
OR { 867}
( segid " " and resid 60 and name HD1%)
( segid " " and resid 40 and name HG1%)
ASSI { 1019}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 61 and name HG1 ))
3.500 1.500 1.500 peak 1019 spectrum 1 weight .10000E+01 volume .18987E-02 ppm1 1.065 ppm2 1.612 CV 1
OR { 1019}
( segid " " and resid 66 and name HG2%)
(( segid " " and resid 69 and name HB1 ))
ASSI { 1047}
(( segid " " and resid 41 and name HG11))
(( segid " " and resid 57 and name HA ))
4.100 2.100 1.900 peak 1047 spectrum 1 weight .10000E+01 volume .65975E-03 ppm1 1.216 ppm2 3.830 CV 1
OR { 1047}
(( segid " " and resid 41 and name HG11))
(( segid " " and resid 40 and name HA ))
ASSI { 1114}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 68 and name HB1 ))
3.200 1.300 1.300 peak 1114 spectrum 1 weight .10000E+01 volume .43638E-03 ppm1 1.077 ppm2 2.525 CV 1
OR { 1114}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 64 and name HB1 ))
OR { 1114}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 63 and name HB1 ))
ASSI { 1139}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 90 and name HA ))
2.500 .800 .800 peak 1139 spectrum 1 weight .10000E+01 volume .54624E-02 ppm1 .858 ppm2 3.659 CV 1
OR { 1139}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 90 and name HA ))
ASSI { 1735}
(( segid " " and resid 106 and name HD1 ))
(( segid " " and resid 105 and name HA ))
3.800 1.800 1.800 peak 1735 spectrum 1 weight .10000E+01 volume .78185E-03 ppm1 7.182 ppm2 4.296 CV 1
OR { 1735}
(( segid " " and resid 106 and name HD1 ))
(( segid " " and resid 103 and name HA ))
OR { 1735}
(( segid " " and resid 106 and name HD1 ))
(( segid " " and resid 107 and name HA ))
ASSI { 1914}
(( segid " " and resid 73 and name HB2 ))
( segid " " and resid 73 and name HD1%)
2.100 .500 .500 peak 1914 spectrum 1 weight .10000E+01 volume .13580E-01 ppm1 1.729 ppm2 .870 CV 1
OR { 1914}
(( segid " " and resid 86 and name HB2 ))
( segid " " and resid 86 and name HD1%)
OR { 1914}
(( segid " " and resid 86 and name HB2 ))
( segid " " and resid 86 and name HD2%)
OR { 1914}
(( segid " " and resid 73 and name HB2 ))
( segid " " and resid 73 and name HD2%)
ASSI { 1940}
(( segid " " and resid 60 and name HB1 ))
(( segid " " and resid 60 and name HA ))
2.600 .900 .900 peak 1940 spectrum 1 weight .10000E+01 volume .38105E-02 ppm1 1.371 ppm2 4.008 CV 1
OR { 1940}
(( segid " " and resid 81 and name HB1 ))
(( segid " " and resid 81 and name HA ))
ASSI { 2006}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 100 and name HN ))
2.600 .900 .900 peak 2006 spectrum 1 weight .10000E+01 volume .31559E-02 ppm1 1.915 ppm2 8.073 CV 1
OR { 2006}
(( segid " " and resid 105 and name HB1 ))
(( segid " " and resid 105 and name HN ))
OR { 2006}
(( segid " " and resid 105 and name HB2 ))
(( segid " " and resid 105 and name HN ))
OR { 2006}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 31 and name HN ))
ASSI { 2008}
(( segid " " and resid 103 and name HD1 ))
(( segid " " and resid 103 and name HA ))
3.300 1.400 1.400 peak 2008 spectrum 1 weight .10000E+01 volume .17663E-02 ppm1 1.575 ppm2 4.259 CV 1
OR { 2008}
(( segid " " and resid 103 and name HD2 ))
(( segid " " and resid 103 and name HA ))
OR { 2008}
(( segid " " and resid 107 and name HD1 ))
(( segid " " and resid 107 and name HA ))
OR { 2008}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 107 and name HA ))
ASSI { 2021}
(( segid " " and resid 71 and name HD2 ))
(( segid " " and resid 68 and name HA ))
3.300 1.400 1.400 peak 2021 spectrum 1 weight .10000E+01 volume .70132E-03 ppm1 3.554 ppm2 4.365 CV 1
OR { 2021}
(( segid " " and resid 71 and name HD2 ))
(( segid " " and resid 69 and name HA ))
ASSI { 2316}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HA ))
2.500 .800 .800 peak 2316 spectrum 1 weight .10000E+01 volume .59195E-02 ppm1 2.639 ppm2 4.365 CV 1
OR { 2316}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HA ))
ASSI { 2321}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 31 and name HA ))
2.500 .800 .800 peak 2321 spectrum 1 weight .10000E+01 volume .41975E-02 ppm1 2.449 ppm2 4.370 CV 1
OR { 2321}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 38 and name HA ))
ASSI { 2373}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HA ))
2.500 .800 .800 peak 2373 spectrum 1 weight .10000E+01 volume .48521E-02 ppm1 2.836 ppm2 4.705 CV 1
OR { 2373}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HA ))
OR { 2373}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HA ))
OR { 2373}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HA ))
ASSI { 2417}
(( segid " " and resid 92 and name HZ ))
( segid " " and resid 60 and name HD2%)
2.300 .700 .700 peak 2417 spectrum 1 weight .10000E+01 volume .50624E-02 ppm1 6.973 ppm2 .897 CV 1
OR { 2417}
(( segid " " and resid 92 and name HZ ))
( segid " " and resid 81 and name HD2%)
OR { 2417}
(( segid " " and resid 92 and name HZ ))
( segid " " and resid 60 and name HD1%)
ASSI { 2420}
( segid " " and resid 92 and name HE% )
( segid " " and resid 81 and name HD2%)
2.500 .800 .800 peak 2420 spectrum 1 weight .10000E+01 volume .33248E-02 ppm1 7.215 ppm2 .875 CV 1
OR { 2420}
( segid " " and resid 92 and name HE% )
( segid " " and resid 60 and name HD2%)
OR { 2420}
( segid " " and resid 92 and name HE% )
( segid " " and resid 60 and name HD1%)
ASSI { 2421}
( segid " " and resid 92 and name HE% )
(( segid " " and resid 81 and name HB1 ))
3.200 1.300 1.300 peak 2421 spectrum 1 weight .10000E+01 volume .43638E-03 ppm1 7.213 ppm2 1.352 CV 1
OR { 2421}
( segid " " and resid 92 and name HE% )
(( segid " " and resid 73 and name HB1 ))
OR { 2421}
( segid " " and resid 92 and name HE% )
( segid " " and resid 89 and name HB% )
OR { 2421}
( segid " " and resid 92 and name HE% )
( segid " " and resid 40 and name HG1%)
ASSI { 2423}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 89 and name HA ))
3.400 1.400 1.400 peak 2423 spectrum 1 weight .10000E+01 volume .10545E-02 ppm1 7.127 ppm2 4.089 CV 1
OR { 2423}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 78 and name HA ))
ASSI { 2426}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 95 and name HB1 ))
3.900 1.900 1.900 peak 2426 spectrum 1 weight .10000E+01 volume .51689E-03 ppm1 7.125 ppm2 1.731 CV 1
OR { 2426}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 96 and name HB ))
OR { 2426}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 93 and name HD2 ))
ASSI { 2427}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 48 and name HG ))
3.600 1.700 1.700 peak 2427 spectrum 1 weight .10000E+01 volume .69871E-03 ppm1 7.126 ppm2 1.571 CV 1
OR { 2427}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 96 and name HG12))
OR { 2427}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 48 and name HB2 ))
ASSI { 2429}
( segid " " and resid 92 and name HD% )
( segid " " and resid 81 and name HD2%)
2.600 .900 .900 peak 2429 spectrum 1 weight .10000E+01 volume .32884E-02 ppm1 7.126 ppm2 .867 CV 1
OR { 2429}
( segid " " and resid 92 and name HD% )
( segid " " and resid 60 and name HD1%)
OR { 2429}
( segid " " and resid 92 and name HD% )
( segid " " and resid 60 and name HD2%)
OR { 2429}
( segid " " and resid 92 and name HD% )
( segid " " and resid 75 and name HD1%)
OR { 2429}
( segid " " and resid 92 and name HD% )
( segid " " and resid 94 and name HD1%)
OR { 2429}
( segid " " and resid 92 and name HD% )
( segid " " and resid 94 and name HG2%)
ASSI { 2430}
( segid " " and resid 92 and name HD% )
( segid " " and resid 48 and name HD2%)
2.800 1.000 1.000 peak 2430 spectrum 1 weight .10000E+01 volume .25559E-02 ppm1 7.126 ppm2 .736 CV 1
OR { 2430}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 96 and name HG11))
OR { 2430}
( segid " " and resid 92 and name HD% )
( segid " " and resid 70 and name HD2%)
ASSI { 2451}
(( segid " " and resid 43 and name HZ3 ))
( segid " " and resid 70 and name HD1%)
3.200 1.300 1.300 peak 2451 spectrum 1 weight .10000E+01 volume .13715E-02 ppm1 6.948 ppm2 .769 CV 1
OR { 2451}
(( segid " " and resid 43 and name HZ3 ))
( segid " " and resid 70 and name HD2%)
OR { 2451}
(( segid " " and resid 43 and name HZ3 ))
( segid " " and resid 95 and name HD1%)
ASSI { 2452}
(( segid " " and resid 43 and name HZ3 ))
( segid " " and resid 92 and name HE% )
3.600 1.600 1.600 peak 2452 spectrum 1 weight .10000E+01 volume .10182E-02 ppm1 6.949 ppm2 7.257 CV 1
OR { 2452}
(( segid " " and resid 43 and name HZ3 ))
(( segid " " and resid 43 and name HZ2 ))
ASSI { 2454}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 95 and name HA ))
4.000 2.000 2.000 peak 2454 spectrum 1 weight .10000E+01 volume .57405E-03 ppm1 7.286 ppm2 4.094 CV 1
OR { 2454}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 99 and name HA ))
ASSI { 2457}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 95 and name HB1 ))
3.000 1.100 1.100 peak 2457 spectrum 1 weight .10000E+01 volume .21169E-02 ppm1 7.288 ppm2 1.753 CV 1
OR { 2457}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 99 and name HB1 ))
OR { 2457}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 95 and name HG ))
ASSI { 2458}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 95 and name HB2 ))
3.200 1.200 1.200 peak 2458 spectrum 1 weight .10000E+01 volume .15351E-02 ppm1 7.290 ppm2 2.037 CV 1
OR { 2458}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 99 and name HB2 ))
ASSI { 2474}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 40 and name HN ))
3.900 1.900 1.900 peak 2474 spectrum 1 weight .10000E+01 volume .49870E-03 ppm1 3.368 ppm2 8.253 CV 1
OR { 2474}
(( segid " " and resid 35 and name HB1 ))
(( segid " " and resid 40 and name HN ))
OR { 2474}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 68 and name HN ))
ASSI { 2480}
(( segid " " and resid 35 and name HE3 ))
(( segid " " and resid 67 and name HA1 ))
3.600 1.600 1.600 peak 2480 spectrum 1 weight .10000E+01 volume .80000E-03 ppm1 7.128 ppm2 3.583 CV 1
OR { 2480}
(( segid " " and resid 35 and name HE3 ))
(( segid " " and resid 43 and name HB2 ))
ASSI { 2488}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 68 and name HA ))
3.800 1.800 1.800 peak 2488 spectrum 1 weight .10000E+01 volume .68835E-03 ppm1 6.569 ppm2 4.387 CV 1
OR { 2488}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 31 and name HA ))
ASSI { 2489}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 67 and name HA1 ))
3.600 1.700 1.700 peak 2489 spectrum 1 weight .10000E+01 volume .51951E-03 ppm1 6.571 ppm2 3.590 CV 1
OR { 2489}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 71 and name HD2 ))
ASSI { 2498}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 71 and name HG2 ))
3.800 1.800 1.800 peak 2498 spectrum 1 weight .10000E+01 volume .66237E-03 ppm1 7.007 ppm2 1.989 CV 1
OR { 2498}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 100 and name HB2 ))
OR { 2498}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 71 and name HB2 ))
OR { 2498}
(( segid " " and resid 32 and name HZ ))
( segid " " and resid 99 and name HE% )
ASSI { 2499}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 100 and name HG2 ))
3.700 1.700 1.700 peak 2499 spectrum 1 weight .10000E+01 volume .57666E-03 ppm1 7.009 ppm2 1.743 CV 1
OR { 2499}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 99 and name HB1 ))
OR { 2499}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 100 and name HB1 ))
OR { 2499}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 71 and name HB1 ))
ASSI { 2500}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 100 and name HG1 ))
3.700 1.700 1.700 peak 2500 spectrum 1 weight .10000E+01 volume .60004E-03 ppm1 7.008 ppm2 1.510 CV 1
OR { 2500}
(( segid " " and resid 32 and name HZ ))
(( segid " " and resid 71 and name HG1 ))
ASSI { 2510}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 100 and name HA ))
3.700 1.700 1.700 peak 2510 spectrum 1 weight .10000E+01 volume .63120E-03 ppm1 6.956 ppm2 4.039 CV 1
OR { 2510}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 71 and name HA ))
ASSI { 2511}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 71 and name HD2 ))
3.900 1.900 1.900 peak 2511 spectrum 1 weight .10000E+01 volume .52469E-03 ppm1 6.957 ppm2 3.524 CV 1
OR { 2511}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 67 and name HA1 ))
ASSI { 2512}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 71 and name HG2 ))
3.400 1.400 1.400 peak 2512 spectrum 1 weight .10000E+01 volume .11299E-02 ppm1 6.960 ppm2 1.995 CV 1
OR { 2512}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 100 and name HB2 ))
OR { 2512}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 71 and name HB2 ))
ASSI { 2513}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 32 and name HB2 ))
3.800 1.800 1.800 peak 2513 spectrum 1 weight .10000E+01 volume .86756E-03 ppm1 6.960 ppm2 1.759 CV 1
OR { 2513}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 100 and name HG2 ))
OR { 2513}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 71 and name HB1 ))
ASSI { 2514}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 71 and name HG1 ))
3.500 1.500 1.500 peak 2514 spectrum 1 weight .10000E+01 volume .86238E-03 ppm1 6.962 ppm2 1.548 CV 1
OR { 2514}
( segid " " and resid 32 and name HE% )
(( segid " " and resid 32 and name HB1 ))
ASSI { 2522}
(( segid " " and resid 43 and name HH2 ))
(( segid " " and resid 95 and name HB1 ))
3.200 1.300 1.300 peak 2522 spectrum 1 weight .10000E+01 volume .10338E-02 ppm1 6.824 ppm2 1.754 CV 1
OR { 2522}
(( segid " " and resid 43 and name HH2 ))
(( segid " " and resid 96 and name HB ))
OR { 2522}
(( segid " " and resid 43 and name HH2 ))
(( segid " " and resid 95 and name HG ))
ASSI { 2524}
(( segid " " and resid 43 and name HH2 ))
(( segid " " and resid 96 and name HG11))
3.100 1.200 1.200 peak 2524 spectrum 1 weight .10000E+01 volume .14494E-02 ppm1 6.826 ppm2 .733 CV 1
OR { 2524}
(( segid " " and resid 43 and name HH2 ))
( segid " " and resid 95 and name HD1%)
OR { 2524}
(( segid " " and resid 43 and name HH2 ))
( segid " " and resid 95 and name HD2%)
ASSI { 2525}
(( segid " " and resid 43 and name HH2 ))
( segid " " and resid 47 and name HG2%)
4.000 2.000 2.000 peak 2525 spectrum 1 weight .10000E+01 volume .48573E-03 ppm1 6.829 ppm2 .961 CV 1
OR { 2525}
(( segid " " and resid 43 and name HH2 ))
( segid " " and resid 94 and name HG2%)
ASSI { 2528}
(( segid " " and resid 43 and name HE3 ))
( segid " " and resid 70 and name HD1%)
3.800 1.800 1.800 peak 2528 spectrum 1 weight .10000E+01 volume .54027E-03 ppm1 7.924 ppm2 .782 CV 1
OR { 2528}
(( segid " " and resid 43 and name HE3 ))
( segid " " and resid 70 and name HD2%)
OR { 2528}
(( segid " " and resid 43 and name HE3 ))
( segid " " and resid 95 and name HD1%)
ASSI { 2530}
(( segid " " and resid 43 and name HZ3 ))
(( segid " " and resid 96 and name HA ))
4.500 2.500 1.500 peak 2530 spectrum 1 weight .10000E+01 volume .45196E-03 ppm1 6.944 ppm2 3.557 CV 1
OR { 2530}
(( segid " " and resid 43 and name HZ3 ))
(( segid " " and resid 43 and name HB2 ))
ASSI { 2539}
(( segid " " and resid 35 and name HZ2 ))
(( segid " " and resid 30 and name HA ))
3.200 3.200 2.800 peak 2539 spectrum 1 weight .10000E+01 volume .46754E-03 ppm1 7.302 ppm2 4.303 CV 1
OR { 2539}
(( segid " " and resid 35 and name HZ2 ))
(( segid " " and resid 31 and name HA ))
ASSI { 2655}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 87 and name HD22))
2.900 1.000 1.000 peak 2655 spectrum 1 weight .10000E+01 volume .23585E-02 ppm1 2.952 ppm2 7.846 CV 1
OR { 2655}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 88 and name HN ))
ASSI { 2656}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 87 and name HD22))
3.100 1.200 1.200 peak 2656 spectrum 1 weight .10000E+01 volume .22832E-02 ppm1 2.786 ppm2 7.851 CV 1
OR { 2656}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 88 and name HN ))
ASSI { 2699}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 92 and name HZ ))
3.400 1.500 1.500 peak 2699 spectrum 1 weight .10000E+01 volume .91692E-03 ppm1 .239 ppm2 6.987 CV 1
OR { 2699}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 43 and name HZ3 ))
ASSI { 2700}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 70 and name HA ))
2.800 1.000 1.000 peak 2700 spectrum 1 weight .10000E+01 volume .10026E-02 ppm1 .241 ppm2 4.044 CV 1
OR { 2700}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 71 and name HA ))
OR { 2700}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 95 and name HA ))
ASSI { 2703}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 93 and name HB2 ))
2.800 1.000 1.000 peak 2703 spectrum 1 weight .10000E+01 volume .10442E-02 ppm1 .236 ppm2 2.051 CV 1
OR { 2703}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 95 and name HB2 ))
OR { 2703}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 93 and name HB1 ))
ASSI { 2713}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 98 and name HN ))
3.600 1.600 1.600 peak 2713 spectrum 1 weight .10000E+01 volume .96105E-03 ppm1 .926 ppm2 8.101 CV 1
OR { 2713}
( segid " " and resid 90 and name HG2%)
(( segid " " and resid 89 and name HN ))
ASSI { 2715}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 94 and name HN ))
3.200 1.300 1.300 peak 2715 spectrum 1 weight .10000E+01 volume .38521E-02 ppm1 .932 ppm2 8.418 CV 1
OR { 2715}
( segid " " and resid 90 and name HG2%)
(( segid " " and resid 90 and name HN ))
ASSI { 2717}
( segid " " and resid 90 and name HG2%)
(( segid " " and resid 91 and name HA ))
2.800 1.000 1.000 peak 2717 spectrum 1 weight .10000E+01 volume .39637E-02 ppm1 .930 ppm2 3.938 CV 1
OR { 2717}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 91 and name HA ))
ASSI { 2718}
( segid " " and resid 90 and name HG2%)
(( segid " " and resid 90 and name HB ))
1.900 .400 .400 peak 2718 spectrum 1 weight .10000E+01 volume .19304E-01 ppm1 .922 ppm2 1.945 CV 1
OR { 2718}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 94 and name HB ))
ASSI { 2719}
( segid " " and resid 90 and name HG2%)
(( segid " " and resid 90 and name HA ))
2.200 .600 .600 peak 2719 spectrum 1 weight .10000E+01 volume .97900E-02 ppm1 .929 ppm2 3.680 CV 1
OR { 2719}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 94 and name HA ))
ASSI { 2720}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 98 and name HE2 ))
2.600 .900 .900 peak 2720 spectrum 1 weight .10000E+01 volume .43612E-02 ppm1 .923 ppm2 2.981 CV 1
OR { 2720}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 98 and name HE1 ))
OR { 2720}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 97 and name HB2 ))
ASSI { 2723}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 98 and name HD1 ))
2.300 .700 .700 peak 2723 spectrum 1 weight .10000E+01 volume .82677E-02 ppm1 .925 ppm2 1.689 CV 1
OR { 2723}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 98 and name HD2 ))
OR { 2723}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 95 and name HB1 ))
OR { 2723}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 98 and name HG2 ))
OR { 2723}
( segid " " and resid 90 and name HG2%)
(( segid " " and resid 86 and name HG ))
ASSI { 2737}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 87 and name HN ))
4.100 2.100 1.900 peak 2737 spectrum 1 weight .10000E+01 volume .57923E-03 ppm1 .861 ppm2 8.111 CV 1
OR { 2737}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 89 and name HN ))
ASSI { 2739}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 87 and name HD22))
3.100 1.200 1.200 peak 2739 spectrum 1 weight .10000E+01 volume .52730E-03 ppm1 .866 ppm2 7.829 CV 1
OR { 2739}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 88 and name HN ))
ASSI { 2745}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 87 and name HB2 ))
3.000 3.000 3.000 peak 2745 spectrum 1 weight .10000E+01 volume .88832E-03 ppm1 .864 ppm2 2.946 CV 1
OR { 2745}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 93 and name HE1 ))
OR { 2745}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 91 and name HE1 ))
ASSI { 2746}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 87 and name HB2 ))
3.000 1.100 1.100 peak 2746 spectrum 1 weight .10000E+01 volume .78441E-03 ppm1 .836 ppm2 2.970 CV 1
OR { 2746}
( segid " " and resid 94 and name HD1%)
(( segid " " and resid 91 and name HE2 ))
OR { 2746}
( segid " " and resid 94 and name HD1%)
(( segid " " and resid 91 and name HE1 ))
OR { 2746}
( segid " " and resid 94 and name HD1%)
(( segid " " and resid 97 and name HB2 ))
OR { 2746}
( segid " " and resid 94 and name HD1%)
(( segid " " and resid 98 and name HE1 ))
OR { 2746}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 93 and name HE1 ))
OR { 2746}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 93 and name HE2 ))
OR { 2746}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 91 and name HE1 ))
ASSI { 2762}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 69 and name HG ))
2.700 2.700 3.300 peak 2762 spectrum 1 weight .10000E+01 volume .58130E-02 ppm1 .981 ppm2 1.721 CV 1
OR { 2762}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 70 and name HG ))
ASSI { 2765}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 42 and name HN ))
3.000 1.100 1.100 peak 2765 spectrum 1 weight .10000E+01 volume .71691E-03 ppm1 .933 ppm2 8.304 CV 1
OR { 2765}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 40 and name HN ))
ASSI { 2769}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 61 and name HA ))
2.800 .900 .900 peak 2769 spectrum 1 weight .10000E+01 volume .31066E-02 ppm1 .932 ppm2 4.077 CV 1
OR { 2769}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 37 and name HA ))
ASSI { 2774}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 40 and name HB ))
3.100 1.200 1.200 peak 2774 spectrum 1 weight .10000E+01 volume .80522E-03 ppm1 .931 ppm2 2.671 CV 1
OR { 2774}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 38 and name HB2 ))
OR { 2774}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 44 and name HB1 ))
ASSI { 2775}
( segid " " and resid 42 and name HG2%)
( segid " " and resid 45 and name HG2%)
2.800 2.800 3.200 peak 2775 spectrum 1 weight .10000E+01 volume .30390E-02 ppm1 1.180 ppm2 .899 CV 1
OR { 2775}
( segid " " and resid 53 and name HG2%)
( segid " " and resid 45 and name HG2%)
OR { 2775}
( segid " " and resid 42 and name HG2%)
( segid " " and resid 47 and name HG2%)
ASSI { 2776}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 65 and name HB ))
3.700 1.700 1.700 peak 2776 spectrum 1 weight .10000E+01 volume .78703E-03 ppm1 .935 ppm2 2.272 CV 1
OR { 2776}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 58 and name HG1 ))
OR { 2776}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 59 and name HB2 ))
OR { 2776}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 52 and name HG1 ))
OR { 2776}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 62 and name HG1 ))
ASSI { 2786}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 42 and name HB ))
3.200 1.300 1.300 peak 2786 spectrum 1 weight .10000E+01 volume .53765E-03 ppm1 .812 ppm2 4.217 CV 1
OR { 2786}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 46 and name HA ))
OR { 2786}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 43 and name HA ))
OR { 2786}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 55 and name HA ))
ASSI { 2788}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 42 and name HA ))
2.700 .900 .900 peak 2788 spectrum 1 weight .10000E+01 volume .34988E-02 ppm1 .814 ppm2 3.814 CV 1
OR { 2788}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 57 and name HA ))
ASSI { 2804}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 52 and name HA ))
3.700 1.700 1.700 peak 2804 spectrum 1 weight .10000E+01 volume .13767E-02 ppm1 1.065 ppm2 4.014 CV 1
OR { 2804}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 61 and name HA ))
OR { 2804}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 58 and name HA ))
OR { 2804}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 60 and name HA ))
ASSI { 2805}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 57 and name HA ))
2.700 .900 .900 peak 2805 spectrum 1 weight .10000E+01 volume .27897E-02 ppm1 1.066 ppm2 3.820 CV 1
OR { 2805}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 42 and name HA ))
ASSI { 2810}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 52 and name HG2 ))
3.300 1.400 1.400 peak 2810 spectrum 1 weight .10000E+01 volume .16234E-02 ppm1 1.066 ppm2 2.275 CV 1
OR { 2810}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 52 and name HG1 ))
OR { 2810}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 59 and name HB2 ))
ASSI { 2821}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 87 and name HA ))
3.700 1.700 1.700 peak 2821 spectrum 1 weight .10000E+01 volume .96628E-03 ppm1 1.371 ppm2 4.435 CV 1
OR { 2821}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 92 and name HA ))
ASSI { 2825}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 82 and name HB1 ))
2.300 2.300 3.700 peak 2825 spectrum 1 weight .10000E+01 volume .37092E-02 ppm1 1.370 ppm2 2.893 CV 1
OR { 2825}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 87 and name HB2 ))
OR { 2825}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 93 and name HE1 ))
ASSI { 2827}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 79 and name HG1 ))
2.300 .700 .700 peak 2827 spectrum 1 weight .10000E+01 volume .71636E-02 ppm1 1.370 ppm2 1.905 CV 1
OR { 2827}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 90 and name HG12))
OR { 2827}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 90 and name HB ))
ASSI { 2828}
( segid " " and resid 89 and name HB% )
( segid " " and resid 86 and name HD1%)
2.300 .700 .700 peak 2828 spectrum 1 weight .10000E+01 volume .11273E-01 ppm1 1.370 ppm2 .891 CV 1
OR { 2828}
( segid " " and resid 89 and name HB% )
( segid " " and resid 75 and name HD1%)
OR { 2828}
( segid " " and resid 89 and name HB% )
( segid " " and resid 75 and name HD2%)
OR { 2828}
( segid " " and resid 89 and name HB% )
( segid " " and resid 90 and name HD1%)
ASSI { 2829}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 86 and name HB1 ))
2.700 2.700 3.300 peak 2829 spectrum 1 weight .10000E+01 volume .41196E-02 ppm1 1.371 ppm2 1.594 CV 1
OR { 2829}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 75 and name HB1 ))
OR { 2829}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 88 and name HG1 ))
ASSI { 2830}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 88 and name HB1 ))
2.800 1.000 1.000 peak 2830 spectrum 1 weight .10000E+01 volume .34702E-02 ppm1 1.371 ppm2 1.677 CV 1
OR { 2830}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 86 and name HG ))
OR { 2830}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 86 and name HB1 ))
OR { 2830}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 88 and name HG1 ))
ASSI { 2833}
( segid " " and resid 96 and name HG2%)
( segid " " and resid 92 and name HE% )
3.700 1.800 1.800 peak 2833 spectrum 1 weight .10000E+01 volume .83121E-03 ppm1 .564 ppm2 7.207 CV 1
OR { 2833}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 100 and name HE ))
ASSI { 2835}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 43 and name HH2 ))
4.100 2.100 1.900 peak 2835 spectrum 1 weight .10000E+01 volume .52986E-03 ppm1 .565 ppm2 6.863 CV 1
OR { 2835}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 97 and name HD21))
ASSI { 2836}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 71 and name HA ))
2.700 2.700 3.300 peak 2836 spectrum 1 weight .10000E+01 volume .36936E-02 ppm1 .565 ppm2 4.083 CV 1
OR { 2836}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 100 and name HA ))
OR { 2836}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 95 and name HA ))
ASSI { 2840}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 99 and name HB2 ))
2.900 1.100 1.100 peak 2840 spectrum 1 weight .10000E+01 volume .22416E-02 ppm1 .566 ppm2 2.000 CV 1
OR { 2840}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 98 and name HB2 ))
OR { 2840}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 98 and name HB1 ))
ASSI { 2849}
( segid " " and resid 50 and name HG1%)
(( segid " " and resid 45 and name HA ))
3.200 1.300 1.300 peak 2849 spectrum 1 weight .10000E+01 volume .26105E-02 ppm1 .530 ppm2 3.661 CV 1
OR { 2849}
( segid " " and resid 50 and name HG1%)
(( segid " " and resid 55 and name HD1 ))
ASSI { 2858}
( segid " " and resid 56 and name HD1%)
( segid " " and resid 60 and name HD1%)
3.300 1.400 1.400 peak 2858 spectrum 1 weight .10000E+01 volume .10182E-02 ppm1 .248 ppm2 .862 CV 1
OR { 2858}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 45 and name HG11))
OR { 2858}
( segid " " and resid 56 and name HD1%)
( segid " " and resid 45 and name HD1%)
ASSI { 2860}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 88 and name HE1 ))
3.200 1.300 1.300 peak 2860 spectrum 1 weight .10000E+01 volume .46495E-03 ppm1 .255 ppm2 2.854 CV 1
OR { 2860}
( segid " " and resid 56 and name HD1%)
(( segid " " and resid 63 and name HB2 ))
ASSI { 2862}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 49 and name HN ))
2.900 1.100 1.100 peak 2862 spectrum 1 weight .10000E+01 volume .97146E-03 ppm1 .563 ppm2 7.221 CV 1
OR { 2862}
( segid " " and resid 56 and name HD2%)
( segid " " and resid 92 and name HE% )
ASSI { 2865}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 49 and name HA ))
3.400 1.400 1.400 peak 2865 spectrum 1 weight .10000E+01 volume .97146E-03 ppm1 .560 ppm2 4.014 CV 1
OR { 2865}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 52 and name HA ))
OR { 2865}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 60 and name HA ))
OR { 2865}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 58 and name HA ))
ASSI { 2868}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 50 and name HB ))
3.500 1.500 1.500 peak 2868 spectrum 1 weight .10000E+01 volume .74289E-03 ppm1 .559 ppm2 2.311 CV 1
OR { 2868}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 59 and name HB2 ))
OR { 2868}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 55 and name HB2 ))
OR { 2868}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 52 and name HG2 ))
ASSI { 2869}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 49 and name HB1 ))
2.600 .800 .800 peak 2869 spectrum 1 weight .10000E+01 volume .33144E-02 ppm1 .561 ppm2 2.010 CV 1
OR { 2869}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 60 and name HB2 ))
OR { 2869}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 60 and name HG ))
ASSI { 2882}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 88 and name HA ))
3.400 1.400 1.400 peak 2882 spectrum 1 weight .10000E+01 volume .10026E-02 ppm1 .642 ppm2 3.911 CV 1
OR { 2882}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 91 and name HA ))
ASSI { 2884}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 88 and name HE2 ))
3.000 1.100 1.100 peak 2884 spectrum 1 weight .10000E+01 volume .15169E-02 ppm1 .643 ppm2 2.938 CV 1
OR { 2884}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 91 and name HE1 ))
OR { 2884}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 91 and name HE2 ))
ASSI { 2885}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 91 and name HB1 ))
2.800 1.000 1.000 peak 2885 spectrum 1 weight .10000E+01 volume .33040E-02 ppm1 .641 ppm2 1.875 CV 1
OR { 2885}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 49 and name HG1 ))
OR { 2885}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 91 and name HB2 ))
OR { 2885}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 95 and name HG ))
ASSI { 2893}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 43 and name HZ3 ))
4.100 2.100 1.900 peak 2893 spectrum 1 weight .10000E+01 volume .41820E-03 ppm1 .683 ppm2 6.966 CV 1
OR { 2893}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 92 and name HZ ))
ASSI { 2897}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 88 and name HE2 ))
3.300 1.300 1.300 peak 2897 spectrum 1 weight .10000E+01 volume .10286E-02 ppm1 .683 ppm2 2.933 CV 1
OR { 2897}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 91 and name HE1 ))
OR { 2897}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 91 and name HE2 ))
ASSI { 2899}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 91 and name HB1 ))
2.600 2.600 3.400 peak 2899 spectrum 1 weight .10000E+01 volume .40806E-02 ppm1 .683 ppm2 1.865 CV 1
OR { 2899}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 95 and name HG ))
OR { 2899}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 91 and name HB2 ))
ASSI { 2900}
( segid " " and resid 48 and name HD1%)
( segid " " and resid 56 and name HD1%)
2.800 1.000 1.000 peak 2900 spectrum 1 weight .10000E+01 volume .36079E-02 ppm1 .639 ppm2 .266 CV 1
OR { 2900}
( segid " " and resid 48 and name HD1%)
( segid " " and resid 96 and name HD1%)
ASSI { 2901}
( segid " " and resid 48 and name HD2%)
( segid " " and resid 56 and name HD1%)
2.700 .900 .900 peak 2901 spectrum 1 weight .10000E+01 volume .42780E-02 ppm1 .680 ppm2 .268 CV 1
OR { 2901}
( segid " " and resid 48 and name HD2%)
( segid " " and resid 96 and name HD1%)
ASSI { 2910}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 65 and name HN ))
2.900 1.100 1.100 peak 2910 spectrum 1 weight .10000E+01 volume .38702E-02 ppm1 1.065 ppm2 7.758 CV 1
OR { 2910}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 38 and name HN ))
ASSI { 2911}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 39 and name HN ))
4.000 2.000 2.000 peak 2911 spectrum 1 weight .10000E+01 volume .70911E-03 ppm1 1.066 ppm2 7.539 CV 1
OR { 2911}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 63 and name HN ))
ASSI { 2914}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 36 and name HA ))
3.100 1.200 1.200 peak 2914 spectrum 1 weight .10000E+01 volume .25741E-02 ppm1 1.079 ppm2 4.816 CV 1
OR { 2914}
( segid " " and resid 66 and name HG2%)
(( segid " " and resid 36 and name HA ))
ASSI { 2920}
( segid " " and resid 66 and name HG2%)
(( segid " " and resid 68 and name HB1 ))
3.600 1.600 1.600 peak 2920 spectrum 1 weight .10000E+01 volume .13039E-02 ppm1 1.066 ppm2 2.500 CV 1
OR { 2920}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 64 and name HB1 ))
ASSI { 2929}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 66 and name HB ))
3.200 1.300 1.300 peak 2929 spectrum 1 weight .10000E+01 volume .41560E-03 ppm1 1.071 ppm2 2.711 CV 1
OR { 2929}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 68 and name HB2 ))
ASSI { 2931}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 65 and name HB ))
3.100 3.100 2.900 peak 2931 spectrum 1 weight .10000E+01 volume .52730E-03 ppm1 1.073 ppm2 2.186 CV 1
OR { 2931}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 72 and name HG1 ))
ASSI { 2934}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 65 and name HG11))
2.600 2.600 3.400 peak 2934 spectrum 1 weight .10000E+01 volume .16780E-02 ppm1 1.074 ppm2 1.404 CV 1
OR { 2934}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 73 and name HB1 ))
ASSI { 2945}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 42 and name HB ))
2.100 .500 .500 peak 2945 spectrum 1 weight .10000E+01 volume .14141E-01 ppm1 1.183 ppm2 4.182 CV 1
OR { 2945}
( segid " " and resid 53 and name HG2%)
(( segid " " and resid 53 and name HA ))
ASSI { 3004}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 37 and name HA ))
2.200 .600 .600 peak 3004 spectrum 1 weight .10000E+01 volume .90420E-02 ppm1 1.004 ppm2 4.098 CV 1
OR { 3004}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 61 and name HA ))
ASSI { 3006}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 40 and name HB ))
3.600 1.600 1.600 peak 3006 spectrum 1 weight .10000E+01 volume .92210E-03 ppm1 1.005 ppm2 2.683 CV 1
OR { 3006}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 38 and name HB2 ))
ASSI { 3007}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 38 and name HB1 ))
4.100 2.100 1.900 peak 3007 spectrum 1 weight .10000E+01 volume .79482E-03 ppm1 1.005 ppm2 2.469 CV 1
OR { 3007}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 64 and name HB1 ))
ASSI { 3011}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 60 and name HB1 ))
3.000 1.100 1.100 peak 3011 spectrum 1 weight .10000E+01 volume .27273E-02 ppm1 1.004 ppm2 1.314 CV 1
OR { 3011}
( segid " " and resid 37 and name HG1%)
( segid " " and resid 40 and name HG1%)
OR { 3011}
( segid " " and resid 37 and name HG1%)
( segid " " and resid 40 and name HG2%)
ASSI { 3027}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 60 and name HN ))
3.000 1.100 1.100 peak 3027 spectrum 1 weight .10000E+01 volume .70132E-03 ppm1 .787 ppm2 8.574 CV 1
OR { 3027}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 62 and name HN ))
OR { 3027}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 59 and name HN ))
ASSI { 3030}
( segid " " and resid 95 and name HD1%)
(( segid " " and resid 43 and name HZ2 ))
2.700 .900 .900 peak 3030 spectrum 1 weight .10000E+01 volume .25299E-02 ppm1 .787 ppm2 7.303 CV 1
OR { 3030}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 63 and name HD21))
ASSI { 3031}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 81 and name HA ))
2.200 .600 .600 peak 3031 spectrum 1 weight .10000E+01 volume .15826E-01 ppm1 .787 ppm2 4.035 CV 1
OR { 3031}
( segid " " and resid 95 and name HD1%)
(( segid " " and resid 95 and name HA ))
ASSI { 3032}
( segid " " and resid 95 and name HD1%)
(( segid " " and resid 47 and name HB ))
2.600 2.600 3.400 peak 3032 spectrum 1 weight .10000E+01 volume .17819E-02 ppm1 .792 ppm2 3.247 CV 1
OR { 3032}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 82 and name HB2 ))
OR { 3032}
( segid " " and resid 95 and name HD1%)
(( segid " " and resid 92 and name HB2 ))
ASSI { 3035}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 59 and name HB2 ))
2.400 2.400 3.600 peak 3035 spectrum 1 weight .10000E+01 volume .24053E-02 ppm1 .786 ppm2 2.322 CV 1
OR { 3035}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 62 and name HG1 ))
OR { 3035}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 79 and name HG2 ))
ASSI { 3045}
(( segid " " and resid 81 and name HB1 ))
(( segid " " and resid 81 and name HB2 ))
1.800 .400 .400 peak 3045 spectrum 1 weight .10000E+01 volume .97121E-02 ppm1 1.369 ppm2 2.014 CV 1
OR { 3045}
(( segid " " and resid 60 and name HB1 ))
(( segid " " and resid 60 and name HB2 ))
ASSI { 3083}
(( segid " " and resid 105 and name HB2 ))
(( segid " " and resid 105 and name HN ))
2.900 1.000 1.000 peak 3083 spectrum 1 weight .10000E+01 volume .22235E-02 ppm1 1.959 ppm2 8.075 CV 1
OR { 3083}
(( segid " " and resid 105 and name HB2 ))
(( segid " " and resid 106 and name HN ))
ASSI { 3087}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 102 and name HN ))
2.700 .900 .900 peak 3087 spectrum 1 weight .10000E+01 volume .38105E-02 ppm1 4.009 ppm2 7.978 CV 1
OR { 3087}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HN ))
OR { 3087}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 103 and name HN ))
ASSI { 3122}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 87 and name HN ))
3.800 1.800 1.800 peak 3122 spectrum 1 weight .10000E+01 volume .11897E-02 ppm1 .877 ppm2 8.099 CV 1
OR { 3122}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 89 and name HN ))
ASSI { 3124}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 101 and name HN ))
3.000 3.000 3.000 peak 3124 spectrum 1 weight .10000E+01 volume .63377E-03 ppm1 1.921 ppm2 8.138 CV 1
OR { 3124}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 98 and name HN ))
OR { 3124}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 31 and name HN ))
OR { 3124}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 43 and name HN ))
ASSI { 3125}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 35 and name HZ2 ))
2.700 .900 .900 peak 3125 spectrum 1 weight .10000E+01 volume .11689E-02 ppm1 1.925 ppm2 7.320 CV 1
OR { 3125}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 43 and name HZ2 ))
ASSI { 3128}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 96 and name HA ))
3.100 3.100 2.900 peak 3128 spectrum 1 weight .10000E+01 volume .51172E-03 ppm1 1.925 ppm2 3.582 CV 1
OR { 3128}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 43 and name HB2 ))
ASSI { 3129}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 43 and name HB1 ))
2.800 2.800 3.200 peak 3129 spectrum 1 weight .10000E+01 volume .10805E-02 ppm1 1.926 ppm2 2.843 CV 1
OR { 3129}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 28 and name HB2 ))
OR { 3129}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 28 and name HB1 ))
OR { 3129}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 29 and name HB2 ))
OR { 3129}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 29 and name HB2 ))
OR { 3129}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 29 and name HB1 ))
OR { 3129}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 29 and name HB1 ))
ASSI { 3172}
( segid " " and resid 95 and name HD2%)
(( segid " " and resid 91 and name HE1 ))
2.800 1.000 1.000 peak 3172 spectrum 1 weight .10000E+01 volume .97925E-03 ppm1 .711 ppm2 2.945 CV 1
OR { 3172}
( segid " " and resid 95 and name HD2%)
(( segid " " and resid 91 and name HE2 ))
OR { 3172}
( segid " " and resid 95 and name HD2%)
(( segid " " and resid 98 and name HE1 ))
ASSI { 3183}
(( segid " " and resid 70 and name HG ))
(( segid " " and resid 71 and name HD2 ))
3.600 1.600 1.600 peak 3183 spectrum 1 weight .10000E+01 volume .16000E-02 ppm1 1.788 ppm2 3.575 CV 1
OR { 3183}
(( segid " " and resid 70 and name HG ))
(( segid " " and resid 67 and name HA1 ))
ASSI { 3213}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 92 and name HN ))
3.600 1.600 1.600 peak 3213 spectrum 1 weight .10000E+01 volume .12026E-02 ppm1 1.938 ppm2 8.456 CV 1
OR { 3213}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 90 and name HN ))
ASSI { 3230}
( segid " " and resid 69 and name HD1%)
(( segid " " and resid 69 and name HB2 ))
2.200 .600 .600 peak 3230 spectrum 1 weight .10000E+01 volume .87017E-02 ppm1 .877 ppm2 1.894 CV 1
OR { 3230}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 75 and name HB2 ))
ASSI { 3238}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 79 and name HB1 ))
3.400 1.400 1.400 peak 3238 spectrum 1 weight .10000E+01 volume .15351E-02 ppm1 2.906 ppm2 1.911 CV 1
OR { 3238}
(( segid " " and resid 80 and name HB2 ))
(( segid " " and resid 81 and name HB2 ))
ASSI { 3239}
(( segid " " and resid 80 and name HB1 ))
(( segid " " and resid 81 and name HB2 ))
3.700 1.700 1.700 peak 3239 spectrum 1 weight .10000E+01 volume .97925E-03 ppm1 2.736 ppm2 1.945 CV 1
OR { 3239}
(( segid " " and resid 80 and name HB1 ))
(( segid " " and resid 79 and name HB1 ))
ASSI { 3331}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HN ))
2.700 .900 .900 peak 3331 spectrum 1 weight .10000E+01 volume .27299E-02 ppm1 4.034 ppm2 8.601 CV 1
OR { 3331}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HN ))
OR { 3331}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HN ))
OR { 3331}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 59 and name HN ))
ASSI { 3332}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HB2 ))
2.200 .600 .600 peak 3332 spectrum 1 weight .10000E+01 volume .10995E-01 ppm1 4.037 ppm2 2.167 CV 1
OR { 3332}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HB1 ))
OR { 3332}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 3351}
(( segid " " and resid 73 and name HG ))
(( segid " " and resid 73 and name HB1 ))
3.000 1.100 1.100 peak 3351 spectrum 1 weight .10000E+01 volume .17663E-02 ppm1 2.032 ppm2 1.389 CV 1
OR { 3351}
(( segid " " and resid 60 and name HG ))
(( segid " " and resid 60 and name HB1 ))
ASSI { 3353}
(( segid " " and resid 73 and name HG ))
( segid " " and resid 73 and name HD1%)
2.100 .600 .600 peak 3353 spectrum 1 weight .10000E+01 volume .95770E-02 ppm1 2.035 ppm2 .875 CV 1
OR { 3353}
(( segid " " and resid 73 and name HG ))
( segid " " and resid 73 and name HD2%)
OR { 3353}
(( segid " " and resid 60 and name HG ))
( segid " " and resid 60 and name HD2%)
OR { 3353}
(( segid " " and resid 60 and name HG ))
( segid " " and resid 60 and name HD1%)
ASSI { 3362}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 43 and name HZ2 ))
2.800 1.000 1.000 peak 3362 spectrum 1 weight .10000E+01 volume .25663E-02 ppm1 .963 ppm2 7.302 CV 1
OR { 3362}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 49 and name HN ))
ASSI { 3424}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 90 and name HD1%)
4.400 2.400 1.600 peak 3424 spectrum 1 weight .10000E+01 volume .78703E-03 ppm1 2.946 ppm2 .901 CV 1
OR { 3424}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 86 and name HD2%)
ASSI { 3426}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 107 and name HA ))
4.200 2.200 1.800 peak 3426 spectrum 1 weight .10000E+01 volume .65457E-03 ppm1 3.258 ppm2 4.283 CV 1
OR { 3426}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 105 and name HA ))
ASSI { 3427}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 107 and name HA ))
4.500 2.600 1.500 peak 3427 spectrum 1 weight .10000E+01 volume .52469E-03 ppm1 3.226 ppm2 4.284 CV 1
OR { 3427}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 105 and name HA ))
ASSI { 3431}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 72 and name HA ))
2.500 .800 .800 peak 3431 spectrum 1 weight .10000E+01 volume .48858E-02 ppm1 1.921 ppm2 4.298 CV 1
OR { 3431}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 30 and name HA ))
ASSI { 3434}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 101 and name HB2 ))
3.600 1.600 1.600 peak 3434 spectrum 1 weight .10000E+01 volume .43638E-03 ppm1 4.009 ppm2 2.833 CV 1
OR { 3434}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 103 and name HE2 ))
OR { 3434}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 103 and name HE1 ))
OR { 3434}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 103 and name HE2 ))
OR { 3434}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 103 and name HE1 ))
ASSI { 3450}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 95 and name HA ))
4.000 2.000 2.000 peak 3450 spectrum 1 weight .10000E+01 volume .59481E-03 ppm1 3.545 ppm2 4.099 CV 1
OR { 3450}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 99 and name HA ))
ASSI { 3451}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HB ))
2.700 .900 .900 peak 3451 spectrum 1 weight .10000E+01 volume .31897E-02 ppm1 3.547 ppm2 1.768 CV 1
OR { 3451}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 99 and name HB1 ))
ASSI { 3453}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 99 and name HB2 ))
2.900 1.100 1.100 peak 3453 spectrum 1 weight .10000E+01 volume .15974E-02 ppm1 3.544 ppm2 1.997 CV 1
OR { 3453}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 100 and name HB2 ))
ASSI { 3458}
(( segid " " and resid 103 and name HB1 ))
(( segid " " and resid 103 and name HN ))
3.200 1.300 1.300 peak 3458 spectrum 1 weight .10000E+01 volume .18831E-02 ppm1 1.765 ppm2 7.920 CV 1
OR { 3458}
(( segid " " and resid 103 and name HB1 ))
(( segid " " and resid 104 and name HN ))
ASSI { 3491}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 98 and name HD1 ))
4.000 2.000 2.000 peak 3491 spectrum 1 weight .10000E+01 volume .70132E-03 ppm1 2.836 ppm2 1.725 CV 1
OR { 3491}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 96 and name HB ))
OR { 3491}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 100 and name HB1 ))
OR { 3491}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 98 and name HD2 ))
OR { 3491}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 98 and name HG2 ))
ASSI { 3494}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 98 and name HB2 ))
4.400 2.400 1.600 peak 3494 spectrum 1 weight .10000E+01 volume .58702E-03 ppm1 3.025 ppm2 1.950 CV 1
OR { 3494}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 100 and name HB2 ))
OR { 3494}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 98 and name HB1 ))
ASSI { 3495}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 96 and name HB ))
4.100 2.100 1.900 peak 3495 spectrum 1 weight .10000E+01 volume .56887E-03 ppm1 3.030 ppm2 1.720 CV 1
OR { 3495}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 100 and name HB1 ))
OR { 3495}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 98 and name HD2 ))
OR { 3495}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 98 and name HG2 ))
ASSI { 3496}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 96 and name HB ))
2.500 .800 .800 peak 3496 spectrum 1 weight .10000E+01 volume .45923E-02 ppm1 3.792 ppm2 1.726 CV 1
OR { 3496}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HD2 ))
ASSI { 3504}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 50 and name HG1%)
3.400 1.400 1.400 peak 3504 spectrum 1 weight .10000E+01 volume .96105E-03 ppm1 3.093 ppm2 .563 CV 1
OR { 3504}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 56 and name HD2%)
ASSI { 3534}
(( segid " " and resid 90 and name HA ))
( segid " " and resid 89 and name HB% )
3.300 1.400 1.400 peak 3534 spectrum 1 weight .10000E+01 volume .13585E-02 ppm1 3.642 ppm2 1.414 CV 1
OR { 3534}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 93 and name HG2 ))
OR { 3534}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 93 and name HG1 ))
ASSI { 3548}
(( segid " " and resid 93 and name HA ))
( segid " " and resid 75 and name HD1%)
3.500 1.600 1.600 peak 3548 spectrum 1 weight .10000E+01 volume .11429E-02 ppm1 3.792 ppm2 .879 CV 1
OR { 3548}
(( segid " " and resid 93 and name HA ))
( segid " " and resid 94 and name HG2%)
OR { 3548}
(( segid " " and resid 93 and name HA ))
( segid " " and resid 94 and name HD1%)
OR { 3548}
(( segid " " and resid 93 and name HA ))
( segid " " and resid 90 and name HG2%)
ASSI { 3552}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 94 and name HN ))
3.500 1.600 1.600 peak 3552 spectrum 1 weight .10000E+01 volume .71691E-03 ppm1 3.792 ppm2 8.444 CV 1
OR { 3552}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 97 and name HN ))
ASSI { 3562}
(( segid " " and resid 92 and name HB1 ))
( segid " " and resid 89 and name HB% )
3.900 1.900 1.900 peak 3562 spectrum 1 weight .10000E+01 volume .61300E-03 ppm1 3.141 ppm2 1.409 CV 1
OR { 3562}
(( segid " " and resid 92 and name HB1 ))
(( segid " " and resid 93 and name HG1 ))
OR { 3562}
(( segid " " and resid 92 and name HB1 ))
(( segid " " and resid 93 and name HG2 ))
ASSI { 3567}
(( segid " " and resid 91 and name HD1 ))
( segid " " and resid 95 and name HD2%)
3.000 1.100 1.100 peak 3567 spectrum 1 weight .10000E+01 volume .27014E-02 ppm1 1.656 ppm2 .691 CV 1
OR { 3567}
(( segid " " and resid 91 and name HD2 ))
( segid " " and resid 95 and name HD2%)
OR { 3567}
(( segid " " and resid 91 and name HD2 ))
( segid " " and resid 48 and name HD1%)
OR { 3567}
(( segid " " and resid 91 and name HD1 ))
( segid " " and resid 48 and name HD2%)
OR { 3567}
(( segid " " and resid 91 and name HD2 ))
( segid " " and resid 48 and name HD2%)
ASSI { 3568}
(( segid " " and resid 91 and name HG2 ))
( segid " " and resid 48 and name HD1%)
3.700 1.700 1.700 peak 3568 spectrum 1 weight .10000E+01 volume .82599E-03 ppm1 1.628 ppm2 .699 CV 1
OR { 3568}
(( segid " " and resid 91 and name HG2 ))
( segid " " and resid 48 and name HD2%)
OR { 3568}
(( segid " " and resid 91 and name HG2 ))
( segid " " and resid 95 and name HD2%)
ASSI { 3570}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 89 and name HN ))
2.900 1.100 1.100 peak 3570 spectrum 1 weight .10000E+01 volume .18676E-02 ppm1 3.927 ppm2 8.098 CV 1
OR { 3570}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 87 and name HN ))
ASSI { 3573}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 75 and name HD2%)
3.600 1.600 1.600 peak 3573 spectrum 1 weight .10000E+01 volume .12286E-02 ppm1 4.038 ppm2 .881 CV 1
OR { 3573}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 75 and name HD1%)
OR { 3573}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 86 and name HD1%)
OR { 3573}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 90 and name HG2%)
OR { 3573}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 90 and name HD1%)
ASSI { 3574}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 79 and name HG1 ))
4.000 2.000 2.000 peak 3574 spectrum 1 weight .10000E+01 volume .73249E-03 ppm1 4.034 ppm2 1.905 CV 1
OR { 3574}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 91 and name HB1 ))
OR { 3574}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 90 and name HB ))
OR { 3574}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 90 and name HG12))
ASSI { 3587}
(( segid " " and resid 88 and name HD2 ))
( segid " " and resid 48 and name HD1%)
3.200 1.300 1.300 peak 3587 spectrum 1 weight .10000E+01 volume .98704E-03 ppm1 1.438 ppm2 .684 CV 1
OR { 3587}
(( segid " " and resid 88 and name HD1 ))
( segid " " and resid 48 and name HD1%)
OR { 3587}
(( segid " " and resid 88 and name HD1 ))
( segid " " and resid 48 and name HD2%)
OR { 3587}
(( segid " " and resid 88 and name HD2 ))
( segid " " and resid 48 and name HD2%)
OR { 3587}
(( segid " " and resid 93 and name HG1 ))
(( segid " " and resid 96 and name HG11))
OR { 3587}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 96 and name HG11))
OR { 3587}
(( segid " " and resid 93 and name HG1 ))
( segid " " and resid 70 and name HD2%)
OR { 3587}
(( segid " " and resid 93 and name HG2 ))
( segid " " and resid 70 and name HD2%)
ASSI { 3592}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 88 and name HB2 ))
4.200 2.200 1.800 peak 3592 spectrum 1 weight .10000E+01 volume .62597E-03 ppm1 2.951 ppm2 1.855 CV 1
OR { 3592}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 90 and name HB ))
ASSI { 3594}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 88 and name HB2 ))
3.800 1.800 1.800 peak 3594 spectrum 1 weight .10000E+01 volume .79221E-03 ppm1 2.786 ppm2 1.890 CV 1
OR { 3594}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 90 and name HB ))
OR { 3594}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 90 and name HG12))
ASSI { 3599}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 79 and name HG1 ))
2.700 .900 .900 peak 3599 spectrum 1 weight .10000E+01 volume .22157E-02 ppm1 3.927 ppm2 1.901 CV 1
OR { 3599}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 90 and name HG12))
ASSI { 3600}
(( segid " " and resid 90 and name HB ))
(( segid " " and resid 91 and name HA ))
3.800 1.800 1.800 peak 3600 spectrum 1 weight .10000E+01 volume .70911E-03 ppm1 1.904 ppm2 3.922 CV 1
OR { 3600}
(( segid " " and resid 90 and name HB ))
(( segid " " and resid 88 and name HA ))
ASSI { 3612}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 82 and name HN ))
3.000 1.200 1.200 peak 3612 spectrum 1 weight .10000E+01 volume .12390E-02 ppm1 3.221 ppm2 7.283 CV 1
OR { 3612}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 85 and name HN ))
ASSI { 3634}
(( segid " " and resid 82 and name HB1 ))
(( segid " " and resid 79 and name HA ))
3.200 1.300 1.300 peak 3634 spectrum 1 weight .10000E+01 volume .16546E-02 ppm1 2.922 ppm2 3.582 CV 1
OR { 3634}
(( segid " " and resid 82 and name HB1 ))
(( segid " " and resid 84 and name HA1 ))
ASSI { 3645}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 81 and name HB1 ))
3.100 1.200 1.200 peak 3645 spectrum 1 weight .10000E+01 volume .12468E-02 ppm1 3.215 ppm2 1.397 CV 1
OR { 3645}
(( segid " " and resid 82 and name HB2 ))
( segid " " and resid 89 and name HB% )
OR { 3645}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 88 and name HD1 ))
ASSI { 3646}
(( segid " " and resid 82 and name HB1 ))
( segid " " and resid 89 and name HB% )
3.100 1.200 1.200 peak 3646 spectrum 1 weight .10000E+01 volume .21481E-02 ppm1 2.914 ppm2 1.397 CV 1
OR { 3646}
(( segid " " and resid 82 and name HB1 ))
(( segid " " and resid 81 and name HB1 ))
OR { 3646}
(( segid " " and resid 82 and name HB1 ))
(( segid " " and resid 88 and name HD1 ))
ASSI { 3652}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 86 and name HA ))
3.800 1.800 1.800 peak 3652 spectrum 1 weight .10000E+01 volume .85976E-03 ppm1 3.561 ppm2 3.961 CV 1
OR { 3652}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 76 and name HA ))
OR { 3652}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 81 and name HA ))
ASSI { 3658}
(( segid " " and resid 79 and name HB2 ))
( segid " " and resid 86 and name HD1%)
3.200 1.300 1.300 peak 3658 spectrum 1 weight .10000E+01 volume .13922E-02 ppm1 2.159 ppm2 .892 CV 1
OR { 3658}
(( segid " " and resid 79 and name HB2 ))
( segid " " and resid 75 and name HD1%)
OR { 3658}
(( segid " " and resid 79 and name HB2 ))
( segid " " and resid 75 and name HD2%)
OR { 3658}
(( segid " " and resid 79 and name HB2 ))
( segid " " and resid 86 and name HD2%)
ASSI { 3662}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HN ))
2.900 1.000 1.000 peak 3662 spectrum 1 weight .10000E+01 volume .20780E-02 ppm1 4.075 ppm2 8.056 CV 1
OR { 3662}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HN ))
ASSI { 3666}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 81 and name HN ))
3.200 1.300 1.300 peak 3666 spectrum 1 weight .10000E+01 volume .11637E-02 ppm1 4.080 ppm2 8.296 CV 1
OR { 3666}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 80 and name HN ))
ASSI { 3667}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 73 and name HN ))
3.400 1.400 1.400 peak 3667 spectrum 1 weight .10000E+01 volume .11481E-02 ppm1 4.082 ppm2 7.222 CV 1
OR { 3667}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 92 and name HE% )
OR { 3667}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 82 and name HN ))
OR { 3667}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 49 and name HN ))
ASSI { 3674}
(( segid " " and resid 73 and name HB1 ))
(( segid " " and resid 77 and name HB1 ))
3.300 1.300 1.300 peak 3674 spectrum 1 weight .10000E+01 volume .90651E-03 ppm1 1.354 ppm2 2.783 CV 1
OR { 3674}
(( segid " " and resid 81 and name HB1 ))
(( segid " " and resid 80 and name HB1 ))
ASSI { 3689}
(( segid " " and resid 78 and name HB2 ))
( segid " " and resid 75 and name HD2%)
3.200 1.300 1.300 peak 3689 spectrum 1 weight .10000E+01 volume .14779E-02 ppm1 3.432 ppm2 .880 CV 1
OR { 3689}
(( segid " " and resid 78 and name HB2 ))
( segid " " and resid 75 and name HD1%)
OR { 3689}
(( segid " " and resid 78 and name HB2 ))
( segid " " and resid 81 and name HD2%)
ASSI { 3690}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 75 and name HD2%)
3.300 1.300 1.300 peak 3690 spectrum 1 weight .10000E+01 volume .17870E-02 ppm1 2.821 ppm2 .881 CV 1
OR { 3690}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 75 and name HD1%)
OR { 3690}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 81 and name HD2%)
ASSI { 3717}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 54 and name HB1 ))
3.700 1.700 1.700 peak 3717 spectrum 1 weight .10000E+01 volume .67016E-03 ppm1 1.726 ppm2 2.783 CV 1
OR { 3717}
(( segid " " and resid 73 and name HB2 ))
(( segid " " and resid 77 and name HB1 ))
ASSI { 3733}
(( segid " " and resid 72 and name HG1 ))
( segid " " and resid 69 and name HD1%)
2.600 .800 .800 peak 3733 spectrum 1 weight .10000E+01 volume .17117E-02 ppm1 2.154 ppm2 .915 CV 1
OR { 3733}
(( segid " " and resid 72 and name HG1 ))
( segid " " and resid 65 and name HG2%)
ASSI { 3737}
(( segid " " and resid 72 and name HB2 ))
( segid " " and resid 69 and name HD1%)
3.100 1.200 1.200 peak 3737 spectrum 1 weight .10000E+01 volume .11637E-02 ppm1 2.293 ppm2 .891 CV 1
OR { 3737}
(( segid " " and resid 72 and name HB2 ))
( segid " " and resid 73 and name HD2%)
ASSI { 3739}
(( segid " " and resid 72 and name HG2 ))
( segid " " and resid 69 and name HD1%)
2.800 2.800 3.200 peak 3739 spectrum 1 weight .10000E+01 volume .17533E-02 ppm1 2.328 ppm2 .902 CV 1
OR { 3739}
(( segid " " and resid 72 and name HG2 ))
( segid " " and resid 73 and name HD2%)
ASSI { 3754}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 69 and name HA ))
3.600 1.600 1.600 peak 3754 spectrum 1 weight .10000E+01 volume .10598E-02 ppm1 3.439 ppm2 4.364 CV 1
OR { 3754}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 68 and name HA ))
ASSI { 3767}
(( segid " " and resid 71 and name HD2 ))
( segid " " and resid 70 and name HD1%)
3.100 1.200 1.200 peak 3767 spectrum 1 weight .10000E+01 volume .82081E-03 ppm1 3.549 ppm2 .790 CV 1
OR { 3767}
(( segid " " and resid 71 and name HD2 ))
( segid " " and resid 70 and name HD2%)
OR { 3767}
(( segid " " and resid 71 and name HD2 ))
( segid " " and resid 73 and name HD1%)
ASSI { 3769}
( segid " " and resid 70 and name HD1%)
(( segid " " and resid 71 and name HD2 ))
3.200 1.300 1.300 peak 3769 spectrum 1 weight .10000E+01 volume .18702E-02 ppm1 .767 ppm2 3.575 CV 1
OR { 3769}
( segid " " and resid 70 and name HD1%)
(( segid " " and resid 96 and name HA ))
ASSI { 3782}
( segid " " and resid 70 and name HD1%)
(( segid " " and resid 43 and name HZ3 ))
2.700 .900 .900 peak 3782 spectrum 1 weight .10000E+01 volume .40079E-02 ppm1 .767 ppm2 6.988 CV 1
OR { 3782}
( segid " " and resid 70 and name HD1%)
(( segid " " and resid 92 and name HZ ))
ASSI { 3786}
( segid " " and resid 70 and name HD2%)
(( segid " " and resid 71 and name HD2 ))
3.200 1.300 1.300 peak 3786 spectrum 1 weight .10000E+01 volume .28105E-02 ppm1 .752 ppm2 3.580 CV 1
OR { 3786}
( segid " " and resid 70 and name HD2%)
(( segid " " and resid 96 and name HA ))
ASSI { 3797}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 70 and name HA ))
3.900 1.900 1.900 peak 3797 spectrum 1 weight .10000E+01 volume .76883E-03 ppm1 1.872 ppm2 4.001 CV 1
OR { 3797}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 65 and name HA ))
ASSI { 3818}
(( segid " " and resid 64 and name HB2 ))
( segid " " and resid 37 and name HG2%)
3.600 1.600 1.600 peak 3818 spectrum 1 weight .10000E+01 volume .11637E-02 ppm1 3.068 ppm2 1.079 CV 1
OR { 3818}
(( segid " " and resid 64 and name HB2 ))
( segid " " and resid 69 and name HD2%)
ASSI { 3819}
(( segid " " and resid 64 and name HB1 ))
( segid " " and resid 37 and name HG2%)
3.500 1.500 1.500 peak 3819 spectrum 1 weight .10000E+01 volume .97925E-03 ppm1 2.472 ppm2 1.078 CV 1
OR { 3819}
(( segid " " and resid 64 and name HB1 ))
( segid " " and resid 69 and name HD2%)
ASSI { 3828}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 69 and name HD2%)
2.600 .900 .900 peak 3828 spectrum 1 weight .10000E+01 volume .51251E-02 ppm1 3.970 ppm2 1.081 CV 1
OR { 3828}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 66 and name HG2%)
ASSI { 3842}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 70 and name HN ))
3.300 1.400 1.400 peak 3842 spectrum 1 weight .10000E+01 volume .10727E-02 ppm1 .893 ppm2 7.510 CV 1
OR { 3842}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 69 and name HN ))
ASSI { 3844}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 66 and name HA ))
3.400 1.400 1.400 peak 3844 spectrum 1 weight .10000E+01 volume .11897E-02 ppm1 .893 ppm2 4.296 CV 1
OR { 3844}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 69 and name HA ))
ASSI { 3845}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 66 and name HB ))
4.300 2.300 1.700 peak 3845 spectrum 1 weight .10000E+01 volume .79482E-03 ppm1 .892 ppm2 2.593 CV 1
OR { 3845}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 63 and name HB1 ))
ASSI { 3846}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 77 and name HB1 ))
3.300 1.400 1.400 peak 3846 spectrum 1 weight .10000E+01 volume .77406E-03 ppm1 .894 ppm2 2.737 CV 1
OR { 3846}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 68 and name HB2 ))
ASSI { 3861}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 65 and name HA ))
3.300 1.400 1.400 peak 3861 spectrum 1 weight .10000E+01 volume .98186E-03 ppm1 2.894 ppm2 4.003 CV 1
OR { 3861}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 60 and name HA ))
ASSI { 3862}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 60 and name HA ))
3.900 1.900 1.900 peak 3862 spectrum 1 weight .10000E+01 volume .64678E-03 ppm1 2.536 ppm2 3.999 CV 1
OR { 3862}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 65 and name HA ))
ASSI { 3876}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 41 and name HD1%)
2.400 .700 .700 peak 3876 spectrum 1 weight .10000E+01 volume .55092E-02 ppm1 1.921 ppm2 .946 CV 1
OR { 3876}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 37 and name HG1%)
OR { 3876}
(( segid " " and resid 61 and name HB1 ))
( segid " " and resid 41 and name HD1%)
ASSI { 3891}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 63 and name HN ))
3.500 1.500 1.500 peak 3891 spectrum 1 weight .10000E+01 volume .13974E-02 ppm1 4.078 ppm2 7.599 CV 1
OR { 3891}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 58 and name HN ))
ASSI { 3895}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 60 and name HD1%)
3.500 3.500 2.500 peak 3895 spectrum 1 weight .10000E+01 volume .12494E-02 ppm1 2.316 ppm2 .821 CV 1
OR { 3895}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 81 and name HD1%)
ASSI { 3901}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 60 and name HN ))
3.600 1.600 1.600 peak 3901 spectrum 1 weight .10000E+01 volume .61039E-03 ppm1 3.813 ppm2 8.586 CV 1
OR { 3901}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 59 and name HN ))
ASSI { 3905}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 60 and name HD1%)
2.800 1.000 1.000 peak 3905 spectrum 1 weight .10000E+01 volume .35222E-02 ppm1 3.817 ppm2 .896 CV 1
OR { 3905}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 41 and name HD1%)
OR { 3905}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 60 and name HD2%)
ASSI { 3906}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 56 and name HG ))
3.400 1.500 1.500 peak 3906 spectrum 1 weight .10000E+01 volume .11818E-02 ppm1 3.818 ppm2 1.244 CV 1
OR { 3906}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 41 and name HG11))
ASSI { 3926}
(( segid " " and resid 56 and name HG ))
( segid " " and resid 60 and name HD1%)
3.200 1.300 1.300 peak 3926 spectrum 1 weight .10000E+01 volume .14520E-02 ppm1 1.205 ppm2 .871 CV 1
OR { 3926}
(( segid " " and resid 56 and name HG ))
(( segid " " and resid 45 and name HG11))
OR { 3926}
(( segid " " and resid 56 and name HG ))
( segid " " and resid 45 and name HD1%)
ASSI { 3954}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 51 and name HG2 ))
3.300 1.300 1.300 peak 3954 spectrum 1 weight .10000E+01 volume .17195E-02 ppm1 4.128 ppm2 2.308 CV 1
OR { 3954}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 52 and name HG2 ))
OR { 3954}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 51 and name HG1 ))
ASSI { 4028}
(( segid " " and resid 45 and name HG11))
(( segid " " and resid 42 and name HA ))
3.600 1.600 1.600 peak 4028 spectrum 1 weight .10000E+01 volume .77406E-03 ppm1 .811 ppm2 3.798 CV 1
OR { 4028}
(( segid " " and resid 45 and name HG11))
(( segid " " and resid 57 and name HA ))
ASSI { 4036}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 56 and name HD2%)
3.100 1.200 1.200 peak 4036 spectrum 1 weight .10000E+01 volume .29482E-02 ppm1 .921 ppm2 .552 CV 1
OR { 4036}
( segid " " and resid 45 and name HG2%)
( segid " " and resid 50 and name HG1%)
ASSI { 4058}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 45 and name HG11))
3.300 1.400 1.400 peak 4058 spectrum 1 weight .10000E+01 volume .12572E-02 ppm1 3.098 ppm2 .872 CV 1
OR { 4058}
(( segid " " and resid 44 and name HB2 ))
( segid " " and resid 60 and name HD1%)
OR { 4058}
(( segid " " and resid 44 and name HB2 ))
( segid " " and resid 60 and name HD2%)
OR { 4058}
(( segid " " and resid 44 and name HB2 ))
( segid " " and resid 45 and name HD1%)
ASSI { 4059}
(( segid " " and resid 44 and name HB1 ))
(( segid " " and resid 45 and name HG11))
3.200 1.300 1.300 peak 4059 spectrum 1 weight .10000E+01 volume .14832E-02 ppm1 2.609 ppm2 .856 CV 1
OR { 4059}
(( segid " " and resid 44 and name HB1 ))
( segid " " and resid 60 and name HD1%)
OR { 4059}
(( segid " " and resid 44 and name HB1 ))
( segid " " and resid 45 and name HD1%)
ASSI { 4070}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 46 and name HN ))
4.000 2.000 2.000 peak 4070 spectrum 1 weight .10000E+01 volume .48573E-03 ppm1 3.786 ppm2 7.595 CV 1
OR { 4070}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 39 and name HN ))
ASSI { 4072}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 42 and name HG2%)
2.300 .600 .600 peak 4072 spectrum 1 weight .10000E+01 volume .86627E-02 ppm1 3.792 ppm2 1.224 CV 1
OR { 4072}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 40 and name HG1%)
ASSI { 4088}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 60 and name HD1%)
2.500 .800 .800 peak 4088 spectrum 1 weight .10000E+01 volume .89118E-02 ppm1 3.613 ppm2 .912 CV 1
OR { 4088}
(( segid " " and resid 41 and name HA ))
( segid " " and resid 41 and name HD1%)
ASSI { 4095}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 41 and name HB ))
4.300 2.300 1.700 peak 4095 spectrum 1 weight .10000E+01 volume .54027E-03 ppm1 2.715 ppm2 2.055 CV 1
OR { 4095}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 37 and name HB ))
ASSI { 4108}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 43 and name HB2 ))
3.100 1.200 1.200 peak 4108 spectrum 1 weight .10000E+01 volume .23637E-02 ppm1 3.789 ppm2 3.600 CV 1
OR { 4108}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 41 and name HA ))
OR { 4108}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HA ))
OR { 4108}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HB2 ))
ASSI { 4115}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 43 and name HZ3 ))
3.500 1.500 1.500 peak 4115 spectrum 1 weight .10000E+01 volume .81302E-03 ppm1 1.248 ppm2 6.980 CV 1
OR { 4115}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 92 and name HZ ))
ASSI { 4116}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 35 and name HE3 ))
3.900 1.900 1.900 peak 4116 spectrum 1 weight .10000E+01 volume .63377E-03 ppm1 1.247 ppm2 7.172 CV 1
OR { 4116}
( segid " " and resid 40 and name HG1%)
( segid " " and resid 92 and name HE% )
ASSI { 4117}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 37 and name HA ))
3.800 1.800 1.800 peak 4117 spectrum 1 weight .10000E+01 volume .94029E-03 ppm1 1.245 ppm2 4.182 CV 1
OR { 4117}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 66 and name HA ))
OR { 4117}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 39 and name HA ))
ASSI { 4119}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 41 and name HA ))
3.400 1.500 1.500 peak 4119 spectrum 1 weight .10000E+01 volume .10234E-02 ppm1 1.248 ppm2 3.602 CV 1
OR { 4119}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 43 and name HB2 ))
ASSI { 4121}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 39 and name HB1 ))
3.600 1.600 1.600 peak 4121 spectrum 1 weight .10000E+01 volume .11195E-02 ppm1 1.249 ppm2 1.820 CV 1
OR { 4121}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 70 and name HG ))
OR { 4121}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 41 and name HG12))
ASSI { 4122}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 41 and name HB ))
3.800 1.800 1.800 peak 4122 spectrum 1 weight .10000E+01 volume .90913E-03 ppm1 1.249 ppm2 2.054 CV 1
OR { 4122}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 60 and name HG ))
OR { 4122}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 60 and name HB2 ))
ASSI { 4124}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 66 and name HA ))
2.900 1.100 1.100 peak 4124 spectrum 1 weight .10000E+01 volume .23403E-02 ppm1 1.330 ppm2 4.210 CV 1
OR { 4124}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 39 and name HA ))
ASSI { 4128}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 41 and name HA ))
3.200 1.300 1.300 peak 4128 spectrum 1 weight .10000E+01 volume .19091E-02 ppm1 1.329 ppm2 3.585 CV 1
OR { 4128}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 67 and name HA1 ))
ASSI { 4132}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HN ))
3.300 1.300 1.300 peak 4132 spectrum 1 weight .10000E+01 volume .11325E-02 ppm1 4.173 ppm2 8.292 CV 1
OR { 4132}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 42 and name HN ))
ASSI { 4143}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 42 and name HN ))
3.400 1.500 1.500 peak 4143 spectrum 1 weight .10000E+01 volume .10208E-02 ppm1 4.333 ppm2 8.262 CV 1
OR { 4143}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 40 and name HN ))
ASSI { 4148}
(( segid " " and resid 38 and name HB2 ))
( segid " " and resid 41 and name HD1%)
4.100 2.100 1.900 peak 4148 spectrum 1 weight .10000E+01 volume .70911E-03 ppm1 2.628 ppm2 1.000 CV 1
OR { 4148}
(( segid " " and resid 38 and name HB2 ))
( segid " " and resid 37 and name HG1%)
ASSI { 4149}
(( segid " " and resid 38 and name HB1 ))
( segid " " and resid 37 and name HG1%)
4.100 2.100 1.900 peak 4149 spectrum 1 weight .10000E+01 volume .68835E-03 ppm1 2.438 ppm2 1.040 CV 1
OR { 4149}
(( segid " " and resid 38 and name HB1 ))
( segid " " and resid 41 and name HG2%)
ASSI { 4180}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HA ))
3.600 1.600 1.600 peak 4180 spectrum 1 weight .10000E+01 volume .73510E-03 ppm1 3.663 ppm2 4.396 CV 1
OR { 4180}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 68 and name HA ))
ASSI { 4193}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HD21))
3.300 1.400 1.400 peak 4193 spectrum 1 weight .10000E+01 volume .75848E-03 ppm1 2.776 ppm2 6.904 CV 1
OR { 4193}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HD21))
OR { 4193}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HD21))
OR { 4193}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HD21))
ASSI { 436}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 105 and name HA ))
2.300 .700 .700 peak 436 spectrum 1 weight .10000E+01 volume .10203E-01 ppm1 8.080 ppm2 4.256 CV 1
OR { 436}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 104 and name HA ))
ASSI { 448}
(( segid " " and resid 105 and name HN ))
( segid " " and resid 104 and name HD2%)
3.600 1.600 1.600 peak 448 spectrum 1 weight .10000E+01 volume .14644E-02 ppm1 8.089 ppm2 .866 CV 1
OR { 448}
(( segid " " and resid 89 and name HN ))
( segid " " and resid 86 and name HD1%)
OR { 448}
(( segid " " and resid 89 and name HN ))
( segid " " and resid 90 and name HD1%)
OR { 448}
(( segid " " and resid 89 and name HN ))
( segid " " and resid 90 and name HG2%)
ASSI { 471}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 103 and name HA ))
2.400 .700 .700 peak 471 spectrum 1 weight .10000E+01 volume .55664E-02 ppm1 7.869 ppm2 4.246 CV 1
OR { 471}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 104 and name HA ))
ASSI { 500}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 90 and name HN ))
3.900 1.900 1.900 peak 500 spectrum 1 weight .10000E+01 volume .46277E-03 ppm1 7.874 ppm2 8.355 CV 1
OR { 500}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 86 and name HN ))
ASSI { 505}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 99 and name HA ))
2.800 1.000 1.000 peak 505 spectrum 1 weight .10000E+01 volume .24920E-02 ppm1 8.001 ppm2 4.117 CV 1
OR { 505}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 98 and name HA ))
ASSI { 543}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 99 and name HA ))
2.700 .900 .900 peak 543 spectrum 1 weight .10000E+01 volume .28549E-02 ppm1 7.778 ppm2 4.118 CV 1
OR { 543}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 98 and name HA ))
ASSI { 571}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 99 and name HN ))
3.700 1.700 1.700 peak 571 spectrum 1 weight .10000E+01 volume .63224E-03 ppm1 8.361 ppm2 7.793 CV 1
OR { 571}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 95 and name HN ))
ASSI { 634}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 94 and name HN ))
2.700 .900 .900 peak 634 spectrum 1 weight .10000E+01 volume .23943E-02 ppm1 8.711 ppm2 8.444 CV 1
OR { 634}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HN ))
ASSI { 648}
(( segid " " and resid 93 and name HN ))
( segid " " and resid 90 and name HG2%)
3.700 1.700 1.700 peak 648 spectrum 1 weight .10000E+01 volume .71045E-03 ppm1 8.712 ppm2 .861 CV 1
OR { 648}
(( segid " " and resid 93 and name HN ))
( segid " " and resid 75 and name HD1%)
OR { 648}
(( segid " " and resid 93 and name HN ))
( segid " " and resid 94 and name HD1%)
OR { 648}
(( segid " " and resid 93 and name HN ))
( segid " " and resid 94 and name HG2%)
ASSI { 655}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 89 and name HA ))
3.400 1.400 1.400 peak 655 spectrum 1 weight .10000E+01 volume .10559E-02 ppm1 8.473 ppm2 4.068 CV 1
OR { 655}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 95 and name HA ))
ASSI { 656}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HA ))
3.000 1.100 1.100 peak 656 spectrum 1 weight .10000E+01 volume .17251E-02 ppm1 8.461 ppm2 3.922 CV 1
OR { 656}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 91 and name HA ))
ASSI { 669}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 92 and name HN ))
2.400 .700 .700 peak 669 spectrum 1 weight .10000E+01 volume .40346E-02 ppm1 7.310 ppm2 8.434 CV 1
OR { 669}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HN ))
ASSI { 683}
(( segid " " and resid 91 and name HN ))
( segid " " and resid 90 and name HD1%)
3.700 1.700 1.700 peak 683 spectrum 1 weight .10000E+01 volume .13145E-02 ppm1 7.315 ppm2 .829 CV 1
OR { 683}
(( segid " " and resid 91 and name HN ))
( segid " " and resid 94 and name HD1%)
ASSI { 696}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 86 and name HG ))
3.900 1.900 1.900 peak 696 spectrum 1 weight .10000E+01 volume .53228E-03 ppm1 8.396 ppm2 1.657 CV 1
OR { 696}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 88 and name HB1 ))
OR { 696}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 86 and name HB1 ))
OR { 696}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 88 and name HG1 ))
OR { 696}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 91 and name HG2 ))
ASSI { 705}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 86 and name HA ))
2.800 1.000 1.000 peak 705 spectrum 1 weight .10000E+01 volume .25768E-02 ppm1 8.094 ppm2 3.914 CV 1
OR { 705}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 88 and name HA ))
ASSI { 709}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 87 and name HB2 ))
3.000 3.000 3.000 peak 709 spectrum 1 weight .10000E+01 volume .81908E-03 ppm1 8.095 ppm2 2.932 CV 1
OR { 709}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 82 and name HB1 ))
OR { 709}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 88 and name HE2 ))
ASSI { 716}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 89 and name HN ))
2.300 .600 .600 peak 716 spectrum 1 weight .10000E+01 volume .66375E-02 ppm1 7.878 ppm2 8.078 CV 1
OR { 716}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HN ))
ASSI { 732}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HD2 ))
4.000 2.000 2.000 peak 732 spectrum 1 weight .10000E+01 volume .95380E-03 ppm1 7.878 ppm2 1.413 CV 1
OR { 732}
(( segid " " and resid 88 and name HN ))
( segid " " and resid 89 and name HB% )
OR { 732}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HD1 ))
ASSI { 748}
(( segid " " and resid 87 and name HN ))
( segid " " and resid 90 and name HD1%)
3.700 1.700 1.700 peak 748 spectrum 1 weight .10000E+01 volume .12167E-02 ppm1 8.109 ppm2 .874 CV 1
OR { 748}
(( segid " " and resid 87 and name HN ))
( segid " " and resid 86 and name HD2%)
OR { 748}
(( segid " " and resid 87 and name HN ))
( segid " " and resid 86 and name HD1%)
ASSI { 788}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HB2 ))
4.000 2.000 2.000 peak 788 spectrum 1 weight .10000E+01 volume .65832E-03 ppm1 8.538 ppm2 3.049 CV 1
OR { 788}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 85 and name HB2 ))
ASSI { 792}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 79 and name HG1 ))
4.100 2.100 1.900 peak 792 spectrum 1 weight .10000E+01 volume .51275E-03 ppm1 8.545 ppm2 1.892 CV 1
OR { 792}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 88 and name HB2 ))
ASSI { 794}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 85 and name HN ))
3.200 1.300 1.300 peak 794 spectrum 1 weight .10000E+01 volume .34827E-02 ppm1 8.133 ppm2 7.273 CV 1
OR { 794}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HN ))
ASSI { 797}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HA ))
2.100 .500 .500 peak 797 spectrum 1 weight .10000E+01 volume .14179E-01 ppm1 8.133 ppm2 4.434 CV 1
OR { 797}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HA ))
ASSI { 815}
(( segid " " and resid 82 and name HN ))
( segid " " and resid 81 and name HD1%)
3.300 1.400 1.400 peak 815 spectrum 1 weight .10000E+01 volume .47581E-03 ppm1 7.279 ppm2 .812 CV 1
OR { 815}
(( segid " " and resid 82 and name HN ))
( segid " " and resid 86 and name HD1%)
OR { 815}
(( segid " " and resid 82 and name HN ))
( segid " " and resid 75 and name HD1%)
ASSI { 821}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HA ))
2.400 .700 .700 peak 821 spectrum 1 weight .10000E+01 volume .61355E-02 ppm1 8.303 ppm2 4.400 CV 1
OR { 821}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 77 and name HA ))
ASSI { 839}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 76 and name HA ))
2.900 1.100 1.100 peak 839 spectrum 1 weight .10000E+01 volume .22530E-02 ppm1 8.917 ppm2 3.939 CV 1
OR { 839}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 75 and name HA ))
ASSI { 848}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 75 and name HD1%)
3.500 1.500 1.500 peak 848 spectrum 1 weight .10000E+01 volume .10016E-02 ppm1 8.921 ppm2 .865 CV 1
OR { 848}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 75 and name HD2%)
OR { 848}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 81 and name HD2%)
OR { 848}
(( segid " " and resid 79 and name HN ))
( segid " " and resid 86 and name HD1%)
ASSI { 861}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 81 and name HB2 ))
4.700 2.700 1.300 peak 861 spectrum 1 weight .10000E+01 volume .33676E-03 ppm1 8.067 ppm2 1.896 CV 1
OR { 861}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 79 and name HB1 ))
OR { 861}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 79 and name HG1 ))
ASSI { 864}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 89 and name HB% )
3.400 1.500 1.500 peak 864 spectrum 1 weight .10000E+01 volume .12471E-02 ppm1 8.069 ppm2 1.376 CV 1
OR { 864}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 81 and name HB1 ))
ASSI { 865}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 75 and name HD2%)
3.300 1.400 1.400 peak 865 spectrum 1 weight .10000E+01 volume .12754E-02 ppm1 8.072 ppm2 .856 CV 1
OR { 865}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 75 and name HD1%)
OR { 865}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 81 and name HD2%)
OR { 865}
(( segid " " and resid 78 and name HN ))
( segid " " and resid 81 and name HD1%)
ASSI { 886}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HA ))
3.100 1.200 1.200 peak 886 spectrum 1 weight .10000E+01 volume .14883E-02 ppm1 8.806 ppm2 3.942 CV 1
OR { 886}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HA ))
ASSI { 916}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 70 and name HA ))
3.500 1.600 1.600 peak 916 spectrum 1 weight .10000E+01 volume .65832E-03 ppm1 7.195 ppm2 4.023 CV 1
OR { 916}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 71 and name HA ))
ASSI { 949}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 65 and name HG2%)
3.400 1.400 1.400 peak 949 spectrum 1 weight .10000E+01 volume .64092E-03 ppm1 7.484 ppm2 .882 CV 1
OR { 949}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 69 and name HD1%)
ASSI { 954}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HA ))
2.700 .900 .900 peak 954 spectrum 1 weight .10000E+01 volume .26572E-02 ppm1 7.551 ppm2 4.349 CV 1
OR { 954}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HA ))
ASSI { 958}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HB1 ))
2.800 1.000 1.000 peak 958 spectrum 1 weight .10000E+01 volume .24008E-02 ppm1 7.550 ppm2 1.681 CV 1
OR { 958}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 70 and name HB2 ))
ASSI { 968}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 69 and name HN ))
2.700 .900 .900 peak 968 spectrum 1 weight .10000E+01 volume .22074E-02 ppm1 8.296 ppm2 7.519 CV 1
OR { 968}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 70 and name HN ))
ASSI { 1015}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 62 and name HA ))
2.800 2.800 3.200 peak 1015 spectrum 1 weight .10000E+01 volume .12949E-02 ppm1 7.942 ppm2 4.063 CV 1
OR { 1015}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 61 and name HA ))
OR { 1015}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 81 and name HA ))
ASSI { 1023}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 37 and name HG2%)
3.500 1.500 1.500 peak 1023 spectrum 1 weight .10000E+01 volume .86908E-03 ppm1 7.942 ppm2 1.064 CV 1
OR { 1023}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 69 and name HD2%)
ASSI { 1028}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HA ))
3.200 1.300 1.300 peak 1028 spectrum 1 weight .10000E+01 volume .12666E-02 ppm1 7.571 ppm2 4.063 CV 1
OR { 1028}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 61 and name HA ))
ASSI { 1040}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HA ))
2.700 .900 .900 peak 1040 spectrum 1 weight .10000E+01 volume .30569E-02 ppm1 8.618 ppm2 4.061 CV 1
OR { 1040}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HA ))
ASSI { 1053}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HB1 ))
3.900 1.900 1.900 peak 1053 spectrum 1 weight .10000E+01 volume .42149E-03 ppm1 8.624 ppm2 1.897 CV 1
OR { 1053}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HG2 ))
OR { 1053}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 59 and name HG1 ))
OR { 1053}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 61 and name HB2 ))
ASSI { 1072}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HG1 ))
3.600 1.600 1.600 peak 1072 spectrum 1 weight .10000E+01 volume .19815E-02 ppm1 7.584 ppm2 2.324 CV 1
OR { 1072}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HG2 ))
OR { 1072}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 59 and name HB2 ))
ASSI { 1111}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 50 and name HB ))
3.300 1.400 1.400 peak 1111 spectrum 1 weight .10000E+01 volume .10320E-02 ppm1 7.780 ppm2 2.266 CV 1
OR { 1111}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 51 and name HG1 ))
ASSI { 1122}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HG1 ))
3.500 1.500 1.500 peak 1122 spectrum 1 weight .10000E+01 volume .97989E-03 ppm1 7.014 ppm2 2.228 CV 1
OR { 1122}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 51 and name HB2 ))
OR { 1122}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 51 and name HG1 ))
ASSI { 1145}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HB ))
2.100 .500 .500 peak 1145 spectrum 1 weight .10000E+01 volume .58095E-02 ppm1 8.445 ppm2 2.261 CV 1
OR { 1145}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HG1 ))
ASSI { 1180}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HA ))
3.600 1.700 1.700 peak 1180 spectrum 1 weight .10000E+01 volume .76479E-03 ppm1 8.063 ppm2 4.208 CV 1
OR { 1180}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HA ))
ASSI { 1190}
(( segid " " and resid 66 and name HN ))
( segid " " and resid 69 and name HD2%)
3.500 1.600 1.600 peak 1190 spectrum 1 weight .10000E+01 volume .11928E-02 ppm1 6.533 ppm2 1.092 CV 1
OR { 1190}
(( segid " " and resid 66 and name HN ))
( segid " " and resid 66 and name HG2%)
ASSI { 1222}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 40 and name HA ))
3.500 1.600 1.600 peak 1222 spectrum 1 weight .10000E+01 volume .69526E-03 ppm1 9.027 ppm2 3.794 CV 1
OR { 1222}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 42 and name HA ))
ASSI { 1235}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HB ))
2.400 .700 .700 peak 1235 spectrum 1 weight .10000E+01 volume .49712E-02 ppm1 8.131 ppm2 4.200 CV 1
OR { 1235}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HA ))
ASSI { 1237}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 42 and name HA ))
3.000 1.100 1.100 peak 1237 spectrum 1 weight .10000E+01 volume .19771E-02 ppm1 8.131 ppm2 3.795 CV 1
OR { 1237}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 40 and name HA ))
ASSI { 1246}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB ))
2.200 .600 .600 peak 1246 spectrum 1 weight .10000E+01 volume .92796E-02 ppm1 8.319 ppm2 4.209 CV 1
OR { 1246}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 39 and name HA ))
ASSI { 1257}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 42 and name HG2%)
3.300 1.400 1.400 peak 1257 spectrum 1 weight .10000E+01 volume .28527E-02 ppm1 8.319 ppm2 1.190 CV 1
OR { 1257}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HG11))
ASSI { 1268}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 37 and name HA ))
3.700 1.700 1.700 peak 1268 spectrum 1 weight .10000E+01 volume .67568E-03 ppm1 8.530 ppm2 4.172 CV 1
OR { 1268}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 39 and name HA ))
OR { 1268}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HB ))
ASSI { 1278}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HG11))
2.500 .800 .800 peak 1278 spectrum 1 weight .10000E+01 volume .29461E-02 ppm1 8.529 ppm2 1.231 CV 1
OR { 1278}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 40 and name HG1%)
ASSI { 1281}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 60 and name HD1%)
3.700 1.700 1.700 peak 1281 spectrum 1 weight .10000E+01 volume .10255E-02 ppm1 8.531 ppm2 .818 CV 1
OR { 1281}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 45 and name HD1%)
OR { 1281}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 45 and name HG11))
ASSI { 1289}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
2.900 1.000 1.000 peak 1289 spectrum 1 weight .10000E+01 volume .23747E-02 ppm1 8.252 ppm2 4.162 CV 1
OR { 1289}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 37 and name HA ))
ASSI { 1292}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 35 and name HB2 ))
3.600 1.700 1.700 peak 1292 spectrum 1 weight .10000E+01 volume .84083E-03 ppm1 8.254 ppm2 3.378 CV 1
OR { 1292}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 78 and name HB2 ))
OR { 1292}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 35 and name HB1 ))
ASSI { 1296}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HB ))
2.400 .700 .700 peak 1296 spectrum 1 weight .10000E+01 volume .52316E-02 ppm1 8.254 ppm2 2.729 CV 1
OR { 1296}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HB1 ))
ASSI { 1301}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HB1 ))
2.700 .900 .900 peak 1301 spectrum 1 weight .10000E+01 volume .26311E-02 ppm1 8.271 ppm2 1.856 CV 1
OR { 1301}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HB1 ))
OR { 1301}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HG1 ))
ASSI { 1302}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HB1 ))
2.400 .700 .700 peak 1302 spectrum 1 weight .10000E+01 volume .54707E-02 ppm1 8.255 ppm2 1.342 CV 1
OR { 1302}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 40 and name HG2%)
ASSI { 1315}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HA ))
2.800 1.000 1.000 peak 1315 spectrum 1 weight .10000E+01 volume .28614E-02 ppm1 7.571 ppm2 4.168 CV 1
OR { 1315}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 36 and name HB1 ))
ASSI { 1327}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HA ))
3.000 1.100 1.100 peak 1327 spectrum 1 weight .10000E+01 volume .20575E-02 ppm1 7.764 ppm2 4.165 CV 1
OR { 1327}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 36 and name HB1 ))
ASSI { 1344}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HA ))
2.600 .800 .800 peak 1344 spectrum 1 weight .10000E+01 volume .38434E-02 ppm1 9.056 ppm2 4.166 CV 1
OR { 1344}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HB1 ))
ASSI { 1351}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 68 and name HN ))
3.600 1.600 1.600 peak 1351 spectrum 1 weight .10000E+01 volume .71913E-03 ppm1 7.745 ppm2 8.257 CV 1
OR { 1351}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 40 and name HN ))
ASSI { 1375}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 62 and name HN ))
2.600 .800 .800 peak 1375 spectrum 1 weight .10000E+01 volume .30417E-02 ppm1 7.432 ppm2 8.596 CV 1
OR { 1375}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HN ))
ASSI { 1379}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HA ))
2.700 .900 .900 peak 1379 spectrum 1 weight .10000E+01 volume .29874E-02 ppm1 7.427 ppm2 4.067 CV 1
OR { 1379}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 58 and name HA ))
ASSI { 1429}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA ))
2.500 .800 .800 peak 1429 spectrum 1 weight .10000E+01 volume .47907E-02 ppm1 8.414 ppm2 4.675 CV 1
OR { 1429}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HA ))
ASSI { 1431}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB2 ))
3.200 1.300 1.300 peak 1431 spectrum 1 weight .10000E+01 volume .15817E-02 ppm1 8.415 ppm2 2.815 CV 1
OR { 1431}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB1 ))
OR { 1431}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB1 ))
ASSI { 1464}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 31 and name HA ))
3.000 3.000 3.000 peak 1464 spectrum 1 weight .10000E+01 volume .72568E-03 ppm1 9.800 ppm2 4.308 CV 1
OR { 1464}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 30 and name HA ))
ASSI { 1465}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 29 and name HB1 ))
2.900 1.000 1.000 peak 1465 spectrum 1 weight .10000E+01 volume .10212E-02 ppm1 9.804 ppm2 2.819 CV 1
OR { 1465}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 29 and name HB2 ))
OR { 1465}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 43 and name HB1 ))
ASSI { 1467}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 39 and name HB1 ))
3.000 1.100 1.100 peak 1467 spectrum 1 weight .10000E+01 volume .12232E-02 ppm1 9.805 ppm2 1.928 CV 1
OR { 1467}
(( segid " " and resid 35 and name HE1 ))
( segid " " and resid 99 and name HE% )
ASSI { 2605}
(( segid " " and resid 63 and name HD22))
( segid " " and resid 65 and name HD1%)
2.700 2.700 3.300 peak 2605 spectrum 1 weight .10000E+01 volume .13297E-02 ppm1 7.651 ppm2 .775 CV 1
OR { 2605}
(( segid " " and resid 63 and name HD22))
( segid " " and resid 81 and name HD1%)
ASSI { 488}
(( segid " " and resid 39 and name HB1 ))
(( segid " " and resid 40 and name HN ))
3.800 1.800 1.800 peak 488 spectrum 1 weight .10000E+01 volume .51951E-03 ppm1 1.854 ppm2 8.248 CV 1
ASSI { 490}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 43 and name HE1 ))
3.000 1.100 1.100 peak 490 spectrum 1 weight .10000E+01 volume .20260E-02 ppm1 .962 ppm2 10.139 CV 1
ASSI { 542}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 97 and name HD22))
4.100 2.100 1.900 peak 542 spectrum 1 weight .10000E+01 volume .75586E-03 ppm1 2.830 ppm2 7.488 CV 1
ASSI { 635}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HB ))
2.700 .900 .900 peak 635 spectrum 1 weight .10000E+01 volume .30988E-02 ppm1 3.688 ppm2 2.016 CV 1
ASSI { 650}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HB2 ))
2.500 .800 .800 peak 650 spectrum 1 weight .10000E+01 volume .41378E-02 ppm1 3.792 ppm2 2.071 CV 1
OR { 650}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HB1 ))
ASSI { 661}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HE2 ))
3.800 1.800 1.800 peak 661 spectrum 1 weight .10000E+01 volume .12156E-02 ppm1 3.867 ppm2 2.924 CV 1
ASSI { 688}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 60 and name HN ))
3.500 1.600 1.600 peak 688 spectrum 1 weight .10000E+01 volume .14961E-02 ppm1 .858 ppm2 8.581 CV 1
ASSI { 747}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 32 and name HB1 ))
3.000 1.100 1.100 peak 747 spectrum 1 weight .10000E+01 volume .13949E-02 ppm1 6.568 ppm2 1.636 CV 1
ASSI { 807}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 60 and name HA ))
3.300 1.300 1.300 peak 807 spectrum 1 weight .10000E+01 volume .22468E-02 ppm1 .858 ppm2 4.015 CV 1
ASSI { 833}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB2 ))
2.800 1.000 1.000 peak 833 spectrum 1 weight .10000E+01 volume .21845E-02 ppm1 3.563 ppm2 2.194 CV 1
ASSI { 903}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 74 and name HN ))
4.200 2.200 1.800 peak 903 spectrum 1 weight .10000E+01 volume .90913E-03 ppm1 .807 ppm2 9.281 CV 1
ASSI { 905}
(( segid " " and resid 73 and name HB2 ))
(( segid " " and resid 73 and name HN ))
2.800 1.000 1.000 peak 905 spectrum 1 weight .10000E+01 volume .15481E-02 ppm1 1.726 ppm2 7.190 CV 1
ASSI { 994}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 67 and name HA2 ))
2.300 .600 .600 peak 994 spectrum 1 weight .10000E+01 volume .29429E-02 ppm1 3.571 ppm2 4.601 CV 1
ASSI { 1083}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HN ))
3.400 1.500 1.500 peak 1083 spectrum 1 weight .10000E+01 volume .67534E-03 ppm1 3.820 ppm2 7.120 CV 1
ASSI { 1119}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 99 and name HG2 ))
2.900 1.100 1.100 peak 1119 spectrum 1 weight .10000E+01 volume .21871E-02 ppm1 1.925 ppm2 2.252 CV 1
OR { 1119}
( segid " " and resid 99 and name HE% )
(( segid " " and resid 99 and name HG1 ))
ASSI { 1153}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HN ))
3.300 1.400 1.400 peak 1153 spectrum 1 weight .10000E+01 volume .89872E-03 ppm1 2.842 ppm2 8.408 CV 1
ASSI { 1159}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HN ))
2.600 .800 .800 peak 1159 spectrum 1 weight .10000E+01 volume .39975E-02 ppm1 4.040 ppm2 7.237 CV 1
ASSI { 1175}
(( segid " " and resid 106 and name HD1 ))
(( segid " " and resid 106 and name HA ))
3.300 1.400 1.400 peak 1175 spectrum 1 weight .10000E+01 volume .16052E-02 ppm1 7.180 ppm2 4.678 CV 1
ASSI { 1177}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 26 and name HD2 ))
3.500 1.500 1.500 peak 1177 spectrum 1 weight .10000E+01 volume .70132E-03 ppm1 3.104 ppm2 7.176 CV 1
ASSI { 1274}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HA ))
3.200 1.300 1.300 peak 1274 spectrum 1 weight .10000E+01 volume .10000E-02 ppm1 2.206 ppm2 4.058 CV 1
ASSI { 1397}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HN ))
2.800 1.000 1.000 peak 1397 spectrum 1 weight .10000E+01 volume .19195E-02 ppm1 4.064 ppm2 7.452 CV 1
ASSI { 1447}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB2 ))
2.800 1.000 1.000 peak 1447 spectrum 1 weight .10000E+01 volume .32832E-02 ppm1 4.362 ppm2 2.669 CV 1
ASSI { 1729}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 107 and name HA ))
2.700 .900 .900 peak 1729 spectrum 1 weight .10000E+01 volume .29637E-02 ppm1 1.750 ppm2 4.324 CV 1
ASSI { 1730}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 107 and name HA ))
2.700 .900 .900 peak 1730 spectrum 1 weight .10000E+01 volume .24312E-02 ppm1 1.599 ppm2 4.321 CV 1
ASSI { 1734}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 106 and name HA ))
2.600 .900 .900 peak 1734 spectrum 1 weight .10000E+01 volume .60290E-02 ppm1 3.256 ppm2 4.671 CV 1
ASSI { 1736}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 106 and name HN ))
3.000 1.100 1.100 peak 1736 spectrum 1 weight .10000E+01 volume .20624E-02 ppm1 3.256 ppm2 8.041 CV 1
ASSI { 1737}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 106 and name HN ))
3.400 1.400 1.400 peak 1737 spectrum 1 weight .10000E+01 volume .18442E-02 ppm1 3.226 ppm2 8.043 CV 1
ASSI { 1740}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 106 and name HE3 ))
3.000 1.200 1.200 peak 1740 spectrum 1 weight .10000E+01 volume .14494E-02 ppm1 3.225 ppm2 7.638 CV 1
ASSI { 1741}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 106 and name HE3 ))
3.100 1.200 1.200 peak 1741 spectrum 1 weight .10000E+01 volume .14494E-02 ppm1 3.253 ppm2 7.633 CV 1
ASSI { 1742}
(( segid " " and resid 106 and name HD1 ))
(( segid " " and resid 106 and name HB2 ))
2.600 .900 .900 peak 1742 spectrum 1 weight .10000E+01 volume .42832E-02 ppm1 7.181 ppm2 3.261 CV 1
OR { 1742}
(( segid " " and resid 106 and name HD1 ))
(( segid " " and resid 106 and name HB1 ))
ASSI { 1743}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 106 and name HD1 ))
3.200 1.300 1.300 peak 1743 spectrum 1 weight .10000E+01 volume .14624E-02 ppm1 3.222 ppm2 7.191 CV 1
ASSI { 1744}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 106 and name HD1 ))
3.100 1.200 1.200 peak 1744 spectrum 1 weight .10000E+01 volume .14208E-02 ppm1 3.252 ppm2 7.202 CV 1
ASSI { 1746}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HG1 ))
2.500 .800 .800 peak 1746 spectrum 1 weight .10000E+01 volume .45066E-02 ppm1 4.237 ppm2 1.396 CV 1
OR { 1746}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HG2 ))
ASSI { 1748}
(( segid " " and resid 105 and name HG2 ))
(( segid " " and resid 105 and name HA ))
3.100 1.200 1.200 peak 1748 spectrum 1 weight .10000E+01 volume .16753E-02 ppm1 2.207 ppm2 4.274 CV 1
ASSI { 1752}
(( segid " " and resid 101 and name HB1 ))
(( segid " " and resid 101 and name HA ))
2.600 .900 .900 peak 1752 spectrum 1 weight .10000E+01 volume .44780E-02 ppm1 2.694 ppm2 4.605 CV 1
ASSI { 1753}
(( segid " " and resid 101 and name HB2 ))
(( segid " " and resid 101 and name HA ))
2.700 .900 .900 peak 1753 spectrum 1 weight .10000E+01 volume .34182E-02 ppm1 2.774 ppm2 4.598 CV 1
ASSI { 1767}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HN ))
2.500 .800 .800 peak 1767 spectrum 1 weight .10000E+01 volume .28468E-02 ppm1 2.720 ppm2 8.279 CV 1
ASSI { 1768}
(( segid " " and resid 100 and name HG1 ))
(( segid " " and resid 100 and name HN ))
4.300 2.300 1.700 peak 1768 spectrum 1 weight .10000E+01 volume .89611E-03 ppm1 1.517 ppm2 8.065 CV 1
ASSI { 1770}
(( segid " " and resid 98 and name HB1 ))
(( segid " " and resid 98 and name HA ))
2.300 .600 .600 peak 1770 spectrum 1 weight .10000E+01 volume .82160E-02 ppm1 1.963 ppm2 4.135 CV 1
OR { 1770}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 98 and name HA ))
ASSI { 1796}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 95 and name HA ))
3.300 1.400 1.400 peak 1796 spectrum 1 weight .10000E+01 volume .90913E-03 ppm1 2.085 ppm2 4.078 CV 1
ASSI { 1798}
(( segid " " and resid 95 and name HB1 ))
(( segid " " and resid 95 and name HA ))
2.800 1.000 1.000 peak 1798 spectrum 1 weight .10000E+01 volume .18987E-02 ppm1 1.722 ppm2 4.086 CV 1
ASSI { 1810}
(( segid " " and resid 94 and name HG11))
(( segid " " and resid 94 and name HB ))
2.700 .900 .900 peak 1810 spectrum 1 weight .10000E+01 volume .20546E-02 ppm1 1.147 ppm2 2.016 CV 1
ASSI { 1816}
(( segid " " and resid 94 and name HB ))
( segid " " and resid 94 and name HG2%)
2.100 .600 .600 peak 1816 spectrum 1 weight .10000E+01 volume .92002E-02 ppm1 2.005 ppm2 .926 CV 1
ASSI { 1830}
(( segid " " and resid 93 and name HB1 ))
(( segid " " and resid 93 and name HE1 ))
4.100 2.100 1.900 peak 1830 spectrum 1 weight .10000E+01 volume .45716E-03 ppm1 2.047 ppm2 2.932 CV 1
OR { 1830}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HE1 ))
ASSI { 1843}
(( segid " " and resid 92 and name HB1 ))
(( segid " " and resid 92 and name HA ))
3.000 1.200 1.200 peak 1843 spectrum 1 weight .10000E+01 volume .21169E-02 ppm1 3.142 ppm2 4.453 CV 1
ASSI { 1857}
(( segid " " and resid 91 and name HE2 ))
(( segid " " and resid 91 and name HA ))
3.500 1.600 1.600 peak 1857 spectrum 1 weight .10000E+01 volume .12286E-02 ppm1 2.915 ppm2 3.902 CV 1
OR { 1857}
(( segid " " and resid 91 and name HE1 ))
(( segid " " and resid 91 and name HA ))
ASSI { 1862}
(( segid " " and resid 91 and name HD1 ))
(( segid " " and resid 91 and name HE2 ))
2.200 .600 .600 peak 1862 spectrum 1 weight .10000E+01 volume .90000E-02 ppm1 1.656 ppm2 2.939 CV 1
OR { 1862}
(( segid " " and resid 91 and name HD2 ))
(( segid " " and resid 91 and name HE1 ))
OR { 1862}
(( segid " " and resid 91 and name HD1 ))
(( segid " " and resid 91 and name HE1 ))
OR { 1862}
(( segid " " and resid 91 and name HD2 ))
(( segid " " and resid 91 and name HE2 ))
ASSI { 1863}
(( segid " " and resid 90 and name HB ))
(( segid " " and resid 90 and name HA ))
3.000 1.100 1.100 peak 1863 spectrum 1 weight .10000E+01 volume .18312E-02 ppm1 1.904 ppm2 3.664 CV 1
ASSI { 1876}
(( segid " " and resid 90 and name HG11))
(( segid " " and resid 90 and name HB ))
2.100 .600 .600 peak 1876 spectrum 1 weight .10000E+01 volume .87821E-02 ppm1 1.089 ppm2 1.873 CV 1
ASSI { 1902}
(( segid " " and resid 86 and name HB2 ))
(( segid " " and resid 86 and name HA ))
2.600 .800 .800 peak 1902 spectrum 1 weight .10000E+01 volume .27663E-02 ppm1 1.730 ppm2 3.952 CV 1
ASSI { 1904}
(( segid " " and resid 86 and name HB1 ))
(( segid " " and resid 86 and name HA ))
2.800 1.000 1.000 peak 1904 spectrum 1 weight .10000E+01 volume .27195E-02 ppm1 1.604 ppm2 3.948 CV 1
ASSI { 1918}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HA ))
2.900 1.100 1.100 peak 1918 spectrum 1 weight .10000E+01 volume .18572E-02 ppm1 3.077 ppm2 4.645 CV 1
ASSI { 1920}
(( segid " " and resid 85 and name HB1 ))
(( segid " " and resid 85 and name HA ))
2.500 .800 .800 peak 1920 spectrum 1 weight .10000E+01 volume .44780E-02 ppm1 2.676 ppm2 4.631 CV 1
ASSI { 1921}
(( segid " " and resid 84 and name HA2 ))
(( segid " " and resid 84 and name HA1 ))
2.000 .500 .500 peak 1921 spectrum 1 weight .10000E+01 volume .87559E-02 ppm1 4.272 ppm2 3.560 CV 1
ASSI { 1928}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 83 and name HA ))
2.700 .900 .900 peak 1928 spectrum 1 weight .10000E+01 volume .37559E-02 ppm1 2.465 ppm2 4.441 CV 1
ASSI { 1930}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HA ))
2.700 .900 .900 peak 1930 spectrum 1 weight .10000E+01 volume .38416E-02 ppm1 3.039 ppm2 4.446 CV 1
ASSI { 1934}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 82 and name HA ))
2.900 1.000 1.000 peak 1934 spectrum 1 weight .10000E+01 volume .18962E-02 ppm1 3.221 ppm2 4.459 CV 1
ASSI { 1964}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HA ))
2.400 .700 .700 peak 1964 spectrum 1 weight .10000E+01 volume .66133E-02 ppm1 2.160 ppm2 4.042 CV 1
OR { 1964}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 58 and name HA ))
ASSI { 1966}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 76 and name HA ))
2.900 1.000 1.000 peak 1966 spectrum 1 weight .10000E+01 volume .16728E-02 ppm1 2.425 ppm2 3.965 CV 1
ASSI { 1973}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name HA ))
3.000 1.200 1.200 peak 1973 spectrum 1 weight .10000E+01 volume .13767E-02 ppm1 1.876 ppm2 3.955 CV 1
ASSI { 1976}
(( segid " " and resid 75 and name HB1 ))
(( segid " " and resid 75 and name HA ))
3.000 1.100 1.100 peak 1976 spectrum 1 weight .10000E+01 volume .16624E-02 ppm1 1.533 ppm2 3.959 CV 1
ASSI { 1988}
(( segid " " and resid 73 and name HB2 ))
(( segid " " and resid 73 and name HA ))
3.100 1.200 1.200 peak 1988 spectrum 1 weight .10000E+01 volume .17507E-02 ppm1 1.725 ppm2 4.481 CV 1
ASSI { 1990}
(( segid " " and resid 73 and name HB1 ))
(( segid " " and resid 73 and name HA ))
2.800 1.000 1.000 peak 1990 spectrum 1 weight .10000E+01 volume .17585E-02 ppm1 1.359 ppm2 4.489 CV 1
ASSI { 2001}
(( segid " " and resid 72 and name HG2 ))
(( segid " " and resid 72 and name HA ))
2.800 1.000 1.000 peak 2001 spectrum 1 weight .10000E+01 volume .29767E-02 ppm1 2.321 ppm2 4.316 CV 1
ASSI { 2003}
(( segid " " and resid 72 and name HG1 ))
(( segid " " and resid 72 and name HA ))
3.000 1.100 1.100 peak 2003 spectrum 1 weight .10000E+01 volume .27949E-02 ppm1 2.157 ppm2 4.315 CV 1
ASSI { 2012}
(( segid " " and resid 71 and name HB1 ))
(( segid " " and resid 71 and name HA ))
2.500 .800 .800 peak 2012 spectrum 1 weight .10000E+01 volume .33534E-02 ppm1 1.769 ppm2 4.087 CV 1
ASSI { 2017}
(( segid " " and resid 71 and name HD2 ))
(( segid " " and resid 71 and name HA ))
3.800 1.800 1.800 peak 2017 spectrum 1 weight .10000E+01 volume .69615E-03 ppm1 3.550 ppm2 4.046 CV 1
ASSI { 2019}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 71 and name HA ))
3.400 1.500 1.500 peak 2019 spectrum 1 weight .10000E+01 volume .94808E-03 ppm1 3.437 ppm2 4.044 CV 1
ASSI { 2023}
(( segid " " and resid 71 and name HG1 ))
(( segid " " and resid 71 and name HA ))
3.800 1.800 1.800 peak 2023 spectrum 1 weight .10000E+01 volume .84157E-03 ppm1 1.494 ppm2 4.082 CV 1
ASSI { 2026}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 71 and name HA ))
3.600 1.600 1.600 peak 2026 spectrum 1 weight .10000E+01 volume .18468E-02 ppm1 1.985 ppm2 4.082 CV 1
ASSI { 2052}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 68 and name HN ))
3.100 1.200 1.200 peak 2052 spectrum 1 weight .10000E+01 volume .20910E-02 ppm1 2.557 ppm2 8.283 CV 1
ASSI { 2093}
(( segid " " and resid 58 and name HG2 ))
(( segid " " and resid 58 and name HA ))
2.700 .900 .900 peak 2093 spectrum 1 weight .10000E+01 volume .25637E-02 ppm1 2.345 ppm2 4.056 CV 1
ASSI { 2094}
(( segid " " and resid 58 and name HG1 ))
(( segid " " and resid 58 and name HA ))
3.000 1.100 1.100 peak 2094 spectrum 1 weight .10000E+01 volume .20702E-02 ppm1 2.301 ppm2 4.059 CV 1
ASSI { 2102}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HA ))
2.700 .900 .900 peak 2102 spectrum 1 weight .10000E+01 volume .18338E-02 ppm1 1.714 ppm2 4.346 CV 1
ASSI { 2106}
(( segid " " and resid 56 and name HG ))
( segid " " and resid 56 and name HD1%)
2.900 1.000 1.000 peak 2106 spectrum 1 weight .10000E+01 volume .17221E-02 ppm1 1.208 ppm2 .266 CV 1
ASSI { 2125}
(( segid " " and resid 56 and name HB2 ))
( segid " " and resid 56 and name HD2%)
3.000 1.200 1.200 peak 2125 spectrum 1 weight .10000E+01 volume .23897E-02 ppm1 1.712 ppm2 .582 CV 1
ASSI { 2127}
(( segid " " and resid 56 and name HB2 ))
( segid " " and resid 56 and name HD1%)
2.600 .800 .800 peak 2127 spectrum 1 weight .10000E+01 volume .29429E-02 ppm1 1.715 ppm2 .264 CV 1
ASSI { 2131}
(( segid " " and resid 56 and name HB1 ))
( segid " " and resid 56 and name HD1%)
3.400 1.400 1.400 peak 2131 spectrum 1 weight .10000E+01 volume .15065E-02 ppm1 1.333 ppm2 .267 CV 1
ASSI { 2134}
(( segid " " and resid 55 and name HD2 ))
(( segid " " and resid 55 and name HA ))
3.800 1.800 1.800 peak 2134 spectrum 1 weight .10000E+01 volume .72208E-03 ppm1 3.887 ppm2 4.256 CV 1
ASSI { 2135}
(( segid " " and resid 55 and name HD1 ))
(( segid " " and resid 55 and name HA ))
3.500 1.500 1.500 peak 2135 spectrum 1 weight .10000E+01 volume .73767E-03 ppm1 3.659 ppm2 4.265 CV 1
ASSI { 2140}
(( segid " " and resid 55 and name HD1 ))
(( segid " " and resid 55 and name HD2 ))
1.800 .400 .400 peak 2140 spectrum 1 weight .10000E+01 volume .98911E-02 ppm1 3.657 ppm2 3.910 CV 1
ASSI { 2146}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HA ))
2.600 .800 .800 peak 2146 spectrum 1 weight .10000E+01 volume .64027E-02 ppm1 2.365 ppm2 4.257 CV 1
ASSI { 2149}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 55 and name HA ))
2.400 .700 .700 peak 2149 spectrum 1 weight .10000E+01 volume .38235E-02 ppm1 1.983 ppm2 4.251 CV 1
ASSI { 2151}
(( segid " " and resid 55 and name HG1 ))
(( segid " " and resid 55 and name HA ))
3.400 1.500 1.500 peak 2151 spectrum 1 weight .10000E+01 volume .17533E-02 ppm1 2.029 ppm2 4.259 CV 1
ASSI { 2152}
(( segid " " and resid 55 and name HG2 ))
(( segid " " and resid 55 and name HA ))
3.500 1.500 1.500 peak 2152 spectrum 1 weight .10000E+01 volume .22157E-02 ppm1 2.120 ppm2 4.254 CV 1
ASSI { 2153}
(( segid " " and resid 55 and name HG2 ))
(( segid " " and resid 55 and name HD1 ))
3.000 1.100 1.100 peak 2153 spectrum 1 weight .10000E+01 volume .27949E-02 ppm1 2.117 ppm2 3.678 CV 1
ASSI { 2154}
(( segid " " and resid 55 and name HG2 ))
(( segid " " and resid 55 and name HD2 ))
2.500 .800 .800 peak 2154 spectrum 1 weight .10000E+01 volume .28131E-02 ppm1 2.117 ppm2 3.911 CV 1
ASSI { 2155}
(( segid " " and resid 55 and name HG1 ))
(( segid " " and resid 55 and name HD1 ))
2.600 .800 .800 peak 2155 spectrum 1 weight .10000E+01 volume .21715E-02 ppm1 2.029 ppm2 3.678 CV 1
ASSI { 2157}
(( segid " " and resid 55 and name HD2 ))
(( segid " " and resid 55 and name HB2 ))
3.600 1.600 1.600 peak 2157 spectrum 1 weight .10000E+01 volume .12000E-02 ppm1 3.893 ppm2 2.388 CV 1
ASSI { 2170}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HD1 ))
3.900 1.900 1.900 peak 2170 spectrum 1 weight .10000E+01 volume .11013E-02 ppm1 2.365 ppm2 3.678 CV 1
ASSI { 2171}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 55 and name HD2 ))
3.500 1.500 1.500 peak 2171 spectrum 1 weight .10000E+01 volume .21741E-02 ppm1 1.980 ppm2 3.912 CV 1
ASSI { 2173}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 55 and name HD1 ))
3.300 1.300 1.300 peak 2173 spectrum 1 weight .10000E+01 volume .15039E-02 ppm1 1.992 ppm2 3.684 CV 1
ASSI { 2178}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 54 and name HA ))
3.000 1.100 1.100 peak 2178 spectrum 1 weight .10000E+01 volume .18702E-02 ppm1 2.724 ppm2 4.659 CV 1
ASSI { 2188}
(( segid " " and resid 62 and name HG1 ))
(( segid " " and resid 62 and name HA ))
2.800 1.000 1.000 peak 2188 spectrum 1 weight .10000E+01 volume .32105E-02 ppm1 2.316 ppm2 4.054 CV 1
ASSI { 2189}
(( segid " " and resid 52 and name HG1 ))
(( segid " " and resid 52 and name HA ))
3.300 1.300 1.300 peak 2189 spectrum 1 weight .10000E+01 volume .84157E-03 ppm1 2.243 ppm2 4.007 CV 1
ASSI { 2198}
(( segid " " and resid 51 and name HG2 ))
(( segid " " and resid 51 and name HA ))
3.100 1.200 1.200 peak 2198 spectrum 1 weight .10000E+01 volume .31507E-02 ppm1 2.358 ppm2 4.494 CV 1
ASSI { 2199}
(( segid " " and resid 51 and name HG1 ))
(( segid " " and resid 51 and name HA ))
3.200 1.300 1.300 peak 2199 spectrum 1 weight .10000E+01 volume .29585E-02 ppm1 2.292 ppm2 4.492 CV 1
ASSI { 2237}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 45 and name HA ))
3.100 1.200 1.200 peak 2237 spectrum 1 weight .10000E+01 volume .14026E-02 ppm1 1.812 ppm2 3.660 CV 1
ASSI { 2242}
(( segid " " and resid 45 and name HG11))
(( segid " " and resid 45 and name HA ))
2.900 1.000 1.000 peak 2242 spectrum 1 weight .10000E+01 volume .17819E-02 ppm1 .812 ppm2 3.660 CV 1
ASSI { 2295}
(( segid " " and resid 41 and name HB ))
(( segid " " and resid 41 and name HG11))
2.700 .900 .900 peak 2295 spectrum 1 weight .10000E+01 volume .20806E-02 ppm1 2.052 ppm2 1.240 CV 1
ASSI { 2312}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HB1 ))
2.200 .600 .600 peak 2312 spectrum 1 weight .10000E+01 volume .35481E-02 ppm1 2.961 ppm2 1.875 CV 1
ASSI { 2323}
(( segid " " and resid 37 and name HB ))
(( segid " " and resid 37 and name HA ))
2.700 .900 .900 peak 2323 spectrum 1 weight .10000E+01 volume .34962E-02 ppm1 2.032 ppm2 4.145 CV 1
ASSI { 2328}
(( segid " " and resid 37 and name HB ))
( segid " " and resid 37 and name HG2%)
2.100 .600 .600 peak 2328 spectrum 1 weight .10000E+01 volume .97121E-02 ppm1 2.030 ppm2 1.057 CV 1
ASSI { 2346}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 34 and name HA ))
2.700 .900 .900 peak 2346 spectrum 1 weight .10000E+01 volume .33819E-02 ppm1 1.951 ppm2 4.422 CV 1
ASSI { 2357}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HB1 ))
2.500 .800 .800 peak 2357 spectrum 1 weight .10000E+01 volume .44858E-02 ppm1 4.365 ppm2 2.484 CV 1
ASSI { 2377}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HA ))
3.000 1.100 1.100 peak 2377 spectrum 1 weight .10000E+01 volume .21091E-02 ppm1 2.025 ppm2 4.435 CV 1
ASSI { 2380}
(( segid " " and resid 27 and name HB1 ))
(( segid " " and resid 27 and name HA ))
2.800 1.000 1.000 peak 2380 spectrum 1 weight .10000E+01 volume .20962E-02 ppm1 1.919 ppm2 4.433 CV 1
ASSI { 2384}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 27 and name HA ))
3.500 1.500 1.500 peak 2384 spectrum 1 weight .10000E+01 volume .80000E-03 ppm1 2.465 ppm2 4.423 CV 1
ASSI { 2385}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 27 and name HA ))
3.500 1.600 1.600 peak 2385 spectrum 1 weight .10000E+01 volume .66754E-03 ppm1 2.409 ppm2 4.435 CV 1
ASSI { 2396}
(( segid " " and resid 106 and name HE3 ))
(( segid " " and resid 106 and name HB1 ))
2.800 1.000 1.000 peak 2396 spectrum 1 weight .10000E+01 volume .26962E-02 ppm1 7.619 ppm2 3.260 CV 1
OR { 2396}
(( segid " " and resid 106 and name HE3 ))
(( segid " " and resid 106 and name HB2 ))
ASSI { 2399}
(( segid " " and resid 106 and name HZ2 ))
(( segid " " and resid 106 and name HH2 ))
2.300 .700 .700 peak 2399 spectrum 1 weight .10000E+01 volume .82939E-02 ppm1 7.459 ppm2 7.184 CV 1
ASSI { 2404}
(( segid " " and resid 92 and name HB1 ))
( segid " " and resid 92 and name HD% )
2.900 1.000 1.000 peak 2404 spectrum 1 weight .10000E+01 volume .13689E-02 ppm1 3.142 ppm2 7.145 CV 1
ASSI { 2405}
(( segid " " and resid 92 and name HB2 ))
( segid " " and resid 92 and name HD% )
3.100 1.200 1.200 peak 2405 spectrum 1 weight .10000E+01 volume .11766E-02 ppm1 3.255 ppm2 7.146 CV 1
ASSI { 2408}
( segid " " and resid 92 and name HE% )
(( segid " " and resid 92 and name HZ ))
2.400 .700 .700 peak 2408 spectrum 1 weight .10000E+01 volume .58519E-02 ppm1 7.214 ppm2 6.980 CV 1
ASSI { 2410}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 92 and name HA ))
2.700 .900 .900 peak 2410 spectrum 1 weight .10000E+01 volume .24209E-02 ppm1 7.125 ppm2 4.456 CV 1
ASSI { 2411}
( segid " " and resid 92 and name HE% )
(( segid " " and resid 92 and name HA ))
4.100 2.100 1.900 peak 2411 spectrum 1 weight .10000E+01 volume .91948E-03 ppm1 7.214 ppm2 4.453 CV 1
ASSI { 2412}
( segid " " and resid 92 and name HE% )
(( segid " " and resid 92 and name HB2 ))
4.300 2.300 1.700 peak 2412 spectrum 1 weight .10000E+01 volume .61300E-03 ppm1 7.213 ppm2 3.260 CV 1
ASSI { 2413}
( segid " " and resid 92 and name HE% )
(( segid " " and resid 92 and name HB1 ))
4.300 2.400 1.700 peak 2413 spectrum 1 weight .10000E+01 volume .58963E-03 ppm1 7.211 ppm2 3.148 CV 1
ASSI { 2418}
(( segid " " and resid 92 and name HZ ))
( segid " " and resid 96 and name HG2%)
4.000 2.000 2.000 peak 2418 spectrum 1 weight .10000E+01 volume .89093E-03 ppm1 6.969 ppm2 .593 CV 1
ASSI { 2419}
(( segid " " and resid 92 and name HZ ))
( segid " " and resid 96 and name HD1%)
3.400 1.400 1.400 peak 2419 spectrum 1 weight .10000E+01 volume .10208E-02 ppm1 6.972 ppm2 .261 CV 1
ASSI { 2433}
(( segid " " and resid 43 and name HB2 ))
(( segid " " and resid 43 and name HE3 ))
4.100 2.100 1.900 peak 2433 spectrum 1 weight .10000E+01 volume .96628E-03 ppm1 3.542 ppm2 7.942 CV 1
ASSI { 2434}
(( segid " " and resid 43 and name HB2 ))
(( segid " " and resid 43 and name HD1 ))
3.400 1.400 1.400 peak 2434 spectrum 1 weight .10000E+01 volume .68835E-03 ppm1 3.546 ppm2 7.296 CV 1
ASSI { 2438}
(( segid " " and resid 43 and name HD1 ))
(( segid " " and resid 43 and name HE1 ))
2.600 .800 .800 peak 2438 spectrum 1 weight .10000E+01 volume .48287E-02 ppm1 7.283 ppm2 10.139 CV 1
ASSI { 2441}
(( segid " " and resid 43 and name HD1 ))
(( segid " " and resid 43 and name HB1 ))
3.900 1.900 1.900 peak 2441 spectrum 1 weight .10000E+01 volume .88314E-03 ppm1 7.283 ppm2 2.855 CV 1
ASSI { 2443}
(( segid " " and resid 43 and name HD1 ))
(( segid " " and resid 35 and name HH2 ))
3.300 1.400 1.400 peak 2443 spectrum 1 weight .10000E+01 volume .10987E-02 ppm1 7.285 ppm2 6.372 CV 1
ASSI { 2445}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 43 and name HE1 ))
2.900 1.100 1.100 peak 2445 spectrum 1 weight .10000E+01 volume .20780E-02 ppm1 7.286 ppm2 10.135 CV 1
ASSI { 2446}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 43 and name HH2 ))
2.500 .800 .800 peak 2446 spectrum 1 weight .10000E+01 volume .47170E-02 ppm1 7.286 ppm2 6.849 CV 1
ASSI { 2449}
(( segid " " and resid 43 and name HE3 ))
(( segid " " and resid 43 and name HZ3 ))
2.800 1.000 1.000 peak 2449 spectrum 1 weight .10000E+01 volume .22676E-02 ppm1 7.924 ppm2 6.962 CV 1
ASSI { 2455}
(( segid " " and resid 43 and name HZ2 ))
( segid " " and resid 47 and name HG2%)
3.100 1.200 1.200 peak 2455 spectrum 1 weight .10000E+01 volume .17273E-02 ppm1 7.288 ppm2 .968 CV 1
ASSI { 2465}
(( segid " " and resid 35 and name HH2 ))
(( segid " " and resid 35 and name HZ3 ))
3.100 1.200 1.200 peak 2465 spectrum 1 weight .10000E+01 volume .12598E-02 ppm1 6.362 ppm2 6.032 CV 1
ASSI { 2478}
(( segid " " and resid 35 and name HE3 ))
(( segid " " and resid 35 and name HB2 ))
2.900 1.000 1.000 peak 2478 spectrum 1 weight .10000E+01 volume .20650E-02 ppm1 7.127 ppm2 3.393 CV 1
OR { 2478}
(( segid " " and resid 35 and name HE3 ))
(( segid " " and resid 35 and name HB1 ))
ASSI { 2479}
(( segid " " and resid 35 and name HE3 ))
(( segid " " and resid 40 and name HA ))
3.000 1.100 1.100 peak 2479 spectrum 1 weight .10000E+01 volume .15793E-02 ppm1 7.124 ppm2 3.810 CV 1
ASSI { 2481}
(( segid " " and resid 35 and name HE3 ))
(( segid " " and resid 35 and name HZ3 ))
2.900 1.000 1.000 peak 2481 spectrum 1 weight .10000E+01 volume .19767E-02 ppm1 7.125 ppm2 6.031 CV 1
ASSI { 2487}
( segid " " and resid 32 and name HD% )
( segid " " and resid 32 and name HE% )
2.500 .800 .800 peak 2487 spectrum 1 weight .10000E+01 volume .37871E-02 ppm1 6.571 ppm2 6.990 CV 1
ASSI { 2491}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 32 and name HB2 ))
2.900 1.000 1.000 peak 2491 spectrum 1 weight .10000E+01 volume .18390E-02 ppm1 6.569 ppm2 1.798 CV 1
ASSI { 2493}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 32 and name HA ))
3.800 3.800 2.200 peak 2493 spectrum 1 weight .10000E+01 volume .59481E-03 ppm1 6.574 ppm2 2.079 CV 1
ASSI { 2496}
(( segid " " and resid 32 and name HZ ))
( segid " " and resid 32 and name HD% )
3.900 2.000 2.000 peak 2496 spectrum 1 weight .10000E+01 volume .96884E-03 ppm1 7.007 ppm2 6.584 CV 1
ASSI { 2520}
(( segid " " and resid 43 and name HB1 ))
(( segid " " and resid 43 and name HN ))
3.300 1.300 1.300 peak 2520 spectrum 1 weight .10000E+01 volume .74028E-03 ppm1 2.836 ppm2 8.124 CV 1
ASSI { 2521}
(( segid " " and resid 43 and name HH2 ))
(( segid " " and resid 96 and name HA ))
3.300 1.400 1.400 peak 2521 spectrum 1 weight .10000E+01 volume .86238E-03 ppm1 6.827 ppm2 3.560 CV 1
ASSI { 2529}
(( segid " " and resid 35 and name HD1 ))
(( segid " " and resid 35 and name HB1 ))
3.600 1.600 1.600 peak 2529 spectrum 1 weight .10000E+01 volume .82599E-03 ppm1 6.900 ppm2 3.388 CV 1
OR { 2529}
(( segid " " and resid 35 and name HD1 ))
(( segid " " and resid 35 and name HB2 ))
ASSI { 2534}
(( segid " " and resid 35 and name HD1 ))
(( segid " " and resid 35 and name HA ))
2.800 1.000 1.000 peak 2534 spectrum 1 weight .10000E+01 volume .22468E-02 ppm1 6.900 ppm2 5.195 CV 1
ASSI { 2536}
(( segid " " and resid 35 and name HZ2 ))
(( segid " " and resid 35 and name HH2 ))
2.600 .800 .800 peak 2536 spectrum 1 weight .10000E+01 volume .44365E-02 ppm1 7.305 ppm2 6.376 CV 1
ASSI { 2541}
(( segid " " and resid 35 and name HE3 ))
( segid " " and resid 40 and name HG2%)
2.600 .800 .800 peak 2541 spectrum 1 weight .10000E+01 volume .40858E-02 ppm1 7.125 ppm2 1.345 CV 1
ASSI { 2542}
(( segid " " and resid 35 and name HZ3 ))
( segid " " and resid 70 and name HD2%)
4.100 2.100 1.900 peak 2542 spectrum 1 weight .10000E+01 volume .42339E-03 ppm1 6.023 ppm2 .768 CV 1
ASSI { 2544}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HN ))
3.800 1.800 1.800 peak 2544 spectrum 1 weight .10000E+01 volume .52986E-03 ppm1 3.659 ppm2 7.717 CV 1
ASSI { 2545}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 26 and name HA ))
3.500 1.500 1.500 peak 2545 spectrum 1 weight .10000E+01 volume .99222E-03 ppm1 7.146 ppm2 4.685 CV 1
ASSI { 2623}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HA ))
3.100 1.200 1.200 peak 2623 spectrum 1 weight .10000E+01 volume .15871E-02 ppm1 2.674 ppm2 4.352 CV 1
ASSI { 2637}
(( segid " " and resid 79 and name HB1 ))
(( segid " " and resid 79 and name HN ))
3.300 1.300 1.300 peak 2637 spectrum 1 weight .10000E+01 volume .20390E-02 ppm1 1.902 ppm2 8.897 CV 1
ASSI { 2638}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 59 and name HN ))
3.700 1.700 1.700 peak 2638 spectrum 1 weight .10000E+01 volume .12832E-02 ppm1 1.912 ppm2 8.571 CV 1
OR { 2638}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HN ))
ASSI { 2646}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 79 and name HE22))
3.700 1.700 1.700 peak 2646 spectrum 1 weight .10000E+01 volume .14806E-02 ppm1 2.260 ppm2 7.079 CV 1
ASSI { 2648}
(( segid " " and resid 50 and name HB ))
(( segid " " and resid 51 and name HN ))
2.300 .600 .600 peak 2648 spectrum 1 weight .10000E+01 volume .25767E-02 ppm1 2.262 ppm2 8.438 CV 1
ASSI { 2649}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 79 and name HE21))
3.000 1.100 1.100 peak 2649 spectrum 1 weight .10000E+01 volume .13299E-02 ppm1 2.261 ppm2 6.733 CV 1
ASSI { 2651}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 79 and name HE21))
3.900 1.900 1.900 peak 2651 spectrum 1 weight .10000E+01 volume .49352E-03 ppm1 2.168 ppm2 6.716 CV 1
ASSI { 2653}
(( segid " " and resid 79 and name HG1 ))
(( segid " " and resid 79 and name HA ))
2.900 1.000 1.000 peak 2653 spectrum 1 weight .10000E+01 volume .17897E-02 ppm1 1.888 ppm2 3.574 CV 1
ASSI { 2657}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HN ))
3.700 1.700 1.700 peak 2657 spectrum 1 weight .10000E+01 volume .89611E-03 ppm1 2.784 ppm2 8.402 CV 1
ASSI { 2658}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HD22))
4.000 2.000 2.000 peak 2658 spectrum 1 weight .10000E+01 volume .10104E-02 ppm1 2.824 ppm2 7.495 CV 1
ASSI { 2660}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HD22))
3.900 1.900 1.900 peak 2660 spectrum 1 weight .10000E+01 volume .99222E-03 ppm1 2.845 ppm2 7.569 CV 1
ASSI { 2662}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HD22))
4.100 2.100 1.900 peak 2662 spectrum 1 weight .10000E+01 volume .77145E-03 ppm1 2.785 ppm2 7.566 CV 1
ASSI { 2664}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 106 and name HN ))
2.200 .600 .600 peak 2664 spectrum 1 weight .10000E+01 volume .83171E-02 ppm1 4.262 ppm2 8.055 CV 1
ASSI { 2673}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 97 and name HD22))
4.200 2.200 1.800 peak 2673 spectrum 1 weight .10000E+01 volume .60260E-03 ppm1 3.026 ppm2 7.490 CV 1
ASSI { 2674}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 107 and name HN ))
3.600 1.600 1.600 peak 2674 spectrum 1 weight .10000E+01 volume .95326E-03 ppm1 1.605 ppm2 7.884 CV 1
ASSI { 2675}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 97 and name HD21))
3.600 1.600 1.600 peak 2675 spectrum 1 weight .10000E+01 volume .46495E-03 ppm1 2.830 ppm2 6.924 CV 1
ASSI { 2677}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 107 and name HG2 ))
3.000 1.100 1.100 peak 2677 spectrum 1 weight .10000E+01 volume .17039E-02 ppm1 1.598 ppm2 1.287 CV 1
OR { 2677}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 107 and name HG1 ))
ASSI { 2678}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 107 and name HG1 ))
2.700 .900 .900 peak 2678 spectrum 1 weight .10000E+01 volume .28052E-02 ppm1 1.750 ppm2 1.299 CV 1
OR { 2678}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 107 and name HG2 ))
ASSI { 2683}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HN ))
3.300 1.300 1.300 peak 2683 spectrum 1 weight .10000E+01 volume .17974E-02 ppm1 .787 ppm2 7.750 CV 1
ASSI { 2690}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 63 and name HB2 ))
2.600 .800 .800 peak 2690 spectrum 1 weight .10000E+01 volume .34027E-02 ppm1 .787 ppm2 2.918 CV 1
ASSI { 2691}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 63 and name HB1 ))
2.800 1.000 1.000 peak 2691 spectrum 1 weight .10000E+01 volume .27222E-02 ppm1 .787 ppm2 2.547 CV 1
ASSI { 2692}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HB ))
2.800 1.000 1.000 peak 2692 spectrum 1 weight .10000E+01 volume .24156E-02 ppm1 .787 ppm2 2.220 CV 1
ASSI { 2694}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HG12))
2.300 .700 .700 peak 2694 spectrum 1 weight .10000E+01 volume .57558E-02 ppm1 .786 ppm2 1.592 CV 1
ASSI { 2695}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HG11))
2.300 .600 .600 peak 2695 spectrum 1 weight .10000E+01 volume .66705E-02 ppm1 .787 ppm2 1.445 CV 1
ASSI { 2698}
( segid " " and resid 96 and name HD1%)
( segid " " and resid 92 and name HE% )
3.000 1.100 1.100 peak 2698 spectrum 1 weight .10000E+01 volume .14026E-02 ppm1 .238 ppm2 7.204 CV 1
ASSI { 2701}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 93 and name HA ))
2.700 .900 .900 peak 2701 spectrum 1 weight .10000E+01 volume .26884E-02 ppm1 .240 ppm2 3.811 CV 1
ASSI { 2702}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 96 and name HA ))
3.900 1.900 1.900 peak 2702 spectrum 1 weight .10000E+01 volume .12857E-02 ppm1 .240 ppm2 3.560 CV 1
ASSI { 2705}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 96 and name HB ))
2.300 .700 .700 peak 2705 spectrum 1 weight .10000E+01 volume .55896E-02 ppm1 .240 ppm2 1.753 CV 1
ASSI { 2728}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 46 and name HN ))
3.200 1.300 1.300 peak 2728 spectrum 1 weight .10000E+01 volume .15767E-02 ppm1 .921 ppm2 7.614 CV 1
ASSI { 2730}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 46 and name HA ))
2.900 1.000 1.000 peak 2730 spectrum 1 weight .10000E+01 volume .23247E-02 ppm1 .921 ppm2 4.221 CV 1
ASSI { 2731}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 45 and name HB ))
2.000 .500 .500 peak 2731 spectrum 1 weight .10000E+01 volume .12385E-01 ppm1 .921 ppm2 1.833 CV 1
ASSI { 2743}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 90 and name HA ))
3.500 1.600 1.600 peak 2743 spectrum 1 weight .10000E+01 volume .30416E-02 ppm1 .863 ppm2 3.667 CV 1
ASSI { 2749}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 90 and name HB ))
1.900 .500 .500 peak 2749 spectrum 1 weight .10000E+01 volume .16548E-01 ppm1 .863 ppm2 1.889 CV 1
ASSI { 2752}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 68 and name HN ))
2.500 .800 .800 peak 2752 spectrum 1 weight .10000E+01 volume .33534E-02 ppm1 .981 ppm2 8.283 CV 1
ASSI { 2753}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 67 and name HN ))
3.200 1.300 1.300 peak 2753 spectrum 1 weight .10000E+01 volume .19611E-02 ppm1 .980 ppm2 8.102 CV 1
ASSI { 2757}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 66 and name HA ))
3.000 1.100 1.100 peak 2757 spectrum 1 weight .10000E+01 volume .33403E-02 ppm1 .981 ppm2 4.269 CV 1
ASSI { 2760}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 66 and name HB ))
2.100 .600 .600 peak 2760 spectrum 1 weight .10000E+01 volume .92496E-02 ppm1 .981 ppm2 2.679 CV 1
ASSI { 2764}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 41 and name HN ))
3.100 1.200 1.200 peak 2764 spectrum 1 weight .10000E+01 volume .25923E-02 ppm1 .934 ppm2 8.538 CV 1
ASSI { 2766}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 95 and name HN ))
2.700 .900 .900 peak 2766 spectrum 1 weight .10000E+01 volume .23170E-02 ppm1 4.075 ppm2 7.806 CV 1
ASSI { 2767}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 61 and name HN ))
3.000 1.100 1.100 peak 2767 spectrum 1 weight .10000E+01 volume .19455E-02 ppm1 .932 ppm2 7.446 CV 1
ASSI { 2768}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 38 and name HA ))
2.600 .800 .800 peak 2768 spectrum 1 weight .10000E+01 volume .30208E-02 ppm1 .933 ppm2 4.347 CV 1
ASSI { 2772}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 57 and name HB2 ))
3.100 1.200 1.200 peak 2772 spectrum 1 weight .10000E+01 volume .14520E-02 ppm1 .933 ppm2 3.195 CV 1
ASSI { 2777}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 41 and name HB ))
2.100 .600 .600 peak 2777 spectrum 1 weight .10000E+01 volume .89823E-02 ppm1 .933 ppm2 2.047 CV 1
ASSI { 2782}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 52 and name HN ))
3.700 1.700 1.700 peak 2782 spectrum 1 weight .10000E+01 volume .77662E-03 ppm1 .810 ppm2 9.131 CV 1
ASSI { 2783}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name HN ))
3.300 1.300 1.300 peak 2783 spectrum 1 weight .10000E+01 volume .23871E-02 ppm1 .814 ppm2 8.579 CV 1
ASSI { 2784}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 46 and name HN ))
3.100 3.100 2.900 peak 2784 spectrum 1 weight .10000E+01 volume .59224E-03 ppm1 .815 ppm2 7.611 CV 1
ASSI { 2789}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name HA ))
3.500 1.500 1.500 peak 2789 spectrum 1 weight .10000E+01 volume .28468E-02 ppm1 .814 ppm2 3.665 CV 1
ASSI { 2793}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name HB ))
2.400 .700 .700 peak 2793 spectrum 1 weight .10000E+01 volume .52858E-02 ppm1 .813 ppm2 1.834 CV 1
ASSI { 2794}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 45 and name HG12))
2.100 .600 .600 peak 2794 spectrum 1 weight .10000E+01 volume .90134E-02 ppm1 .813 ppm2 1.653 CV 1
ASSI { 2801}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 41 and name HN ))
3.500 1.500 1.500 peak 2801 spectrum 1 weight .10000E+01 volume .25585E-02 ppm1 1.067 ppm2 8.538 CV 1
ASSI { 2806}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 41 and name HA ))
2.300 .700 .700 peak 2806 spectrum 1 weight .10000E+01 volume .61562E-02 ppm1 1.066 ppm2 3.633 CV 1
ASSI { 2807}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 57 and name HB2 ))
3.000 1.100 1.100 peak 2807 spectrum 1 weight .10000E+01 volume .15611E-02 ppm1 1.065 ppm2 3.219 CV 1
ASSI { 2808}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 57 and name HB1 ))
2.700 .900 .900 peak 2808 spectrum 1 weight .10000E+01 volume .27767E-02 ppm1 1.065 ppm2 3.015 CV 1
ASSI { 2811}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 41 and name HB ))
2.100 .500 .500 peak 2811 spectrum 1 weight .10000E+01 volume .99611E-02 ppm1 1.066 ppm2 2.074 CV 1
ASSI { 2812}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 41 and name HG12))
2.300 .700 .700 peak 2812 spectrum 1 weight .10000E+01 volume .46339E-02 ppm1 1.066 ppm2 1.847 CV 1
ASSI { 2813}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 45 and name HG12))
3.400 1.400 1.400 peak 2813 spectrum 1 weight .10000E+01 volume .24260E-02 ppm1 1.066 ppm2 1.648 CV 1
ASSI { 2815}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 79 and name HN ))
2.900 1.100 1.100 peak 2815 spectrum 1 weight .10000E+01 volume .18338E-02 ppm1 1.370 ppm2 8.898 CV 1
ASSI { 2816}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 90 and name HN ))
2.600 .800 .800 peak 2816 spectrum 1 weight .10000E+01 volume .36832E-02 ppm1 1.370 ppm2 8.387 CV 1
ASSI { 2817}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 89 and name HN ))
2.200 .600 .600 peak 2817 spectrum 1 weight .10000E+01 volume .80937E-02 ppm1 1.370 ppm2 8.096 CV 1
ASSI { 2820}
( segid " " and resid 89 and name HB% )
( segid " " and resid 92 and name HD% )
3.900 1.900 1.900 peak 2820 spectrum 1 weight .10000E+01 volume .71952E-03 ppm1 1.370 ppm2 7.123 CV 1
ASSI { 2822}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 89 and name HA ))
2.100 .600 .600 peak 2822 spectrum 1 weight .10000E+01 volume .98393E-02 ppm1 1.370 ppm2 4.027 CV 1
ASSI { 2838}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 96 and name HA ))
2.500 .800 .800 peak 2838 spectrum 1 weight .10000E+01 volume .44988E-02 ppm1 .565 ppm2 3.569 CV 1
ASSI { 2841}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 96 and name HB ))
2.100 .600 .600 peak 2841 spectrum 1 weight .10000E+01 volume .99715E-02 ppm1 .565 ppm2 1.757 CV 1
ASSI { 2844}
( segid " " and resid 96 and name HG2%)
( segid " " and resid 96 and name HD1%)
2.400 .700 .700 peak 2844 spectrum 1 weight .10000E+01 volume .75325E-02 ppm1 .564 ppm2 .263 CV 1
ASSI { 2847}
( segid " " and resid 50 and name HG1%)
(( segid " " and resid 50 and name HN ))
3.100 1.200 1.200 peak 2847 spectrum 1 weight .10000E+01 volume .21585E-02 ppm1 .529 ppm2 6.722 CV 1
ASSI { 2848}
( segid " " and resid 50 and name HG1%)
(( segid " " and resid 49 and name HA ))
2.800 2.800 3.200 peak 2848 spectrum 1 weight .10000E+01 volume .10936E-02 ppm1 .528 ppm2 4.044 CV 1
ASSI { 2852}
( segid " " and resid 50 and name HG1%)
(( segid " " and resid 50 and name HB ))
2.500 .800 .800 peak 2852 spectrum 1 weight .10000E+01 volume .32988E-02 ppm1 .529 ppm2 2.281 CV 1
ASSI { 2863}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 45 and name HN ))
3.000 1.100 1.100 peak 2863 spectrum 1 weight .10000E+01 volume .64935E-03 ppm1 .560 ppm2 8.587 CV 1
ASSI { 2864}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 56 and name HA ))
3.000 1.200 1.200 peak 2864 spectrum 1 weight .10000E+01 volume .40001E-02 ppm1 .560 ppm2 4.346 CV 1
ASSI { 2872}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 56 and name HG ))
2.400 .700 .700 peak 2872 spectrum 1 weight .10000E+01 volume .44313E-02 ppm1 .560 ppm2 1.241 CV 1
ASSI { 2874}
( segid " " and resid 56 and name HD2%)
( segid " " and resid 56 and name HD1%)
2.400 .700 .700 peak 2874 spectrum 1 weight .10000E+01 volume .65147E-02 ppm1 .560 ppm2 .269 CV 1
ASSI { 2876}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 92 and name HN ))
3.800 1.800 1.800 peak 2876 spectrum 1 weight .10000E+01 volume .70394E-03 ppm1 .640 ppm2 8.474 CV 1
ASSI { 2881}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 48 and name HA ))
2.800 1.000 1.000 peak 2881 spectrum 1 weight .10000E+01 volume .46079E-02 ppm1 .641 ppm2 4.205 CV 1
ASSI { 2887}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 92 and name HN ))
3.700 1.700 1.700 peak 2887 spectrum 1 weight .10000E+01 volume .64417E-03 ppm1 .680 ppm2 8.459 CV 1
ASSI { 2890}
(( segid " " and resid 44 and name HB1 ))
( segid " " and resid 48 and name HD2%)
3.200 1.300 1.300 peak 2890 spectrum 1 weight .10000E+01 volume .13169E-02 ppm1 2.610 ppm2 .708 CV 1
ASSI { 2892}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 48 and name HA ))
3.100 1.200 1.200 peak 2892 spectrum 1 weight .10000E+01 volume .25793E-02 ppm1 .681 ppm2 4.196 CV 1
ASSI { 2896}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 92 and name HB1 ))
3.600 1.600 1.600 peak 2896 spectrum 1 weight .10000E+01 volume .17169E-02 ppm1 .681 ppm2 3.151 CV 1
ASSI { 2905}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 37 and name HN ))
2.500 .800 .800 peak 2905 spectrum 1 weight .10000E+01 volume .48105E-02 ppm1 1.065 ppm2 9.037 CV 1
ASSI { 2907}
( segid " " and resid 66 and name HG2%)
(( segid " " and resid 67 and name HN ))
2.900 1.100 1.100 peak 2907 spectrum 1 weight .10000E+01 volume .14286E-02 ppm1 1.078 ppm2 8.100 CV 1
ASSI { 2913}
( segid " " and resid 66 and name HG2%)
(( segid " " and resid 66 and name HN ))
3.500 1.600 1.600 peak 2913 spectrum 1 weight .10000E+01 volume .17792E-02 ppm1 1.079 ppm2 6.540 CV 1
ASSI { 2919}
( segid " " and resid 66 and name HG2%)
(( segid " " and resid 66 and name HB ))
2.300 .600 .600 peak 2919 spectrum 1 weight .10000E+01 volume .65482E-02 ppm1 1.080 ppm2 2.677 CV 1
ASSI { 2926}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 69 and name HA ))
3.500 1.500 1.500 peak 2926 spectrum 1 weight .10000E+01 volume .17715E-02 ppm1 1.074 ppm2 4.349 CV 1
ASSI { 2932}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 69 and name HG ))
2.300 .700 .700 peak 2932 spectrum 1 weight .10000E+01 volume .66158E-02 ppm1 1.074 ppm2 1.685 CV 1
ASSI { 2933}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 69 and name HB2 ))
2.700 .900 .900 peak 2933 spectrum 1 weight .10000E+01 volume .47326E-02 ppm1 1.074 ppm2 1.893 CV 1
ASSI { 2935}
(( segid " " and resid 93 and name HD1 ))
(( segid " " and resid 93 and name HE2 ))
2.800 1.000 1.000 peak 2935 spectrum 1 weight .10000E+01 volume .14832E-02 ppm1 1.445 ppm2 3.025 CV 1
ASSI { 2937}
( segid " " and resid 53 and name HG2%)
(( segid " " and resid 52 and name HN ))
3.700 1.700 1.700 peak 2937 spectrum 1 weight .10000E+01 volume .56103E-03 ppm1 1.192 ppm2 9.143 CV 1
ASSI { 2938}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 42 and name HN ))
3.500 1.600 1.600 peak 2938 spectrum 1 weight .10000E+01 volume .21377E-02 ppm1 1.176 ppm2 8.308 CV 1
ASSI { 2939}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 43 and name HN ))
3.700 1.700 1.700 peak 2939 spectrum 1 weight .10000E+01 volume .14598E-02 ppm1 1.175 ppm2 8.126 CV 1
ASSI { 2940}
( segid " " and resid 53 and name HG2%)
(( segid " " and resid 54 and name HN ))
4.100 2.100 1.900 peak 2940 spectrum 1 weight .10000E+01 volume .69353E-03 ppm1 1.191 ppm2 7.779 CV 1
ASSI { 2942}
( segid " " and resid 53 and name HG2%)
(( segid " " and resid 53 and name HN ))
2.700 .900 .900 peak 2942 spectrum 1 weight .10000E+01 volume .37689E-02 ppm1 1.190 ppm2 7.010 CV 1
ASSI { 2944}
( segid " " and resid 53 and name HG2%)
(( segid " " and resid 53 and name HB ))
2.100 .500 .500 peak 2944 spectrum 1 weight .10000E+01 volume .13938E-01 ppm1 1.190 ppm2 4.545 CV 1
ASSI { 2946}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 52 and name HN ))
4.300 2.300 1.700 peak 2946 spectrum 1 weight .10000E+01 volume .99483E-03 ppm1 1.871 ppm2 9.134 CV 1
ASSI { 2947}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 42 and name HA ))
2.300 .700 .700 peak 2947 spectrum 1 weight .10000E+01 volume .79561E-02 ppm1 1.176 ppm2 3.815 CV 1
ASSI { 2954}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 52 and name HN ))
2.700 .900 .900 peak 2954 spectrum 1 weight .10000E+01 volume .13117E-02 ppm1 2.214 ppm2 9.133 CV 1
ASSI { 2972}
(( segid " " and resid 104 and name HB1 ))
(( segid " " and resid 104 and name HA ))
2.600 .900 .900 peak 2972 spectrum 1 weight .10000E+01 volume .38547E-02 ppm1 1.456 ppm2 4.266 CV 1
ASSI { 2973}
(( segid " " and resid 104 and name HB2 ))
(( segid " " and resid 104 and name HA ))
2.500 .800 .800 peak 2973 spectrum 1 weight .10000E+01 volume .40703E-02 ppm1 1.633 ppm2 4.268 CV 1
ASSI { 2983}
(( segid " " and resid 104 and name HG ))
(( segid " " and resid 104 and name HA ))
2.700 .900 .900 peak 2983 spectrum 1 weight .10000E+01 volume .21871E-02 ppm1 1.623 ppm2 4.270 CV 1
ASSI { 2987}
( segid " " and resid 104 and name HD2%)
(( segid " " and resid 106 and name HZ2 ))
4.000 2.000 2.000 peak 2987 spectrum 1 weight .10000E+01 volume .58702E-03 ppm1 .901 ppm2 7.491 CV 1
ASSI { 2990}
( segid " " and resid 104 and name HD2%)
(( segid " " and resid 104 and name HA ))
3.200 1.300 1.300 peak 2990 spectrum 1 weight .10000E+01 volume .22858E-02 ppm1 .900 ppm2 4.263 CV 1
ASSI { 2997}
(( segid " " and resid 104 and name HB1 ))
(( segid " " and resid 104 and name HN ))
3.300 1.400 1.400 peak 2997 spectrum 1 weight .10000E+01 volume .17195E-02 ppm1 1.455 ppm2 7.862 CV 1
ASSI { 2998}
(( segid " " and resid 104 and name HB2 ))
(( segid " " and resid 104 and name HN ))
2.600 .800 .800 peak 2998 spectrum 1 weight .10000E+01 volume .29169E-02 ppm1 1.633 ppm2 7.864 CV 1
ASSI { 2999}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 37 and name HN ))
3.400 1.500 1.500 peak 2999 spectrum 1 weight .10000E+01 volume .27975E-02 ppm1 1.004 ppm2 9.040 CV 1
ASSI { 3001}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 38 and name HN ))
2.800 1.000 1.000 peak 3001 spectrum 1 weight .10000E+01 volume .32650E-02 ppm1 1.003 ppm2 7.752 CV 1
ASSI { 3008}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 37 and name HB ))
2.100 .600 .600 peak 3008 spectrum 1 weight .10000E+01 volume .93871E-02 ppm1 1.004 ppm2 2.048 CV 1
ASSI { 3019}
(( segid " " and resid 108 and name HB1 ))
(( segid " " and resid 108 and name HA ))
3.200 1.300 1.300 peak 3019 spectrum 1 weight .10000E+01 volume .14260E-02 ppm1 2.522 ppm2 4.356 CV 1
ASSI { 3022}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HN ))
3.300 1.300 1.300 peak 3022 spectrum 1 weight .10000E+01 volume .90390E-03 ppm1 2.662 ppm2 7.802 CV 1
ASSI { 3026}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 81 and name HN ))
3.400 1.500 1.500 peak 3026 spectrum 1 weight .10000E+01 volume .19923E-02 ppm1 .787 ppm2 8.274 CV 1
ASSI { 3036}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 81 and name HG ))
2.000 .500 .500 peak 3036 spectrum 1 weight .10000E+01 volume .17439E-01 ppm1 .786 ppm2 1.937 CV 1
ASSI { 3044}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HN ))
2.600 .800 .800 peak 3044 spectrum 1 weight .10000E+01 volume .39767E-02 ppm1 4.399 ppm2 8.278 CV 1
ASSI { 3046}
(( segid " " and resid 81 and name HG ))
(( segid " " and resid 81 and name HN ))
3.300 1.400 1.400 peak 3046 spectrum 1 weight .10000E+01 volume .18260E-02 ppm1 1.936 ppm2 8.274 CV 1
ASSI { 3054}
( segid " " and resid 81 and name HD2%)
(( segid " " and resid 81 and name HN ))
3.700 1.700 1.700 peak 3054 spectrum 1 weight .10000E+01 volume .16208E-02 ppm1 .890 ppm2 8.267 CV 1
ASSI { 3058}
( segid " " and resid 81 and name HD2%)
(( segid " " and resid 81 and name HB1 ))
2.300 .600 .600 peak 3058 spectrum 1 weight .10000E+01 volume .62341E-02 ppm1 .892 ppm2 1.374 CV 1
ASSI { 3063}
(( segid " " and resid 103 and name HE1 ))
(( segid " " and resid 103 and name HD2 ))
2.100 .600 .600 peak 3063 spectrum 1 weight .10000E+01 volume .10715E-01 ppm1 2.865 ppm2 1.593 CV 1
OR { 3063}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HD1 ))
OR { 3063}
(( segid " " and resid 103 and name HE1 ))
(( segid " " and resid 103 and name HD1 ))
OR { 3063}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HD2 ))
ASSI { 3069}
(( segid " " and resid 107 and name HG2 ))
(( segid " " and resid 107 and name HE2 ))
3.500 1.500 1.500 peak 3069 spectrum 1 weight .10000E+01 volume .70911E-03 ppm1 1.297 ppm2 2.953 CV 1
OR { 3069}
(( segid " " and resid 107 and name HG1 ))
(( segid " " and resid 107 and name HE1 ))
OR { 3069}
(( segid " " and resid 107 and name HG2 ))
(( segid " " and resid 107 and name HE1 ))
OR { 3069}
(( segid " " and resid 107 and name HG1 ))
(( segid " " and resid 107 and name HE2 ))
ASSI { 3077}
(( segid " " and resid 107 and name HD1 ))
(( segid " " and resid 107 and name HE1 ))
2.300 .700 .700 peak 3077 spectrum 1 weight .10000E+01 volume .73481E-02 ppm1 1.602 ppm2 2.959 CV 1
OR { 3077}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 107 and name HE2 ))
OR { 3077}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 107 and name HE1 ))
OR { 3077}
(( segid " " and resid 107 and name HD1 ))
(( segid " " and resid 107 and name HE2 ))
ASSI { 3078}
(( segid " " and resid 107 and name HD1 ))
(( segid " " and resid 107 and name HA ))
3.400 1.400 1.400 peak 3078 spectrum 1 weight .10000E+01 volume .17195E-02 ppm1 1.601 ppm2 4.296 CV 1
OR { 3078}
(( segid " " and resid 107 and name HD2 ))
(( segid " " and resid 107 and name HA ))
ASSI { 3084}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 102 and name HA ))
2.200 .600 .600 peak 3084 spectrum 1 weight .10000E+01 volume .10278E-01 ppm1 4.009 ppm2 4.396 CV 1
OR { 3084}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HA ))
ASSI { 3088}
(( segid " " and resid 98 and name HE2 ))
(( segid " " and resid 98 and name HD1 ))
2.000 .500 .500 peak 3088 spectrum 1 weight .10000E+01 volume .15746E-01 ppm1 2.962 ppm2 1.707 CV 1
OR { 3088}
(( segid " " and resid 98 and name HE1 ))
(( segid " " and resid 98 and name HD2 ))
OR { 3088}
(( segid " " and resid 98 and name HE1 ))
(( segid " " and resid 98 and name HD1 ))
OR { 3088}
(( segid " " and resid 98 and name HE2 ))
(( segid " " and resid 98 and name HD2 ))
ASSI { 3089}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HA ))
4.200 2.200 1.800 peak 3089 spectrum 1 weight .10000E+01 volume .53248E-03 ppm1 2.866 ppm2 4.241 CV 1
OR { 3089}
(( segid " " and resid 103 and name HE1 ))
(( segid " " and resid 103 and name HA ))
ASSI { 3090}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HG1 ))
2.600 .800 .800 peak 3090 spectrum 1 weight .10000E+01 volume .43923E-02 ppm1 2.864 ppm2 1.397 CV 1
OR { 3090}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HG2 ))
OR { 3090}
(( segid " " and resid 103 and name HE1 ))
(( segid " " and resid 103 and name HG2 ))
OR { 3090}
(( segid " " and resid 103 and name HE1 ))
(( segid " " and resid 103 and name HG1 ))
ASSI { 3091}
(( segid " " and resid 103 and name HE1 ))
(( segid " " and resid 103 and name HB2 ))
3.600 1.600 1.600 peak 3091 spectrum 1 weight .10000E+01 volume .11091E-02 ppm1 2.864 ppm2 1.894 CV 1
OR { 3091}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HB2 ))
ASSI { 3092}
(( segid " " and resid 103 and name HE1 ))
(( segid " " and resid 103 and name HB1 ))
3.300 1.400 1.400 peak 3092 spectrum 1 weight .10000E+01 volume .18831E-02 ppm1 2.863 ppm2 1.788 CV 1
OR { 3092}
(( segid " " and resid 103 and name HE2 ))
(( segid " " and resid 103 and name HB1 ))
ASSI { 3095}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 100 and name HB2 ))
3.200 1.300 1.300 peak 3095 spectrum 1 weight .10000E+01 volume .19325E-02 ppm1 3.083 ppm2 1.945 CV 1
ASSI { 3100}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 100 and name HG1 ))
2.600 .800 .800 peak 3100 spectrum 1 weight .10000E+01 volume .25533E-02 ppm1 3.082 ppm2 1.535 CV 1
ASSI { 3104}
(( segid " " and resid 100 and name HB1 ))
(( segid " " and resid 100 and name HD2 ))
2.800 1.000 1.000 peak 3104 spectrum 1 weight .10000E+01 volume .14832E-02 ppm1 1.735 ppm2 3.057 CV 1
OR { 3104}
(( segid " " and resid 100 and name HB1 ))
(( segid " " and resid 100 and name HD1 ))
ASSI { 3111}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 61 and name HA ))
2.200 .600 .600 peak 3111 spectrum 1 weight .10000E+01 volume .84832E-02 ppm1 1.920 ppm2 4.071 CV 1
OR { 3111}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 61 and name HA ))
ASSI { 3113}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 53 and name HN ))
3.400 1.400 1.400 peak 3113 spectrum 1 weight .10000E+01 volume .10832E-02 ppm1 2.220 ppm2 7.008 CV 1
ASSI { 3114}
(( segid " " and resid 99 and name HG1 ))
(( segid " " and resid 99 and name HA ))
3.300 1.400 1.400 peak 3114 spectrum 1 weight .10000E+01 volume .98443E-03 ppm1 2.233 ppm2 4.121 CV 1
OR { 3114}
(( segid " " and resid 99 and name HG2 ))
(( segid " " and resid 99 and name HA ))
ASSI { 3120}
(( segid " " and resid 88 and name HB2 ))
(( segid " " and resid 89 and name HN ))
3.400 1.500 1.500 peak 3120 spectrum 1 weight .10000E+01 volume .13351E-02 ppm1 1.824 ppm2 8.096 CV 1
ASSI { 3121}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 86 and name HA ))
2.100 .600 .600 peak 3121 spectrum 1 weight .10000E+01 volume .11478E-01 ppm1 .876 ppm2 3.951 CV 1
ASSI { 3130}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 27 and name HG2 ))
2.900 1.100 1.100 peak 3130 spectrum 1 weight .10000E+01 volume .23274E-02 ppm1 1.926 ppm2 2.459 CV 1
ASSI { 3131}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 27 and name HG1 ))
3.100 1.200 1.200 peak 3131 spectrum 1 weight .10000E+01 volume .15663E-02 ppm1 1.927 ppm2 2.379 CV 1
ASSI { 3135}
(( segid " " and resid 96 and name HG11))
( segid " " and resid 96 and name HD1%)
2.800 1.000 1.000 peak 3135 spectrum 1 weight .10000E+01 volume .16260E-02 ppm1 .668 ppm2 .256 CV 1
ASSI { 3140}
(( segid " " and resid 96 and name HG11))
(( segid " " and resid 96 and name HB ))
2.900 1.100 1.100 peak 3140 spectrum 1 weight .10000E+01 volume .12104E-02 ppm1 .664 ppm2 1.757 CV 1
ASSI { 3141}
(( segid " " and resid 96 and name HG11))
(( segid " " and resid 96 and name HA ))
3.200 1.300 1.300 peak 3141 spectrum 1 weight .10000E+01 volume .84680E-03 ppm1 .670 ppm2 3.560 CV 1
ASSI { 3144}
(( segid " " and resid 71 and name HG1 ))
(( segid " " and resid 71 and name HD2 ))
3.300 1.400 1.400 peak 3144 spectrum 1 weight .10000E+01 volume .14935E-02 ppm1 1.495 ppm2 3.544 CV 1
ASSI { 3147}
(( segid " " and resid 98 and name HG1 ))
(( segid " " and resid 98 and name HN ))
3.500 1.500 1.500 peak 3147 spectrum 1 weight .10000E+01 volume .10987E-02 ppm1 1.501 ppm2 8.112 CV 1
ASSI { 3155}
(( segid " " and resid 98 and name HG2 ))
(( segid " " and resid 98 and name HN ))
3.900 1.900 1.900 peak 3155 spectrum 1 weight .10000E+01 volume .14234E-02 ppm1 1.686 ppm2 8.120 CV 1
ASSI { 3156}
(( segid " " and resid 98 and name HG2 ))
(( segid " " and resid 98 and name HA ))
3.200 1.300 1.300 peak 3156 spectrum 1 weight .10000E+01 volume .22286E-02 ppm1 1.684 ppm2 4.142 CV 1
ASSI { 3158}
(( segid " " and resid 98 and name HG2 ))
(( segid " " and resid 98 and name HE1 ))
2.900 1.100 1.100 peak 3158 spectrum 1 weight .10000E+01 volume .22079E-02 ppm1 1.682 ppm2 2.977 CV 1
OR { 3158}
(( segid " " and resid 98 and name HG2 ))
(( segid " " and resid 98 and name HE2 ))
ASSI { 3159}
(( segid " " and resid 98 and name HG2 ))
(( segid " " and resid 98 and name HB1 ))
2.300 .700 .700 peak 3159 spectrum 1 weight .10000E+01 volume .52365E-02 ppm1 1.684 ppm2 1.985 CV 1
OR { 3159}
(( segid " " and resid 98 and name HG2 ))
(( segid " " and resid 98 and name HB2 ))
ASSI { 3160}
(( segid " " and resid 98 and name HG1 ))
(( segid " " and resid 98 and name HB2 ))
2.600 .800 .800 peak 3160 spectrum 1 weight .10000E+01 volume .43507E-02 ppm1 1.501 ppm2 1.985 CV 1
OR { 3160}
(( segid " " and resid 98 and name HG1 ))
(( segid " " and resid 98 and name HB1 ))
ASSI { 3162}
(( segid " " and resid 98 and name HD1 ))
(( segid " " and resid 98 and name HB2 ))
2.200 .600 .600 peak 3162 spectrum 1 weight .10000E+01 volume .85794E-02 ppm1 1.687 ppm2 1.982 CV 1
OR { 3162}
(( segid " " and resid 98 and name HD2 ))
(( segid " " and resid 98 and name HB2 ))
OR { 3162}
(( segid " " and resid 98 and name HD2 ))
(( segid " " and resid 98 and name HB1 ))
OR { 3162}
(( segid " " and resid 98 and name HD1 ))
(( segid " " and resid 98 and name HB1 ))
ASSI { 3164}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 95 and name HN ))
3.100 1.200 1.200 peak 3164 spectrum 1 weight .10000E+01 volume .65975E-03 ppm1 2.079 ppm2 7.814 CV 1
ASSI { 3166}
(( segid " " and resid 95 and name HB1 ))
(( segid " " and resid 95 and name HB2 ))
2.000 .500 .500 peak 3166 spectrum 1 weight .10000E+01 volume .44183E-02 ppm1 1.723 ppm2 2.074 CV 1
ASSI { 3173}
( segid " " and resid 95 and name HD2%)
(( segid " " and resid 95 and name HB2 ))
3.400 1.400 1.400 peak 3173 spectrum 1 weight .10000E+01 volume .22001E-02 ppm1 .714 ppm2 2.071 CV 1
ASSI { 3174}
( segid " " and resid 95 and name HD2%)
(( segid " " and resid 95 and name HG ))
2.400 .700 .700 peak 3174 spectrum 1 weight .10000E+01 volume .50600E-02 ppm1 .713 ppm2 1.807 CV 1
ASSI { 3180}
(( segid " " and resid 70 and name HG ))
(( segid " " and resid 70 and name HA ))
3.300 1.300 1.300 peak 3180 spectrum 1 weight .10000E+01 volume .10182E-02 ppm1 1.783 ppm2 4.023 CV 1
ASSI { 3182}
(( segid " " and resid 70 and name HG ))
(( segid " " and resid 70 and name HN ))
2.800 .900 .900 peak 3182 spectrum 1 weight .10000E+01 volume .19455E-02 ppm1 1.785 ppm2 7.475 CV 1
ASSI { 3184}
(( segid " " and resid 95 and name HG ))
(( segid " " and resid 95 and name HA ))
3.100 1.200 1.200 peak 3184 spectrum 1 weight .10000E+01 volume .10727E-02 ppm1 1.820 ppm2 4.086 CV 1
ASSI { 3186}
(( segid " " and resid 94 and name HG11))
(( segid " " and resid 94 and name HN ))
2.800 1.000 1.000 peak 3186 spectrum 1 weight .10000E+01 volume .11793E-02 ppm1 1.156 ppm2 8.457 CV 1
ASSI { 3188}
(( segid " " and resid 91 and name HD1 ))
(( segid " " and resid 91 and name HN ))
4.000 2.000 2.000 peak 3188 spectrum 1 weight .10000E+01 volume .10130E-02 ppm1 1.658 ppm2 7.321 CV 1
OR { 3188}
(( segid " " and resid 91 and name HD2 ))
(( segid " " and resid 91 and name HN ))
ASSI { 3192}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 91 and name HE1 ))
2.800 1.000 1.000 peak 3192 spectrum 1 weight .10000E+01 volume .23325E-02 ppm1 1.360 ppm2 2.924 CV 1
OR { 3192}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 91 and name HE2 ))
ASSI { 3195}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HN ))
3.900 1.900 1.900 peak 3195 spectrum 1 weight .10000E+01 volume .10727E-02 ppm1 1.626 ppm2 7.323 CV 1
ASSI { 3197}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HA ))
3.100 1.200 1.200 peak 3197 spectrum 1 weight .10000E+01 volume .13533E-02 ppm1 1.631 ppm2 3.923 CV 1
ASSI { 3201}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HE1 ))
3.000 1.200 1.200 peak 3201 spectrum 1 weight .10000E+01 volume .17974E-02 ppm1 1.628 ppm2 2.940 CV 1
OR { 3201}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HE2 ))
ASSI { 3205}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HB2 ))
2.300 .600 .600 peak 3205 spectrum 1 weight .10000E+01 volume .64052E-02 ppm1 3.912 ppm2 1.900 CV 1
ASSI { 3206}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HD1 ))
2.600 .800 .800 peak 3206 spectrum 1 weight .10000E+01 volume .43794E-02 ppm1 3.911 ppm2 1.662 CV 1
OR { 3206}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HD2 ))
ASSI { 3207}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HG1 ))
2.700 .900 .900 peak 3207 spectrum 1 weight .10000E+01 volume .29923E-02 ppm1 3.910 ppm2 1.379 CV 1
ASSI { 3208}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 91 and name HE2 ))
3.700 1.700 1.700 peak 3208 spectrum 1 weight .10000E+01 volume .12832E-02 ppm1 1.928 ppm2 2.944 CV 1
OR { 3208}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 91 and name HE1 ))
ASSI { 3211}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 91 and name HN ))
2.500 .800 .800 peak 3211 spectrum 1 weight .10000E+01 volume .23429E-02 ppm1 1.933 ppm2 7.322 CV 1
ASSI { 3212}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 91 and name HN ))
3.100 1.200 1.200 peak 3212 spectrum 1 weight .10000E+01 volume .20052E-02 ppm1 1.846 ppm2 7.323 CV 1
ASSI { 3217}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 89 and name HN ))
3.300 1.300 1.300 peak 3217 spectrum 1 weight .10000E+01 volume .10754E-02 ppm1 3.871 ppm2 8.093 CV 1
ASSI { 3218}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HB2 ))
2.300 .700 .700 peak 3218 spectrum 1 weight .10000E+01 volume .57351E-02 ppm1 3.873 ppm2 1.860 CV 1
ASSI { 3219}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HB1 ))
2.500 .800 .800 peak 3219 spectrum 1 weight .10000E+01 volume .61872E-02 ppm1 3.872 ppm2 1.671 CV 1
ASSI { 3220}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HD2 ))
2.900 1.100 1.100 peak 3220 spectrum 1 weight .10000E+01 volume .36416E-02 ppm1 3.870 ppm2 1.464 CV 1
OR { 3220}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HD1 ))
ASSI { 3223}
(( segid " " and resid 88 and name HB1 ))
(( segid " " and resid 88 and name HE2 ))
4.000 2.000 2.000 peak 3223 spectrum 1 weight .10000E+01 volume .10000E-02 ppm1 1.684 ppm2 2.943 CV 1
ASSI { 3224}
(( segid " " and resid 88 and name HB2 ))
(( segid " " and resid 88 and name HE2 ))
3.600 1.600 1.600 peak 3224 spectrum 1 weight .10000E+01 volume .13818E-02 ppm1 1.829 ppm2 2.942 CV 1
ASSI { 3228}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 86 and name HG ))
1.900 .500 .500 peak 3228 spectrum 1 weight .10000E+01 volume .16917E-01 ppm1 .878 ppm2 1.677 CV 1
ASSI { 3229}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 86 and name HN ))
3.600 1.600 1.600 peak 3229 spectrum 1 weight .10000E+01 volume .20624E-02 ppm1 .877 ppm2 8.362 CV 1
ASSI { 3235}
(( segid " " and resid 80 and name HB1 ))
(( segid " " and resid 80 and name HA ))
2.700 .900 .900 peak 3235 spectrum 1 weight .10000E+01 volume .45949E-02 ppm1 2.738 ppm2 4.421 CV 1
ASSI { 3237}
(( segid " " and resid 80 and name HB1 ))
(( segid " " and resid 80 and name HN ))
3.000 1.100 1.100 peak 3237 spectrum 1 weight .10000E+01 volume .40027E-02 ppm1 2.738 ppm2 8.273 CV 1
ASSI { 3244}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 78 and name HB2 ))
2.900 1.000 1.000 peak 3244 spectrum 1 weight .10000E+01 volume .14208E-02 ppm1 3.941 ppm2 3.445 CV 1
ASSI { 3247}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HB2 ))
2.300 .700 .700 peak 3247 spectrum 1 weight .10000E+01 volume .64782E-02 ppm1 3.954 ppm2 2.179 CV 1
ASSI { 3248}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HG1 ))
2.900 1.100 1.100 peak 3248 spectrum 1 weight .10000E+01 volume .26078E-02 ppm1 4.068 ppm2 1.596 CV 1
ASSI { 3251}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HA ))
2.700 .900 .900 peak 3251 spectrum 1 weight .10000E+01 volume .34339E-02 ppm1 3.283 ppm2 4.951 CV 1
OR { 3251}
(( segid " " and resid 74 and name HB1 ))
(( segid " " and resid 74 and name HA ))
ASSI { 3255}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HN ))
3.100 1.200 1.200 peak 3255 spectrum 1 weight .10000E+01 volume .14338E-02 ppm1 4.286 ppm2 7.371 CV 1
ASSI { 3257}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HA ))
3.000 1.200 1.200 peak 3257 spectrum 1 weight .10000E+01 volume .13559E-02 ppm1 1.708 ppm2 4.014 CV 1
ASSI { 3258}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HB1 ))
2.600 .800 .800 peak 3258 spectrum 1 weight .10000E+01 volume .43144E-02 ppm1 4.285 ppm2 1.956 CV 1
ASSI { 3261}
(( segid " " and resid 70 and name HB1 ))
(( segid " " and resid 70 and name HA ))
3.200 1.300 1.300 peak 3261 spectrum 1 weight .10000E+01 volume .91948E-03 ppm1 1.126 ppm2 4.014 CV 1
ASSI { 3272}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HN ))
2.800 .900 .900 peak 3272 spectrum 1 weight .10000E+01 volume .14857E-02 ppm1 1.708 ppm2 7.478 CV 1
ASSI { 3273}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HB1 ))
2.000 .500 .500 peak 3273 spectrum 1 weight .10000E+01 volume .49687E-02 ppm1 1.713 ppm2 1.138 CV 1
ASSI { 3277}
( segid " " and resid 70 and name HD1%)
(( segid " " and resid 70 and name HG ))
2.000 .500 .500 peak 3277 spectrum 1 weight .10000E+01 volume .12925E-01 ppm1 .768 ppm2 1.786 CV 1
ASSI { 3282}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 68 and name HA ))
2.800 1.000 1.000 peak 3282 spectrum 1 weight .10000E+01 volume .28806E-02 ppm1 2.559 ppm2 4.387 CV 1
ASSI { 3284}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HA ))
2.600 .800 .800 peak 3284 spectrum 1 weight .10000E+01 volume .45949E-02 ppm1 2.713 ppm2 4.396 CV 1
ASSI { 3291}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 59 and name HD2 ))
3.300 1.400 1.400 peak 3291 spectrum 1 weight .10000E+01 volume .17507E-02 ppm1 1.845 ppm2 3.212 CV 1
OR { 3291}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 59 and name HD1 ))
ASSI { 3292}
(( segid " " and resid 59 and name HD1 ))
(( segid " " and resid 59 and name HA ))
2.800 1.000 1.000 peak 3292 spectrum 1 weight .10000E+01 volume .29611E-02 ppm1 3.176 ppm2 4.089 CV 1
ASSI { 3297}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 61 and name HN ))
2.400 .700 .700 peak 3297 spectrum 1 weight .10000E+01 volume .44521E-02 ppm1 1.922 ppm2 7.438 CV 1
OR { 3297}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 61 and name HN ))
ASSI { 3298}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 62 and name HN ))
2.800 1.000 1.000 peak 3298 spectrum 1 weight .10000E+01 volume .20910E-02 ppm1 1.921 ppm2 8.610 CV 1
OR { 3298}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 62 and name HN ))
ASSI { 3301}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HA ))
3.100 1.200 1.200 peak 3301 spectrum 1 weight .10000E+01 volume .13429E-02 ppm1 2.036 ppm2 4.007 CV 1
ASSI { 3302}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HB1 ))
1.900 .500 .500 peak 3302 spectrum 1 weight .10000E+01 volume .47664E-02 ppm1 2.038 ppm2 1.394 CV 1
ASSI { 3305}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HN ))
3.100 1.200 1.200 peak 3305 spectrum 1 weight .10000E+01 volume .11662E-02 ppm1 3.977 ppm2 8.596 CV 1
ASSI { 3307}
(( segid " " and resid 65 and name HG11))
(( segid " " and resid 65 and name HA ))
2.900 1.100 1.100 peak 3307 spectrum 1 weight .10000E+01 volume .19429E-02 ppm1 1.424 ppm2 3.997 CV 1
ASSI { 3308}
(( segid " " and resid 52 and name HG1 ))
(( segid " " and resid 52 and name HN ))
3.800 1.800 1.800 peak 3308 spectrum 1 weight .10000E+01 volume .67534E-03 ppm1 2.241 ppm2 9.135 CV 1
ASSI { 3309}
(( segid " " and resid 65 and name HG11))
( segid " " and resid 65 and name HG2%)
2.700 .900 .900 peak 3309 spectrum 1 weight .10000E+01 volume .54441E-02 ppm1 1.421 ppm2 .898 CV 1
ASSI { 3310}
(( segid " " and resid 65 and name HG11))
(( segid " " and resid 65 and name HN ))
2.900 1.000 1.000 peak 3310 spectrum 1 weight .10000E+01 volume .13611E-02 ppm1 1.421 ppm2 7.752 CV 1
ASSI { 3311}
(( segid " " and resid 65 and name HG11))
(( segid " " and resid 65 and name HB ))
2.700 .900 .900 peak 3311 spectrum 1 weight .10000E+01 volume .20494E-02 ppm1 1.422 ppm2 2.216 CV 1
ASSI { 3312}
(( segid " " and resid 65 and name HG11))
(( segid " " and resid 63 and name HB1 ))
3.100 1.200 1.200 peak 3312 spectrum 1 weight .10000E+01 volume .83121E-03 ppm1 1.424 ppm2 2.550 CV 1
ASSI { 3314}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HA ))
2.700 .900 .900 peak 3314 spectrum 1 weight .10000E+01 volume .23793E-02 ppm1 3.225 ppm2 4.094 CV 1
ASSI { 3318}
(( segid " " and resid 59 and name HD1 ))
(( segid " " and resid 59 and name HB2 ))
2.900 1.000 1.000 peak 3318 spectrum 1 weight .10000E+01 volume .11585E-02 ppm1 3.179 ppm2 2.334 CV 1
ASSI { 3319}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HB2 ))
3.500 1.600 1.600 peak 3319 spectrum 1 weight .10000E+01 volume .10000E-02 ppm1 3.225 ppm2 2.330 CV 1
ASSI { 3323}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HD2 ))
3.400 1.400 1.400 peak 3323 spectrum 1 weight .10000E+01 volume .60260E-03 ppm1 2.325 ppm2 3.210 CV 1
OR { 3323}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HD1 ))
ASSI { 3326}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HD1 ))
2.600 .900 .900 peak 3326 spectrum 1 weight .10000E+01 volume .29404E-02 ppm1 1.907 ppm2 3.219 CV 1
OR { 3326}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 59 and name HD2 ))
OR { 3326}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 59 and name HD1 ))
OR { 3326}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HD2 ))
ASSI { 3327}
(( segid " " and resid 58 and name HG2 ))
(( segid " " and resid 58 and name HN ))
3.800 1.800 1.800 peak 3327 spectrum 1 weight .10000E+01 volume .16831E-02 ppm1 2.343 ppm2 7.611 CV 1
ASSI { 3328}
(( segid " " and resid 58 and name HG1 ))
(( segid " " and resid 58 and name HN ))
3.800 1.800 1.800 peak 3328 spectrum 1 weight .10000E+01 volume .14961E-02 ppm1 2.301 ppm2 7.601 CV 1
ASSI { 3329}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HN ))
2.700 .900 .900 peak 3329 spectrum 1 weight .10000E+01 volume .27481E-02 ppm1 4.037 ppm2 7.583 CV 1
ASSI { 3330}
(( segid " " and resid 58 and name HG2 ))
(( segid " " and resid 58 and name HE21))
3.400 1.500 1.500 peak 3330 spectrum 1 weight .10000E+01 volume .48832E-03 ppm1 2.342 ppm2 6.794 CV 1
ASSI { 3333}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HG2 ))
2.300 .700 .700 peak 3333 spectrum 1 weight .10000E+01 volume .76341E-02 ppm1 4.036 ppm2 2.334 CV 1
OR { 3333}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HG1 ))
ASSI { 3337}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 52 and name HN ))
3.900 1.900 1.900 peak 3337 spectrum 1 weight .10000E+01 volume .97146E-03 ppm1 2.296 ppm2 9.137 CV 1
ASSI { 3338}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 52 and name HN ))
3.100 1.200 1.200 peak 3338 spectrum 1 weight .10000E+01 volume .16910E-02 ppm1 2.036 ppm2 9.135 CV 1
ASSI { 3344}
(( segid " " and resid 52 and name HB2 ))
( segid " " and resid 53 and name HG2%)
3.600 1.600 1.600 peak 3344 spectrum 1 weight .10000E+01 volume .78703E-03 ppm1 2.033 ppm2 1.212 CV 1
OR { 3344}
(( segid " " and resid 52 and name HB1 ))
( segid " " and resid 53 and name HG2%)
ASSI { 3347}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 49 and name HA ))
3.000 1.100 1.100 peak 3347 spectrum 1 weight .10000E+01 volume .24468E-02 ppm1 2.040 ppm2 4.060 CV 1
ASSI { 3348}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 49 and name HN ))
4.000 2.000 2.000 peak 3348 spectrum 1 weight .10000E+01 volume .68313E-03 ppm1 2.035 ppm2 7.229 CV 1
ASSI { 3349}
(( segid " " and resid 49 and name HG1 ))
(( segid " " and resid 49 and name HA ))
3.100 1.200 1.200 peak 3349 spectrum 1 weight .10000E+01 volume .16234E-02 ppm1 1.943 ppm2 4.057 CV 1
ASSI { 3352}
(( segid " " and resid 73 and name HG ))
(( segid " " and resid 73 and name HB2 ))
2.900 1.100 1.100 peak 3352 spectrum 1 weight .10000E+01 volume .14312E-02 ppm1 2.030 ppm2 1.754 CV 1
ASSI { 3354}
(( segid " " and resid 49 and name HB1 ))
( segid " " and resid 56 and name HD2%)
3.000 1.100 1.100 peak 3354 spectrum 1 weight .10000E+01 volume .14857E-02 ppm1 2.037 ppm2 .583 CV 1
ASSI { 3357}
(( segid " " and resid 46 and name HB1 ))
( segid " " and resid 47 and name HG2%)
3.000 1.100 1.100 peak 3357 spectrum 1 weight .10000E+01 volume .18364E-02 ppm1 3.911 ppm2 .959 CV 1
OR { 3357}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 47 and name HG2%)
ASSI { 3358}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 47 and name HN ))
3.100 1.200 1.200 peak 3358 spectrum 1 weight .10000E+01 volume .13299E-02 ppm1 3.911 ppm2 8.056 CV 1
OR { 3358}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 47 and name HN ))
ASSI { 3360}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 47 and name HA ))
2.500 .800 .800 peak 3360 spectrum 1 weight .10000E+01 volume .82342E-02 ppm1 .963 ppm2 4.091 CV 1
ASSI { 3364}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 47 and name HN ))
3.000 1.100 1.100 peak 3364 spectrum 1 weight .10000E+01 volume .18390E-02 ppm1 .964 ppm2 8.056 CV 1
ASSI { 3368}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 48 and name HN ))
3.600 1.600 1.600 peak 3368 spectrum 1 weight .10000E+01 volume .75325E-03 ppm1 .963 ppm2 8.316 CV 1
ASSI { 3370}
(( segid " " and resid 61 and name HD2 ))
(( segid " " and resid 61 and name HB1 ))
2.700 .900 .900 peak 3370 spectrum 1 weight .10000E+01 volume .24910E-02 ppm1 3.293 ppm2 1.941 CV 1
OR { 3370}
(( segid " " and resid 61 and name HD2 ))
(( segid " " and resid 61 and name HB2 ))
ASSI { 3372}
(( segid " " and resid 61 and name HD2 ))
(( segid " " and resid 61 and name HE ))
3.300 1.400 1.400 peak 3372 spectrum 1 weight .10000E+01 volume .69871E-03 ppm1 3.285 ppm2 7.351 CV 1
ASSI { 3375}
(( segid " " and resid 61 and name HD2 ))
(( segid " " and resid 61 and name HG1 ))
2.600 .900 .900 peak 3375 spectrum 1 weight .10000E+01 volume .27793E-02 ppm1 3.292 ppm2 1.596 CV 1
ASSI { 3376}
(( segid " " and resid 61 and name HD2 ))
(( segid " " and resid 61 and name HG2 ))
2.800 1.000 1.000 peak 3376 spectrum 1 weight .10000E+01 volume .23247E-02 ppm1 3.292 ppm2 1.753 CV 1
ASSI { 3395}
(( segid " " and resid 51 and name HG1 ))
(( segid " " and resid 51 and name HN ))
2.800 1.000 1.000 peak 3395 spectrum 1 weight .10000E+01 volume .26131E-02 ppm1 2.288 ppm2 8.435 CV 1
ASSI { 3398}
(( segid " " and resid 51 and name HG2 ))
(( segid " " and resid 51 and name HN ))
2.600 .800 .800 peak 3398 spectrum 1 weight .10000E+01 volume .18650E-02 ppm1 2.359 ppm2 8.430 CV 1
ASSI { 3406}
(( segid " " and resid 107 and name HG1 ))
(( segid " " and resid 107 and name HA ))
2.900 1.000 1.000 peak 3406 spectrum 1 weight .10000E+01 volume .18183E-02 ppm1 1.297 ppm2 4.320 CV 1
OR { 3406}
(( segid " " and resid 107 and name HG2 ))
(( segid " " and resid 107 and name HA ))
ASSI { 3407}
(( segid " " and resid 107 and name HG2 ))
(( segid " " and resid 107 and name HN ))
4.000 2.000 2.000 peak 3407 spectrum 1 weight .10000E+01 volume .54288E-03 ppm1 1.294 ppm2 7.871 CV 1
OR { 3407}
(( segid " " and resid 107 and name HG1 ))
(( segid " " and resid 107 and name HN ))
ASSI { 3409}
(( segid " " and resid 106 and name HD1 ))
(( segid " " and resid 106 and name HN ))
3.300 1.300 1.300 peak 3409 spectrum 1 weight .10000E+01 volume .10832E-02 ppm1 7.181 ppm2 8.041 CV 1
ASSI { 3410}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 103 and name HN ))
2.500 .800 .800 peak 3410 spectrum 1 weight .10000E+01 volume .46884E-02 ppm1 4.375 ppm2 7.965 CV 1
ASSI { 3413}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 73 and name HN ))
3.500 1.500 1.500 peak 3413 spectrum 1 weight .10000E+01 volume .88314E-03 ppm1 4.289 ppm2 7.193 CV 1
ASSI { 3416}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 92 and name HN ))
4.600 2.600 1.400 peak 3416 spectrum 1 weight .10000E+01 volume .52207E-03 ppm1 7.130 ppm2 8.474 CV 1
ASSI { 3418}
(( segid " " and resid 105 and name HB2 ))
(( segid " " and resid 105 and name HA ))
2.500 .800 .800 peak 3418 spectrum 1 weight .10000E+01 volume .45118E-02 ppm1 1.961 ppm2 4.279 CV 1
ASSI { 3420}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HN ))
2.900 1.000 1.000 peak 3420 spectrum 1 weight .10000E+01 volume .14000E-02 ppm1 2.392 ppm2 7.717 CV 1
ASSI { 3428}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 106 and name HB1 ))
3.600 1.600 1.600 peak 3428 spectrum 1 weight .10000E+01 volume .69353E-03 ppm1 4.239 ppm2 3.242 CV 1
OR { 3428}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 106 and name HB2 ))
ASSI { 3429}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 104 and name HN ))
2.400 .700 .700 peak 3429 spectrum 1 weight .10000E+01 volume .48676E-02 ppm1 4.237 ppm2 7.890 CV 1
ASSI { 3435}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 78 and name HA ))
2.600 .900 .900 peak 3435 spectrum 1 weight .10000E+01 volume .28598E-02 ppm1 2.821 ppm2 4.097 CV 1
ASSI { 3436}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HN ))
2.700 .900 .900 peak 3436 spectrum 1 weight .10000E+01 volume .32209E-02 ppm1 4.011 ppm2 8.077 CV 1
ASSI { 3438}
(( segid " " and resid 100 and name HG2 ))
(( segid " " and resid 100 and name HN ))
3.900 1.900 1.900 peak 3438 spectrum 1 weight .10000E+01 volume .13247E-02 ppm1 1.705 ppm2 8.068 CV 1
ASSI { 3441}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 32 and name HZ ))
3.200 1.300 1.300 peak 3441 spectrum 1 weight .10000E+01 volume .12442E-02 ppm1 4.014 ppm2 6.998 CV 1
ASSI { 3442}
(( segid " " and resid 100 and name HB1 ))
(( segid " " and resid 97 and name HA ))
3.100 1.200 1.200 peak 3442 spectrum 1 weight .10000E+01 volume .95070E-03 ppm1 1.741 ppm2 4.231 CV 1
ASSI { 3443}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HD1 ))
3.900 1.900 1.900 peak 3443 spectrum 1 weight .10000E+01 volume .95849E-03 ppm1 4.012 ppm2 3.070 CV 1
OR { 3443}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HD2 ))
ASSI { 3444}
(( segid " " and resid 100 and name HG1 ))
(( segid " " and resid 100 and name HA ))
3.300 1.400 1.400 peak 3444 spectrum 1 weight .10000E+01 volume .16442E-02 ppm1 1.517 ppm2 4.035 CV 1
ASSI { 3445}
(( segid " " and resid 100 and name HG2 ))
(( segid " " and resid 100 and name HA ))
2.700 .900 .900 peak 3445 spectrum 1 weight .10000E+01 volume .24104E-02 ppm1 1.708 ppm2 4.024 CV 1
ASSI { 3454}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HG12))
2.900 1.100 1.100 peak 3454 spectrum 1 weight .10000E+01 volume .16052E-02 ppm1 3.547 ppm2 1.585 CV 1
ASSI { 3459}
(( segid " " and resid 99 and name HB1 ))
(( segid " " and resid 96 and name HA ))
3.400 1.400 1.400 peak 3459 spectrum 1 weight .10000E+01 volume .80261E-03 ppm1 1.753 ppm2 3.569 CV 1
ASSI { 3460}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 99 and name HN ))
2.800 1.000 1.000 peak 3460 spectrum 1 weight .10000E+01 volume .23170E-02 ppm1 4.101 ppm2 7.793 CV 1
ASSI { 3464}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HD1 ))
3.000 1.100 1.100 peak 3464 spectrum 1 weight .10000E+01 volume .48105E-02 ppm1 4.133 ppm2 1.708 CV 1
OR { 3464}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HD2 ))
ASSI { 3465}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HG1 ))
2.400 .700 .700 peak 3465 spectrum 1 weight .10000E+01 volume .34417E-02 ppm1 4.133 ppm2 1.516 CV 1
ASSI { 3466}
(( segid " " and resid 101 and name HB2 ))
(( segid " " and resid 98 and name HA ))
2.900 1.100 1.100 peak 3466 spectrum 1 weight .10000E+01 volume .14468E-02 ppm1 2.775 ppm2 4.146 CV 1
ASSI { 3467}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HN ))
2.500 .800 .800 peak 3467 spectrum 1 weight .10000E+01 volume .37923E-02 ppm1 4.133 ppm2 8.111 CV 1
ASSI { 3468}
(( segid " " and resid 101 and name HB1 ))
(( segid " " and resid 98 and name HA ))
3.300 1.400 1.400 peak 3468 spectrum 1 weight .10000E+01 volume .11871E-02 ppm1 2.700 ppm2 4.160 CV 1
ASSI { 3472}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 98 and name HE2 ))
3.500 1.600 1.600 peak 3472 spectrum 1 weight .10000E+01 volume .13611E-02 ppm1 1.960 ppm2 2.983 CV 1
OR { 3472}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 98 and name HE1 ))
OR { 3472}
(( segid " " and resid 98 and name HB1 ))
(( segid " " and resid 98 and name HE2 ))
OR { 3472}
(( segid " " and resid 98 and name HB1 ))
(( segid " " and resid 98 and name HE1 ))
ASSI { 3475}
(( segid " " and resid 98 and name HD1 ))
(( segid " " and resid 99 and name HN ))
3.200 1.300 1.300 peak 3475 spectrum 1 weight .10000E+01 volume .42079E-03 ppm1 1.690 ppm2 7.793 CV 1
OR { 3475}
(( segid " " and resid 98 and name HD2 ))
(( segid " " and resid 99 and name HN ))
ASSI { 3476}
(( segid " " and resid 98 and name HE1 ))
(( segid " " and resid 98 and name HG1 ))
2.500 .800 .800 peak 3476 spectrum 1 weight .10000E+01 volume .48780E-02 ppm1 2.962 ppm2 1.504 CV 1
OR { 3476}
(( segid " " and resid 98 and name HE2 ))
(( segid " " and resid 98 and name HG1 ))
ASSI { 3479}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HB1 ))
2.700 .900 .900 peak 3479 spectrum 1 weight .10000E+01 volume .36572E-02 ppm1 4.216 ppm2 2.854 CV 1
ASSI { 3480}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HB2 ))
2.600 .800 .800 peak 3480 spectrum 1 weight .10000E+01 volume .34209E-02 ppm1 4.217 ppm2 3.049 CV 1
ASSI { 3481}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 97 and name HB2 ))
2.700 .900 .900 peak 3481 spectrum 1 weight .10000E+01 volume .24572E-02 ppm1 3.688 ppm2 3.043 CV 1
ASSI { 3483}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 97 and name HB1 ))
3.200 1.200 1.200 peak 3483 spectrum 1 weight .10000E+01 volume .14572E-02 ppm1 3.688 ppm2 2.855 CV 1
ASSI { 3484}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 97 and name HB2 ))
1.800 .400 .400 peak 3484 spectrum 1 weight .10000E+01 volume .10237E-01 ppm1 2.834 ppm2 3.043 CV 1
ASSI { 3486}
(( segid " " and resid 97 and name HB2 ))
( segid " " and resid 94 and name HG2%)
4.000 2.000 2.000 peak 3486 spectrum 1 weight .10000E+01 volume .61300E-03 ppm1 3.035 ppm2 .939 CV 1
ASSI { 3490}
(( segid " " and resid 97 and name HB1 ))
( segid " " and resid 94 and name HG2%)
3.700 1.700 1.700 peak 3490 spectrum 1 weight .10000E+01 volume .57143E-03 ppm1 2.834 ppm2 .926 CV 1
ASSI { 3493}
(( segid " " and resid 96 and name HB ))
(( segid " " and resid 93 and name HA ))
2.800 1.000 1.000 peak 3493 spectrum 1 weight .10000E+01 volume .19065E-02 ppm1 1.745 ppm2 3.808 CV 1
ASSI { 3498}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HN ))
2.700 .900 .900 peak 3498 spectrum 1 weight .10000E+01 volume .27066E-02 ppm1 3.790 ppm2 8.275 CV 1
ASSI { 3499}
(( segid " " and resid 96 and name HB ))
(( segid " " and resid 96 and name HG12))
3.100 1.200 1.200 peak 3499 spectrum 1 weight .10000E+01 volume .17481E-02 ppm1 1.742 ppm2 1.579 CV 1
ASSI { 3507}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HN ))
2.700 .900 .900 peak 3507 spectrum 1 weight .10000E+01 volume .28572E-02 ppm1 4.082 ppm2 8.585 CV 1
ASSI { 3515}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HN ))
2.800 1.000 1.000 peak 3515 spectrum 1 weight .10000E+01 volume .22546E-02 ppm1 3.690 ppm2 8.448 CV 1
ASSI { 3517}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HG11))
2.600 .800 .800 peak 3517 spectrum 1 weight .10000E+01 volume .38884E-02 ppm1 3.688 ppm2 1.165 CV 1
ASSI { 3519}
(( segid " " and resid 94 and name HB ))
(( segid " " and resid 91 and name HA ))
2.700 .900 .900 peak 3519 spectrum 1 weight .10000E+01 volume .20624E-02 ppm1 2.009 ppm2 3.933 CV 1
ASSI { 3522}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB1 ))
2.400 .700 .700 peak 3522 spectrum 1 weight .10000E+01 volume .44651E-02 ppm1 4.371 ppm2 2.789 CV 1
ASSI { 3523}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB2 ))
2.600 .800 .800 peak 3523 spectrum 1 weight .10000E+01 volume .39560E-02 ppm1 4.369 ppm2 2.955 CV 1
ASSI { 3526}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HN ))
2.800 .900 .900 peak 3526 spectrum 1 weight .10000E+01 volume .23611E-02 ppm1 3.642 ppm2 8.399 CV 1
ASSI { 3528}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 50 and name HN ))
3.100 1.200 1.200 peak 3528 spectrum 1 weight .10000E+01 volume .13429E-02 ppm1 3.645 ppm2 6.721 CV 1
ASSI { 3531}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 93 and name HB1 ))
2.600 .900 .900 peak 3531 spectrum 1 weight .10000E+01 volume .33248E-02 ppm1 3.642 ppm2 2.071 CV 1
OR { 3531}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 93 and name HB2 ))
ASSI { 3533}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HG12))
2.700 .900 .900 peak 3533 spectrum 1 weight .10000E+01 volume .24572E-02 ppm1 3.643 ppm2 1.645 CV 1
ASSI { 3535}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HG11))
2.500 .800 .800 peak 3535 spectrum 1 weight .10000E+01 volume .38339E-02 ppm1 3.642 ppm2 1.102 CV 1
ASSI { 3542}
(( segid " " and resid 93 and name HD1 ))
(( segid " " and resid 93 and name HA ))
3.300 1.400 1.400 peak 3542 spectrum 1 weight .10000E+01 volume .13273E-02 ppm1 1.448 ppm2 3.806 CV 1
ASSI { 3544}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HE2 ))
4.300 2.300 1.700 peak 3544 spectrum 1 weight .10000E+01 volume .60260E-03 ppm1 3.788 ppm2 3.015 CV 1
ASSI { 3547}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HE1 ))
4.300 2.300 1.700 peak 3547 spectrum 1 weight .10000E+01 volume .54288E-03 ppm1 3.795 ppm2 2.924 CV 1
ASSI { 3549}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HN ))
3.000 1.100 1.100 peak 3549 spectrum 1 weight .10000E+01 volume .12883E-02 ppm1 3.792 ppm2 8.701 CV 1
ASSI { 3553}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 93 and name HE1 ))
2.900 1.000 1.000 peak 3553 spectrum 1 weight .10000E+01 volume .20520E-02 ppm1 1.454 ppm2 2.924 CV 1
OR { 3553}
(( segid " " and resid 93 and name HG1 ))
(( segid " " and resid 93 and name HE1 ))
ASSI { 3557}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 92 and name HB2 ))
2.700 .900 .900 peak 3557 spectrum 1 weight .10000E+01 volume .24598E-02 ppm1 4.042 ppm2 3.253 CV 1
ASSI { 3558}
(( segid " " and resid 92 and name HB1 ))
(( segid " " and resid 89 and name HA ))
3.000 1.100 1.100 peak 3558 spectrum 1 weight .10000E+01 volume .12805E-02 ppm1 3.137 ppm2 4.060 CV 1
ASSI { 3561}
(( segid " " and resid 92 and name HB2 ))
( segid " " and resid 48 and name HD2%)
3.100 1.200 1.200 peak 3561 spectrum 1 weight .10000E+01 volume .12650E-02 ppm1 3.257 ppm2 .686 CV 1
ASSI { 3565}
(( segid " " and resid 73 and name HB1 ))
(( segid " " and resid 73 and name HN ))
3.600 1.600 1.600 peak 3565 spectrum 1 weight .10000E+01 volume .12935E-02 ppm1 1.359 ppm2 7.210 CV 1
ASSI { 3566}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 91 and name HB1 ))
2.500 .800 .800 peak 3566 spectrum 1 weight .10000E+01 volume .41274E-02 ppm1 1.361 ppm2 1.878 CV 1
OR { 3566}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 91 and name HB2 ))
ASSI { 3569}
(( segid " " and resid 90 and name HB ))
(( segid " " and resid 90 and name HN ))
2.400 .700 .700 peak 3569 spectrum 1 weight .10000E+01 volume .40390E-02 ppm1 1.906 ppm2 8.393 CV 1
ASSI { 3578}
(( segid " " and resid 90 and name HB ))
( segid " " and resid 89 and name HB% )
4.100 2.100 1.900 peak 3578 spectrum 1 weight .10000E+01 volume .86756E-03 ppm1 1.907 ppm2 1.377 CV 1
ASSI { 3581}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 88 and name HB1 ))
3.600 1.600 1.600 peak 3581 spectrum 1 weight .10000E+01 volume .17066E-02 ppm1 3.073 ppm2 1.687 CV 1
ASSI { 3582}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 88 and name HB2 ))
3.900 1.900 1.900 peak 3582 spectrum 1 weight .10000E+01 volume .88314E-03 ppm1 3.075 ppm2 1.844 CV 1
ASSI { 3584}
(( segid " " and resid 88 and name HB1 ))
(( segid " " and resid 88 and name HD1 ))
3.100 1.200 1.200 peak 3584 spectrum 1 weight .10000E+01 volume .19403E-02 ppm1 1.684 ppm2 1.471 CV 1
OR { 3584}
(( segid " " and resid 88 and name HB1 ))
(( segid " " and resid 88 and name HD2 ))
ASSI { 3589}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 90 and name HB ))
2.700 .900 .900 peak 3589 spectrum 1 weight .10000E+01 volume .29118E-02 ppm1 4.369 ppm2 1.908 CV 1
ASSI { 3590}
(( segid " " and resid 88 and name HD2 ))
(( segid " " and resid 88 and name HN ))
4.200 2.200 1.800 peak 3590 spectrum 1 weight .10000E+01 volume .64156E-03 ppm1 1.439 ppm2 7.850 CV 1
OR { 3590}
(( segid " " and resid 88 and name HD1 ))
(( segid " " and resid 88 and name HN ))
ASSI { 3591}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 88 and name HB1 ))
4.300 2.300 1.700 peak 3591 spectrum 1 weight .10000E+01 volume .89354E-03 ppm1 2.945 ppm2 1.694 CV 1
ASSI { 3593}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 88 and name HB1 ))
4.200 2.200 1.800 peak 3593 spectrum 1 weight .10000E+01 volume .96628E-03 ppm1 2.787 ppm2 1.687 CV 1
ASSI { 3601}
(( segid " " and resid 86 and name HA ))
( segid " " and resid 89 and name HB% )
2.300 .700 .700 peak 3601 spectrum 1 weight .10000E+01 volume .55220E-02 ppm1 3.928 ppm2 1.391 CV 1
ASSI { 3603}
(( segid " " and resid 86 and name HG ))
(( segid " " and resid 86 and name HN ))
3.700 1.700 1.700 peak 3603 spectrum 1 weight .10000E+01 volume .13351E-02 ppm1 1.680 ppm2 8.355 CV 1
ASSI { 3605}
( segid " " and resid 86 and name HD2%)
(( segid " " and resid 86 and name HN ))
3.900 1.900 1.900 peak 3605 spectrum 1 weight .10000E+01 volume .13065E-02 ppm1 .860 ppm2 8.355 CV 1
ASSI { 3606}
( segid " " and resid 86 and name HD2%)
(( segid " " and resid 87 and name HN ))
4.100 2.100 1.900 peak 3606 spectrum 1 weight .10000E+01 volume .87796E-03 ppm1 .860 ppm2 8.111 CV 1
ASSI { 3609}
( segid " " and resid 86 and name HD2%)
(( segid " " and resid 86 and name HA ))
3.200 1.300 1.300 peak 3609 spectrum 1 weight .10000E+01 volume .29326E-02 ppm1 .860 ppm2 3.953 CV 1
ASSI { 3611}
( segid " " and resid 86 and name HD2%)
(( segid " " and resid 86 and name HG ))
1.900 .500 .500 peak 3611 spectrum 1 weight .10000E+01 volume .17385E-01 ppm1 .860 ppm2 1.696 CV 1
ASSI { 3615}
(( segid " " and resid 85 and name HB1 ))
(( segid " " and resid 88 and name HB1 ))
3.000 1.100 1.100 peak 3615 spectrum 1 weight .10000E+01 volume .18702E-02 ppm1 2.673 ppm2 1.683 CV 1
ASSI { 3617}
(( segid " " and resid 85 and name HB1 ))
(( segid " " and resid 88 and name HB2 ))
2.900 1.000 1.000 peak 3617 spectrum 1 weight .10000E+01 volume .10987E-02 ppm1 2.672 ppm2 1.843 CV 1
ASSI { 3627}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HN ))
2.400 .700 .700 peak 3627 spectrum 1 weight .10000E+01 volume .70108E-02 ppm1 4.426 ppm2 8.120 CV 1
ASSI { 3629}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 80 and name HB2 ))
2.600 .800 .800 peak 3629 spectrum 1 weight .10000E+01 volume .42702E-02 ppm1 4.402 ppm2 2.906 CV 1
ASSI { 3632}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HB1 ))
2.700 .900 .900 peak 3632 spectrum 1 weight .10000E+01 volume .33949E-02 ppm1 4.446 ppm2 2.947 CV 1
ASSI { 3635}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 79 and name HA ))
3.200 1.300 1.300 peak 3635 spectrum 1 weight .10000E+01 volume .92210E-03 ppm1 3.221 ppm2 3.574 CV 1
ASSI { 3637}
(( segid " " and resid 82 and name HB1 ))
(( segid " " and resid 82 and name HB2 ))
2.000 .500 .500 peak 3637 spectrum 1 weight .10000E+01 volume .54806E-02 ppm1 2.919 ppm2 3.235 CV 1
ASSI { 3642}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB2 ))
2.600 .900 .900 peak 3642 spectrum 1 weight .10000E+01 volume .40365E-02 ppm1 4.330 ppm2 2.650 CV 1
ASSI { 3644}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 88 and name HB1 ))
2.900 1.000 1.000 peak 3644 spectrum 1 weight .10000E+01 volume .13974E-02 ppm1 3.220 ppm2 1.684 CV 1
ASSI { 3648}
(( segid " " and resid 82 and name HB1 ))
(( segid " " and resid 79 and name HB1 ))
3.000 3.000 3.000 peak 3648 spectrum 1 weight .10000E+01 volume .64935E-03 ppm1 2.919 ppm2 1.916 CV 1
ASSI { 3650}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB1 ))
2.700 .900 .900 peak 3650 spectrum 1 weight .10000E+01 volume .39170E-02 ppm1 3.562 ppm2 1.913 CV 1
ASSI { 3659}
(( segid " " and resid 79 and name HG1 ))
(( segid " " and resid 79 and name HN ))
4.400 2.400 1.600 peak 3659 spectrum 1 weight .10000E+01 volume .60260E-03 ppm1 1.887 ppm2 8.903 CV 1
ASSI { 3668}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB ))
2.700 .900 .900 peak 3668 spectrum 1 weight .10000E+01 volume .30494E-02 ppm1 4.070 ppm2 3.309 CV 1
ASSI { 3670}
(( segid " " and resid 81 and name HB2 ))
(( segid " " and resid 81 and name HN ))
2.900 1.100 1.100 peak 3670 spectrum 1 weight .10000E+01 volume .13455E-02 ppm1 1.956 ppm2 8.270 CV 1
ASSI { 3672}
(( segid " " and resid 81 and name HB1 ))
(( segid " " and resid 81 and name HN ))
3.000 1.100 1.100 peak 3672 spectrum 1 weight .10000E+01 volume .12026E-02 ppm1 1.368 ppm2 8.274 CV 1
ASSI { 3676}
(( segid " " and resid 81 and name HB2 ))
( segid " " and resid 81 and name HD2%)
2.800 1.000 1.000 peak 3676 spectrum 1 weight .10000E+01 volume .37352E-02 ppm1 1.956 ppm2 .894 CV 1
ASSI { 3679}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 81 and name HD2%)
2.400 .700 .700 peak 3679 spectrum 1 weight .10000E+01 volume .81065E-02 ppm1 4.091 ppm2 .926 CV 1
ASSI { 3681}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 81 and name HB1 ))
2.900 1.000 1.000 peak 3681 spectrum 1 weight .10000E+01 volume .18001E-02 ppm1 4.096 ppm2 1.390 CV 1
ASSI { 3687}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 78 and name HB2 ))
2.000 .500 .500 peak 3687 spectrum 1 weight .10000E+01 volume .54130E-02 ppm1 2.819 ppm2 3.446 CV 1
ASSI { 3693}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HB2 ))
2.800 1.000 1.000 peak 3693 spectrum 1 weight .10000E+01 volume .22001E-02 ppm1 4.418 ppm2 3.087 CV 1
ASSI { 3698}
(( segid " " and resid 76 and name HB2 ))
(( segid " " and resid 76 and name HN ))
2.700 .900 .900 peak 3698 spectrum 1 weight .10000E+01 volume .18208E-02 ppm1 2.174 ppm2 8.828 CV 1
ASSI { 3702}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 76 and name HE21))
3.100 1.200 1.200 peak 3702 spectrum 1 weight .10000E+01 volume .97925E-03 ppm1 2.422 ppm2 6.706 CV 1
ASSI { 3705}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 76 and name HE22))
3.600 1.700 1.700 peak 3705 spectrum 1 weight .10000E+01 volume .15247E-02 ppm1 2.423 ppm2 7.675 CV 1
ASSI { 3706}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 76 and name HN ))
4.400 2.400 1.600 peak 3706 spectrum 1 weight .10000E+01 volume .49352E-03 ppm1 2.422 ppm2 8.820 CV 1
ASSI { 3714}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name HB1 ))
1.900 .500 .500 peak 3714 spectrum 1 weight .10000E+01 volume .64728E-02 ppm1 1.878 ppm2 1.571 CV 1
ASSI { 3718}
(( segid " " and resid 77 and name HB1 ))
(( segid " " and resid 74 and name HN ))
4.100 2.100 1.900 peak 3718 spectrum 1 weight .10000E+01 volume .46754E-03 ppm1 2.766 ppm2 9.274 CV 1
ASSI { 3720}
(( segid " " and resid 73 and name HG ))
(( segid " " and resid 73 and name HA ))
3.600 1.600 1.600 peak 3720 spectrum 1 weight .10000E+01 volume .48573E-03 ppm1 2.032 ppm2 4.488 CV 1
ASSI { 3724}
( segid " " and resid 73 and name HD2%)
(( segid " " and resid 73 and name HN ))
3.200 1.300 1.300 peak 3724 spectrum 1 weight .10000E+01 volume .34624E-02 ppm1 .840 ppm2 7.205 CV 1
ASSI { 3725}
( segid " " and resid 73 and name HD2%)
(( segid " " and resid 73 and name HA ))
3.100 1.200 1.200 peak 3725 spectrum 1 weight .10000E+01 volume .15741E-02 ppm1 .839 ppm2 4.486 CV 1
ASSI { 3727}
( segid " " and resid 73 and name HD2%)
(( segid " " and resid 73 and name HG ))
2.200 .600 .600 peak 3727 spectrum 1 weight .10000E+01 volume .87249E-02 ppm1 .841 ppm2 2.047 CV 1
ASSI { 3728}
( segid " " and resid 73 and name HD2%)
(( segid " " and resid 73 and name HB1 ))
2.300 .700 .700 peak 3728 spectrum 1 weight .10000E+01 volume .54130E-02 ppm1 .840 ppm2 1.389 CV 1
ASSI { 3729}
(( segid " " and resid 72 and name HG1 ))
(( segid " " and resid 72 and name HN ))
3.600 1.600 1.600 peak 3729 spectrum 1 weight .10000E+01 volume .99745E-03 ppm1 2.160 ppm2 7.384 CV 1
ASSI { 3732}
(( segid " " and resid 72 and name HG2 ))
(( segid " " and resid 72 and name HN ))
3.400 1.400 1.400 peak 3732 spectrum 1 weight .10000E+01 volume .96628E-03 ppm1 2.322 ppm2 7.375 CV 1
ASSI { 3734}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HN ))
3.200 1.300 1.300 peak 3734 spectrum 1 weight .10000E+01 volume .80522E-03 ppm1 2.302 ppm2 7.367 CV 1
ASSI { 3735}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HA ))
2.700 .900 .900 peak 3735 spectrum 1 weight .10000E+01 volume .33014E-02 ppm1 2.284 ppm2 4.311 CV 1
ASSI { 3757}
(( segid " " and resid 71 and name HD2 ))
(( segid " " and resid 71 and name HB1 ))
3.300 1.300 1.300 peak 3757 spectrum 1 weight .10000E+01 volume .30624E-02 ppm1 3.550 ppm2 1.754 CV 1
ASSI { 3760}
(( segid " " and resid 71 and name HD2 ))
(( segid " " and resid 70 and name HB1 ))
3.900 1.900 1.900 peak 3760 spectrum 1 weight .10000E+01 volume .10987E-02 ppm1 3.544 ppm2 1.134 CV 1
ASSI { 3761}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 71 and name HG1 ))
2.600 .900 .900 peak 3761 spectrum 1 weight .10000E+01 volume .17221E-02 ppm1 3.441 ppm2 1.514 CV 1
ASSI { 3763}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 71 and name HB1 ))
2.900 1.100 1.100 peak 3763 spectrum 1 weight .10000E+01 volume .36936E-02 ppm1 3.440 ppm2 1.761 CV 1
ASSI { 3768}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 70 and name HB1 ))
3.100 1.200 1.200 peak 3768 spectrum 1 weight .10000E+01 volume .10390E-02 ppm1 3.442 ppm2 1.135 CV 1
ASSI { 3772}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 70 and name HN ))
2.800 1.000 1.000 peak 3772 spectrum 1 weight .10000E+01 volume .17611E-02 ppm1 3.440 ppm2 7.466 CV 1
ASSI { 3775}
( segid " " and resid 70 and name HD1%)
(( segid " " and resid 70 and name HN ))
3.500 1.500 1.500 peak 3775 spectrum 1 weight .10000E+01 volume .15169E-02 ppm1 .769 ppm2 7.475 CV 1
ASSI { 3776}
( segid " " and resid 70 and name HD2%)
(( segid " " and resid 70 and name HN ))
3.700 1.800 1.800 peak 3776 spectrum 1 weight .10000E+01 volume .10858E-02 ppm1 .750 ppm2 7.479 CV 1
ASSI { 3777}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HN ))
3.000 1.100 1.100 peak 3777 spectrum 1 weight .10000E+01 volume .12364E-02 ppm1 3.995 ppm2 7.475 CV 1
ASSI { 3780}
(( segid " " and resid 70 and name HG ))
(( segid " " and resid 70 and name HB1 ))
3.100 1.200 1.200 peak 3780 spectrum 1 weight .10000E+01 volume .14442E-02 ppm1 1.788 ppm2 1.137 CV 1
ASSI { 3783}
( segid " " and resid 70 and name HD1%)
( segid " " and resid 96 and name HD1%)
2.800 1.000 1.000 peak 3783 spectrum 1 weight .10000E+01 volume .40417E-02 ppm1 .767 ppm2 .263 CV 1
ASSI { 3785}
( segid " " and resid 70 and name HD2%)
(( segid " " and resid 70 and name HA ))
3.200 1.300 1.300 peak 3785 spectrum 1 weight .10000E+01 volume .12779E-02 ppm1 .752 ppm2 4.029 CV 1
ASSI { 3789}
(( segid " " and resid 69 and name HB1 ))
(( segid " " and resid 69 and name HN ))
2.800 1.000 1.000 peak 3789 spectrum 1 weight .10000E+01 volume .19143E-02 ppm1 1.620 ppm2 7.542 CV 1
ASSI { 3790}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HN ))
2.700 .900 .900 peak 3790 spectrum 1 weight .10000E+01 volume .25923E-02 ppm1 4.335 ppm2 7.539 CV 1
ASSI { 3792}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB1 ))
2.500 .800 .800 peak 3792 spectrum 1 weight .10000E+01 volume .52779E-02 ppm1 4.333 ppm2 1.646 CV 1
ASSI { 3795}
( segid " " and resid 69 and name HD1%)
(( segid " " and resid 69 and name HA ))
2.200 .600 .600 peak 3795 spectrum 1 weight .10000E+01 volume .13021E-01 ppm1 .894 ppm2 4.353 CV 1
ASSI { 3796}
( segid " " and resid 69 and name HD1%)
(( segid " " and resid 69 and name HN ))
3.500 1.500 1.500 peak 3796 spectrum 1 weight .10000E+01 volume .18260E-02 ppm1 .894 ppm2 7.542 CV 1
ASSI { 3798}
(( segid " " and resid 69 and name HB2 ))
( segid " " and resid 69 and name HD1%)
2.500 .800 .800 peak 3798 spectrum 1 weight .10000E+01 volume .41845E-02 ppm1 1.873 ppm2 .912 CV 1
ASSI { 3800}
(( segid " " and resid 69 and name HB1 ))
( segid " " and resid 69 and name HD2%)
2.500 .800 .800 peak 3800 spectrum 1 weight .10000E+01 volume .37326E-02 ppm1 1.619 ppm2 1.086 CV 1
ASSI { 3801}
(( segid " " and resid 69 and name HG ))
(( segid " " and resid 69 and name HN ))
3.300 1.300 1.300 peak 3801 spectrum 1 weight .10000E+01 volume .18286E-02 ppm1 1.710 ppm2 7.547 CV 1
ASSI { 3802}
(( segid " " and resid 69 and name HG ))
(( segid " " and resid 69 and name HA ))
2.900 1.000 1.000 peak 3802 spectrum 1 weight .10000E+01 volume .18962E-02 ppm1 1.705 ppm2 4.346 CV 1
ASSI { 3803}
(( segid " " and resid 100 and name HG2 ))
(( segid " " and resid 100 and name HD2 ))
2.800 1.000 1.000 peak 3803 spectrum 1 weight .10000E+01 volume .33871E-02 ppm1 1.704 ppm2 3.081 CV 1
ASSI { 3805}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 71 and name HD1 ))
3.400 1.500 1.500 peak 3805 spectrum 1 weight .10000E+01 volume .96105E-03 ppm1 4.371 ppm2 3.460 CV 1
ASSI { 3808}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 40 and name HN ))
2.600 .800 .800 peak 3808 spectrum 1 weight .10000E+01 volume .30728E-02 ppm1 1.330 ppm2 8.227 CV 1
ASSI { 3813}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB ))
2.700 .900 .900 peak 3813 spectrum 1 weight .10000E+01 volume .22312E-02 ppm1 4.245 ppm2 2.677 CV 1
ASSI { 3823}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 65 and name HN ))
3.500 1.600 1.600 peak 3823 spectrum 1 weight .10000E+01 volume .23274E-02 ppm1 .894 ppm2 7.753 CV 1
ASSI { 3826}
(( segid " " and resid 65 and name HB ))
(( segid " " and resid 65 and name HA ))
3.100 1.200 1.200 peak 3826 spectrum 1 weight .10000E+01 volume .15221E-02 ppm1 2.199 ppm2 3.995 CV 1
ASSI { 3830}
(( segid " " and resid 65 and name HB ))
(( segid " " and resid 65 and name HG12))
3.100 1.200 1.200 peak 3830 spectrum 1 weight .10000E+01 volume .13299E-02 ppm1 2.201 ppm2 1.589 CV 1
ASSI { 3837}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 65 and name HG12))
3.600 1.600 1.600 peak 3837 spectrum 1 weight .10000E+01 volume .12910E-02 ppm1 2.896 ppm2 1.585 CV 1
ASSI { 3838}
(( segid " " and resid 65 and name HG12))
(( segid " " and resid 65 and name HA ))
2.700 .900 .900 peak 3838 spectrum 1 weight .10000E+01 volume .25092E-02 ppm1 1.580 ppm2 3.985 CV 1
ASSI { 3839}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 65 and name HG11))
3.200 1.300 1.300 peak 3839 spectrum 1 weight .10000E+01 volume .12208E-02 ppm1 2.898 ppm2 1.447 CV 1
ASSI { 3840}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 65 and name HG12))
3.400 1.400 1.400 peak 3840 spectrum 1 weight .10000E+01 volume .99745E-03 ppm1 2.532 ppm2 1.585 CV 1
ASSI { 3843}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 65 and name HA ))
2.200 .600 .600 peak 3843 spectrum 1 weight .10000E+01 volume .93378E-02 ppm1 .893 ppm2 3.993 CV 1
ASSI { 3847}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 65 and name HB ))
2.200 .600 .600 peak 3847 spectrum 1 weight .10000E+01 volume .92599E-02 ppm1 .892 ppm2 2.219 CV 1
ASSI { 3851}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 64 and name HA ))
2.600 .900 .900 peak 3851 spectrum 1 weight .10000E+01 volume .33066E-02 ppm1 2.473 ppm2 4.286 CV 1
ASSI { 3852}
(( segid " " and resid 64 and name HB2 ))
(( segid " " and resid 64 and name HA ))
2.900 1.000 1.000 peak 3852 spectrum 1 weight .10000E+01 volume .27014E-02 ppm1 3.063 ppm2 4.282 CV 1
ASSI { 3855}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 63 and name HN ))
3.800 1.800 1.800 peak 3855 spectrum 1 weight .10000E+01 volume .91692E-03 ppm1 2.139 ppm2 7.555 CV 1
ASSI { 3856}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HN ))
2.600 .900 .900 peak 3856 spectrum 1 weight .10000E+01 volume .22235E-02 ppm1 2.900 ppm2 7.587 CV 1
ASSI { 3857}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 63 and name HN ))
3.100 1.200 1.200 peak 3857 spectrum 1 weight .10000E+01 volume .97664E-03 ppm1 2.031 ppm2 7.574 CV 1
ASSI { 3859}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 63 and name HD21))
3.200 1.300 1.300 peak 3859 spectrum 1 weight .10000E+01 volume .96105E-03 ppm1 2.531 ppm2 7.342 CV 1
ASSI { 3860}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HD21))
3.100 1.200 1.200 peak 3860 spectrum 1 weight .10000E+01 volume .87273E-03 ppm1 2.895 ppm2 7.327 CV 1
ASSI { 3864}
(( segid " " and resid 62 and name HG2 ))
(( segid " " and resid 62 and name HN ))
4.000 2.000 2.000 peak 3864 spectrum 1 weight .10000E+01 volume .13195E-02 ppm1 2.471 ppm2 8.617 CV 1
ASSI { 3867}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 62 and name HN ))
3.300 1.400 1.400 peak 3867 spectrum 1 weight .10000E+01 volume .16702E-02 ppm1 2.030 ppm2 8.611 CV 1
ASSI { 3869}
(( segid " " and resid 62 and name HG2 ))
(( segid " " and resid 62 and name HA ))
2.800 1.000 1.000 peak 3869 spectrum 1 weight .10000E+01 volume .26338E-02 ppm1 2.468 ppm2 4.060 CV 1
ASSI { 3871}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HG2 ))
3.000 1.100 1.100 peak 3871 spectrum 1 weight .10000E+01 volume .27975E-02 ppm1 2.140 ppm2 2.487 CV 1
ASSI { 3872}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 62 and name HG2 ))
2.600 .800 .800 peak 3872 spectrum 1 weight .10000E+01 volume .32832E-02 ppm1 2.031 ppm2 2.488 CV 1
ASSI { 3874}
(( segid " " and resid 61 and name HG1 ))
(( segid " " and resid 61 and name HN ))
4.300 2.300 1.700 peak 3874 spectrum 1 weight .10000E+01 volume .63120E-03 ppm1 1.578 ppm2 7.450 CV 1
ASSI { 3883}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 61 and name HD2 ))
3.500 1.600 1.600 peak 3883 spectrum 1 weight .10000E+01 volume .19377E-02 ppm1 1.004 ppm2 3.315 CV 1
ASSI { 3886}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 60 and name HB2 ))
2.700 .900 .900 peak 3886 spectrum 1 weight .10000E+01 volume .15663E-02 ppm1 3.816 ppm2 2.049 CV 1
ASSI { 3892}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HD1 ))
2.500 .800 .800 peak 3892 spectrum 1 weight .10000E+01 volume .43794E-02 ppm1 4.083 ppm2 3.222 CV 1
OR { 3892}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HD2 ))
ASSI { 3893}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB2 ))
2.600 .800 .800 peak 3893 spectrum 1 weight .10000E+01 volume .41534E-02 ppm1 4.085 ppm2 2.331 CV 1
ASSI { 3894}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 59 and name HA ))
2.700 .900 .900 peak 3894 spectrum 1 weight .10000E+01 volume .30962E-02 ppm1 1.844 ppm2 4.083 CV 1
ASSI { 3898}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 58 and name HB2 ))
2.400 .700 .700 peak 3898 spectrum 1 weight .10000E+01 volume .56497E-02 ppm1 4.234 ppm2 2.168 CV 1
OR { 3898}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 58 and name HB1 ))
ASSI { 3899}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 58 and name HB1 ))
3.400 1.400 1.400 peak 3899 spectrum 1 weight .10000E+01 volume .70132E-03 ppm1 3.220 ppm2 2.139 CV 1
ASSI { 3902}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB2 ))
3.100 1.200 1.200 peak 3902 spectrum 1 weight .10000E+01 volume .13507E-02 ppm1 3.818 ppm2 3.233 CV 1
ASSI { 3907}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 57 and name HN ))
3.100 1.200 1.200 peak 3907 spectrum 1 weight .10000E+01 volume .10442E-02 ppm1 3.001 ppm2 7.113 CV 1
ASSI { 3909}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 60 and name HB1 ))
3.800 1.800 1.800 peak 3909 spectrum 1 weight .10000E+01 volume .74807E-03 ppm1 3.808 ppm2 1.389 CV 1
ASSI { 3912}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 57 and name HA ))
2.700 .900 .900 peak 3912 spectrum 1 weight .10000E+01 volume .22079E-02 ppm1 2.996 ppm2 3.842 CV 1
ASSI { 3916}
(( segid " " and resid 57 and name HB1 ))
( segid " " and resid 41 and name HD1%)
3.600 1.600 1.600 peak 3916 spectrum 1 weight .10000E+01 volume .13091E-02 ppm1 2.995 ppm2 .926 CV 1
ASSI { 3917}
(( segid " " and resid 55 and name HD1 ))
(( segid " " and resid 56 and name HN ))
4.200 2.200 1.800 peak 3917 spectrum 1 weight .10000E+01 volume .46754E-03 ppm1 3.658 ppm2 8.945 CV 1
ASSI { 3918}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 56 and name HN ))
3.700 1.700 1.700 peak 3918 spectrum 1 weight .10000E+01 volume .10104E-02 ppm1 1.986 ppm2 8.952 CV 1
ASSI { 3921}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB1 ))
3.100 1.200 1.200 peak 3921 spectrum 1 weight .10000E+01 volume .20390E-02 ppm1 4.324 ppm2 1.344 CV 1
ASSI { 3922}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HN ))
3.300 1.300 1.300 peak 3922 spectrum 1 weight .10000E+01 volume .91948E-03 ppm1 4.320 ppm2 8.960 CV 1
ASSI { 3927}
(( segid " " and resid 56 and name HG ))
(( segid " " and resid 56 and name HB2 ))
3.100 1.200 1.200 peak 3927 spectrum 1 weight .10000E+01 volume .13455E-02 ppm1 1.207 ppm2 1.729 CV 1
ASSI { 3929}
(( segid " " and resid 56 and name HG ))
(( segid " " and resid 56 and name HA ))
3.600 1.600 1.600 peak 3929 spectrum 1 weight .10000E+01 volume .59224E-03 ppm1 1.210 ppm2 4.331 CV 1
ASSI { 3932}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 58 and name HN ))
3.200 1.300 1.300 peak 3932 spectrum 1 weight .10000E+01 volume .11247E-02 ppm1 4.233 ppm2 7.619 CV 1
ASSI { 3933}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 56 and name HN ))
3.500 1.600 1.600 peak 3933 spectrum 1 weight .10000E+01 volume .51951E-03 ppm1 2.366 ppm2 8.960 CV 1
ASSI { 3942}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 54 and name HB2 ))
2.000 .500 .500 peak 3942 spectrum 1 weight .10000E+01 volume .54910E-02 ppm1 2.726 ppm2 3.119 CV 1
ASSI { 3945}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 50 and name HB ))
2.800 1.000 1.000 peak 3945 spectrum 1 weight .10000E+01 volume .15689E-02 ppm1 3.094 ppm2 2.284 CV 1
ASSI { 3948}
(( segid " " and resid 51 and name HG1 ))
(( segid " " and resid 54 and name HB1 ))
4.300 2.300 1.700 peak 3948 spectrum 1 weight .10000E+01 volume .67272E-03 ppm1 2.290 ppm2 2.736 CV 1
ASSI { 3949}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 53 and name HN ))
4.000 2.000 2.000 peak 3949 spectrum 1 weight .10000E+01 volume .10052E-02 ppm1 1.872 ppm2 7.012 CV 1
ASSI { 3950}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HA ))
2.700 .900 .900 peak 3950 spectrum 1 weight .10000E+01 volume .27637E-02 ppm1 2.217 ppm2 4.495 CV 1
ASSI { 3951}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HN ))
2.800 1.000 1.000 peak 3951 spectrum 1 weight .10000E+01 volume .20390E-02 ppm1 4.128 ppm2 7.011 CV 1
ASSI { 3952}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HN ))
3.300 1.400 1.400 peak 3952 spectrum 1 weight .10000E+01 volume .12078E-02 ppm1 4.128 ppm2 7.765 CV 1
ASSI { 3953}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB ))
2.300 .700 .700 peak 3953 spectrum 1 weight .10000E+01 volume .67662E-02 ppm1 4.127 ppm2 4.545 CV 1
ASSI { 3956}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HN ))
3.000 1.100 1.100 peak 3956 spectrum 1 weight .10000E+01 volume .11897E-02 ppm1 3.987 ppm2 9.135 CV 1
ASSI { 3957}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 51 and name HA ))
2.600 .800 .800 peak 3957 spectrum 1 weight .10000E+01 volume .26078E-02 ppm1 1.871 ppm2 4.500 CV 1
ASSI { 3958}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 51 and name HN ))
4.100 2.100 1.900 peak 3958 spectrum 1 weight .10000E+01 volume .72208E-03 ppm1 2.725 ppm2 8.433 CV 1
ASSI { 3959}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 51 and name HN ))
2.800 1.000 1.000 peak 3959 spectrum 1 weight .10000E+01 volume .22026E-02 ppm1 1.870 ppm2 8.436 CV 1
ASSI { 3961}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HN ))
3.400 1.500 1.500 peak 3961 spectrum 1 weight .10000E+01 volume .13091E-02 ppm1 2.215 ppm2 8.434 CV 1
ASSI { 3968}
(( segid " " and resid 51 and name HG2 ))
(( segid " " and resid 52 and name HN ))
4.600 2.700 1.400 peak 3968 spectrum 1 weight .10000E+01 volume .67534E-03 ppm1 2.361 ppm2 9.129 CV 1
ASSI { 3969}
(( segid " " and resid 51 and name HG2 ))
(( segid " " and resid 51 and name HB1 ))
2.300 .700 .700 peak 3969 spectrum 1 weight .10000E+01 volume .47248E-02 ppm1 2.357 ppm2 1.890 CV 1
ASSI { 3971}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 51 and name HN ))
3.500 1.500 1.500 peak 3971 spectrum 1 weight .10000E+01 volume .18468E-02 ppm1 .737 ppm2 8.436 CV 1
ASSI { 3972}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 50 and name HN ))
2.900 1.100 1.100 peak 3972 spectrum 1 weight .10000E+01 volume .16130E-02 ppm1 .737 ppm2 6.722 CV 1
ASSI { 3973}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 50 and name HA ))
2.600 .800 .800 peak 3973 spectrum 1 weight .10000E+01 volume .65014E-02 ppm1 .737 ppm2 4.625 CV 1
ASSI { 3974}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 88 and name HE1 ))
2.600 2.600 3.400 peak 3974 spectrum 1 weight .10000E+01 volume .15559E-02 ppm1 .738 ppm2 2.812 CV 1
ASSI { 3975}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 88 and name HE2 ))
2.700 2.700 3.300 peak 3975 spectrum 1 weight .10000E+01 volume .13818E-02 ppm1 .737 ppm2 2.933 CV 1
ASSI { 3982}
( segid " " and resid 50 and name HG2%)
( segid " " and resid 56 and name HD1%)
3.100 1.200 1.200 peak 3982 spectrum 1 weight .10000E+01 volume .18780E-02 ppm1 .735 ppm2 .275 CV 1
ASSI { 3983}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name HN ))
2.900 1.000 1.000 peak 3983 spectrum 1 weight .10000E+01 volume .22520E-02 ppm1 4.041 ppm2 6.723 CV 1
ASSI { 3985}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HN ))
3.000 1.100 1.100 peak 3985 spectrum 1 weight .10000E+01 volume .16078E-02 ppm1 4.180 ppm2 8.315 CV 1
ASSI { 3986}
(( segid " " and resid 48 and name HG ))
(( segid " " and resid 48 and name HN ))
3.700 1.700 1.700 peak 3986 spectrum 1 weight .10000E+01 volume .10676E-02 ppm1 1.542 ppm2 8.319 CV 1
ASSI { 3987}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 49 and name HN ))
3.500 1.500 1.500 peak 3987 spectrum 1 weight .10000E+01 volume .95070E-03 ppm1 4.184 ppm2 7.248 CV 1
ASSI { 3989}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 48 and name HA ))
2.500 .800 .800 peak 3989 spectrum 1 weight .10000E+01 volume .42105E-02 ppm1 1.557 ppm2 4.205 CV 1
OR { 3989}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HA ))
ASSI { 3993}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 48 and name HN ))
2.700 .900 .900 peak 3993 spectrum 1 weight .10000E+01 volume .22728E-02 ppm1 1.559 ppm2 8.322 CV 1
OR { 3993}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HN ))
ASSI { 3995}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 48 and name HB1 ))
3.100 1.200 1.200 peak 3995 spectrum 1 weight .10000E+01 volume .12390E-02 ppm1 3.430 ppm2 1.571 CV 1
OR { 3995}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 48 and name HB2 ))
ASSI { 3999}
(( segid " " and resid 48 and name HG ))
(( segid " " and resid 48 and name HA ))
2.900 1.100 1.100 peak 3999 spectrum 1 weight .10000E+01 volume .16753E-02 ppm1 1.547 ppm2 4.205 CV 1
ASSI { 4008}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HB2 ))
2.200 .600 .600 peak 4008 spectrum 1 weight .10000E+01 volume .12455E-01 ppm1 4.206 ppm2 3.934 CV 1
OR { 4008}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HB1 ))
ASSI { 4011}
(( segid " " and resid 45 and name HG11))
(( segid " " and resid 45 and name HN ))
2.700 .900 .900 peak 4011 spectrum 1 weight .10000E+01 volume .13611E-02 ppm1 .812 ppm2 8.584 CV 1
ASSI { 4017}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 45 and name HB ))
2.600 .800 .800 peak 4017 spectrum 1 weight .10000E+01 volume .29507E-02 ppm1 3.794 ppm2 1.834 CV 1
ASSI { 4018}
(( segid " " and resid 45 and name HB ))
(( segid " " and resid 45 and name HG12))
3.000 1.100 1.100 peak 4018 spectrum 1 weight .10000E+01 volume .21455E-02 ppm1 1.814 ppm2 1.653 CV 1
ASSI { 4022}
(( segid " " and resid 45 and name HG11))
(( segid " " and resid 45 and name HB ))
2.700 .900 .900 peak 4022 spectrum 1 weight .10000E+01 volume .18286E-02 ppm1 .813 ppm2 1.843 CV 1
ASSI { 4026}
(( segid " " and resid 45 and name HG11))
(( segid " " and resid 45 and name HG12))
2.000 .500 .500 peak 4026 spectrum 1 weight .10000E+01 volume .46936E-02 ppm1 .813 ppm2 1.653 CV 1
ASSI { 4038}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 44 and name HN ))
3.700 1.700 1.700 peak 4038 spectrum 1 weight .10000E+01 volume .53509E-03 ppm1 3.782 ppm2 9.006 CV 1
ASSI { 4042}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB2 ))
3.100 1.200 1.200 peak 4042 spectrum 1 weight .10000E+01 volume .16130E-02 ppm1 3.430 ppm2 3.124 CV 1
ASSI { 4043}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 44 and name HB1 ))
2.900 1.100 1.100 peak 4043 spectrum 1 weight .10000E+01 volume .17507E-02 ppm1 3.431 ppm2 2.630 CV 1
ASSI { 4044}
(( segid " " and resid 44 and name HA ))
( segid " " and resid 48 and name HD2%)
3.500 1.500 1.500 peak 4044 spectrum 1 weight .10000E+01 volume .11455E-02 ppm1 3.431 ppm2 .713 CV 1
ASSI { 4047}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 45 and name HN ))
3.100 1.200 1.200 peak 4047 spectrum 1 weight .10000E+01 volume .10727E-02 ppm1 3.099 ppm2 8.583 CV 1
ASSI { 4049}
(( segid " " and resid 44 and name HB1 ))
(( segid " " and resid 44 and name HB2 ))
1.800 .400 .400 peak 4049 spectrum 1 weight .10000E+01 volume .10135E-01 ppm1 2.609 ppm2 3.122 CV 1
ASSI { 4051}
(( segid " " and resid 44 and name HB1 ))
(( segid " " and resid 41 and name HA ))
3.300 1.400 1.400 peak 4051 spectrum 1 weight .10000E+01 volume .17637E-02 ppm1 2.609 ppm2 3.627 CV 1
ASSI { 4052}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 41 and name HA ))
2.700 .900 .900 peak 4052 spectrum 1 weight .10000E+01 volume .17351E-02 ppm1 3.103 ppm2 3.628 CV 1
ASSI { 4067}
(( segid " " and resid 43 and name HB2 ))
(( segid " " and resid 43 and name HB1 ))
2.200 .600 .600 peak 4067 spectrum 1 weight .10000E+01 volume .29715E-02 ppm1 3.546 ppm2 2.856 CV 1
ASSI { 4068}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HN ))
3.100 1.200 1.200 peak 4068 spectrum 1 weight .10000E+01 volume .14935E-02 ppm1 3.794 ppm2 8.556 CV 1
ASSI { 4073}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HB ))
3.100 1.200 1.200 peak 4073 spectrum 1 weight .10000E+01 volume .15013E-02 ppm1 3.786 ppm2 2.753 CV 1
ASSI { 4074}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 42 and name HN ))
2.600 .800 .800 peak 4074 spectrum 1 weight .10000E+01 volume .33741E-02 ppm1 4.213 ppm2 8.310 CV 1
ASSI { 4075}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 43 and name HN ))
2.700 .900 .900 peak 4075 spectrum 1 weight .10000E+01 volume .19793E-02 ppm1 4.212 ppm2 8.123 CV 1
ASSI { 4077}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 42 and name HG2%)
2.300 .600 .600 peak 4077 spectrum 1 weight .10000E+01 volume .74832E-02 ppm1 4.213 ppm2 1.194 CV 1
ASSI { 4078}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 41 and name HN ))
3.100 1.200 1.200 peak 4078 spectrum 1 weight .10000E+01 volume .13169E-02 ppm1 4.336 ppm2 8.538 CV 1
ASSI { 4080}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 41 and name HN ))
3.700 1.700 1.700 peak 4080 spectrum 1 weight .10000E+01 volume .82599E-03 ppm1 1.247 ppm2 8.531 CV 1
ASSI { 4085}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HG12))
2.700 .900 .900 peak 4085 spectrum 1 weight .10000E+01 volume .27689E-02 ppm1 3.612 ppm2 1.846 CV 1
ASSI { 4086}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HB ))
2.900 1.000 1.000 peak 4086 spectrum 1 weight .10000E+01 volume .21118E-02 ppm1 3.611 ppm2 2.071 CV 1
ASSI { 4093}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 41 and name HB ))
2.500 .800 .800 peak 4093 spectrum 1 weight .10000E+01 volume .38001E-02 ppm1 4.332 ppm2 2.071 CV 1
ASSI { 4101}
(( segid " " and resid 41 and name HG12))
(( segid " " and resid 41 and name HG11))
1.800 .400 .400 peak 4101 spectrum 1 weight .10000E+01 volume .84966E-02 ppm1 1.827 ppm2 1.213 CV 1
ASSI { 4103}
(( segid " " and resid 40 and name HB ))
(( segid " " and resid 40 and name HN ))
2.900 1.100 1.100 peak 4103 spectrum 1 weight .10000E+01 volume .14208E-02 ppm1 2.724 ppm2 8.232 CV 1
ASSI { 4106}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB ))
2.800 1.000 1.000 peak 4106 spectrum 1 weight .10000E+01 volume .26884E-02 ppm1 3.793 ppm2 4.222 CV 1
ASSI { 4109}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 40 and name HB ))
2.900 1.000 1.000 peak 4109 spectrum 1 weight .10000E+01 volume .16052E-02 ppm1 4.138 ppm2 2.732 CV 1
ASSI { 4118}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 40 and name HA ))
2.700 .900 .900 peak 4118 spectrum 1 weight .10000E+01 volume .26780E-02 ppm1 1.247 ppm2 3.807 CV 1
ASSI { 4120}
( segid " " and resid 40 and name HG1%)
(( segid " " and resid 40 and name HB ))
2.500 .800 .800 peak 4120 spectrum 1 weight .10000E+01 volume .34131E-02 ppm1 1.246 ppm2 2.736 CV 1
ASSI { 4126}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 40 and name HA ))
2.700 .900 .900 peak 4126 spectrum 1 weight .10000E+01 volume .33066E-02 ppm1 1.329 ppm2 3.806 CV 1
ASSI { 4127}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 35 and name HB2 ))
2.800 1.000 1.000 peak 4127 spectrum 1 weight .10000E+01 volume .22806E-02 ppm1 1.330 ppm2 3.396 CV 1
OR { 4127}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 35 and name HB1 ))
ASSI { 4129}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 40 and name HB ))
2.500 .800 .800 peak 4129 spectrum 1 weight .10000E+01 volume .39014E-02 ppm1 1.330 ppm2 2.733 CV 1
ASSI { 4131}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HN ))
3.200 1.200 1.200 peak 4131 spectrum 1 weight .10000E+01 volume .11793E-02 ppm1 4.170 ppm2 7.567 CV 1
ASSI { 4133}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB2 ))
3.200 1.200 1.200 peak 4133 spectrum 1 weight .10000E+01 volume .15559E-02 ppm1 4.171 ppm2 2.970 CV 1
ASSI { 4134}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB1 ))
2.700 .900 .900 peak 4134 spectrum 1 weight .10000E+01 volume .26234E-02 ppm1 4.170 ppm2 1.889 CV 1
ASSI { 4137}
(( segid " " and resid 39 and name HB1 ))
(( segid " " and resid 35 and name HB2 ))
3.300 1.400 1.400 peak 4137 spectrum 1 weight .10000E+01 volume .11922E-02 ppm1 1.864 ppm2 3.388 CV 1
OR { 4137}
(( segid " " and resid 39 and name HB1 ))
(( segid " " and resid 35 and name HB1 ))
ASSI { 4138}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 35 and name HB2 ))
3.100 1.200 1.200 peak 4138 spectrum 1 weight .10000E+01 volume .18650E-02 ppm1 2.964 ppm2 3.389 CV 1
OR { 4138}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 35 and name HB1 ))
ASSI { 4142}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB1 ))
2.700 .900 .900 peak 4142 spectrum 1 weight .10000E+01 volume .26858E-02 ppm1 4.332 ppm2 2.436 CV 1
ASSI { 4144}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HN ))
2.600 .900 .900 peak 4144 spectrum 1 weight .10000E+01 volume .21663E-02 ppm1 2.633 ppm2 7.756 CV 1
ASSI { 4146}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 39 and name HN ))
3.300 1.300 1.300 peak 4146 spectrum 1 weight .10000E+01 volume .10520E-02 ppm1 2.630 ppm2 7.568 CV 1
ASSI { 4150}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 37 and name HN ))
3.000 1.100 1.100 peak 4150 spectrum 1 weight .10000E+01 volume .15845E-02 ppm1 4.182 ppm2 9.035 CV 1
ASSI { 4152}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HA ))
2.600 .900 .900 peak 4152 spectrum 1 weight .10000E+01 volume .32598E-02 ppm1 4.179 ppm2 4.813 CV 1
ASSI { 4153}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HN ))
3.100 1.200 1.200 peak 4153 spectrum 1 weight .10000E+01 volume .12182E-02 ppm1 4.135 ppm2 9.022 CV 1
ASSI { 4155}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 36 and name HA ))
3.200 1.300 1.300 peak 4155 spectrum 1 weight .10000E+01 volume .23663E-02 ppm1 4.140 ppm2 4.816 CV 1
ASSI { 4160}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HB2 ))
2.000 .500 .500 peak 4160 spectrum 1 weight .10000E+01 volume .60704E-02 ppm1 4.180 ppm2 4.512 CV 1
ASSI { 4165}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB2 ))
3.000 1.100 1.100 peak 4165 spectrum 1 weight .10000E+01 volume .14935E-02 ppm1 5.174 ppm2 3.393 CV 1
OR { 4165}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB1 ))
ASSI { 4166}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 39 and name HB2 ))
4.000 2.000 2.000 peak 4166 spectrum 1 weight .10000E+01 volume .67272E-03 ppm1 5.179 ppm2 2.987 CV 1
ASSI { 4168}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 35 and name HD1 ))
3.700 1.700 1.700 peak 4168 spectrum 1 weight .10000E+01 volume .66493E-03 ppm1 1.951 ppm2 6.921 CV 1
ASSI { 4170}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB2 ))
2.400 .700 .700 peak 4170 spectrum 1 weight .10000E+01 volume .80937E-02 ppm1 4.409 ppm2 2.409 CV 1
ASSI { 4171}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 39 and name HB1 ))
4.300 2.300 1.700 peak 4171 spectrum 1 weight .10000E+01 volume .47274E-03 ppm1 5.172 ppm2 1.875 CV 1
ASSI { 4174}
(( segid " " and resid 34 and name HG1 ))
(( segid " " and resid 34 and name HA ))
2.900 1.100 1.100 peak 4174 spectrum 1 weight .10000E+01 volume .20650E-02 ppm1 2.220 ppm2 4.422 CV 1
ASSI { 4175}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 34 and name HN ))
3.100 1.200 1.200 peak 4175 spectrum 1 weight .10000E+01 volume .24053E-02 ppm1 1.951 ppm2 7.721 CV 1
ASSI { 4176}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HB1 ))
1.800 .400 .400 peak 4176 spectrum 1 weight .10000E+01 volume .12268E-01 ppm1 2.392 ppm2 1.969 CV 1
ASSI { 4178}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HN ))
3.800 1.800 1.800 peak 4178 spectrum 1 weight .10000E+01 volume .43638E-03 ppm1 3.666 ppm2 7.431 CV 1
ASSI { 4183}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HN ))
3.400 1.400 1.400 peak 4183 spectrum 1 weight .10000E+01 volume .77145E-03 ppm1 3.709 ppm2 7.429 CV 1
ASSI { 4184}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HN ))
2.500 .800 .800 peak 4184 spectrum 1 weight .10000E+01 volume .40781E-02 ppm1 4.361 ppm2 7.070 CV 1
ASSI { 4187}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HN ))
2.700 .900 .900 peak 4187 spectrum 1 weight .10000E+01 volume .24910E-02 ppm1 2.651 ppm2 8.086 CV 1
ASSI { 4189}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HG2 ))
2.600 .900 .900 peak 4189 spectrum 1 weight .10000E+01 volume .44001E-02 ppm1 4.281 ppm2 2.303 CV 1
OR { 4189}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HG1 ))
ASSI { 4191}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
2.500 .800 .800 peak 4191 spectrum 1 weight .10000E+01 volume .56833E-02 ppm1 4.281 ppm2 2.071 CV 1
ASSI { 4192}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HD21))
3.300 1.400 1.400 peak 4192 spectrum 1 weight .10000E+01 volume .92989E-03 ppm1 2.839 ppm2 6.862 CV 1
ASSI { 4194}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HD21))
3.300 1.300 1.300 peak 4194 spectrum 1 weight .10000E+01 volume .75848E-03 ppm1 2.784 ppm2 6.866 CV 1
ASSI { 468}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 77 and name HB2 ))
2.900 1.000 1.000 peak 468 spectrum 1 weight .10000E+01 volume .29897E-02 ppm1 .807 ppm2 3.106 CV 1
ASSI { 489}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 77 and name HB1 ))
2.600 .800 .800 peak 489 spectrum 1 weight .10000E+01 volume .46417E-02 ppm1 .809 ppm2 2.785 CV 1
ASSI { 530}
( segid " " and resid 70 and name HD1%)
( segid " " and resid 92 and name HE% )
3.100 1.200 1.200 peak 530 spectrum 1 weight .10000E+01 volume .22624E-02 ppm1 .769 ppm2 7.211 CV 1
ASSI { 636}
(( segid " " and resid 44 and name HB1 ))
( segid " " and resid 56 and name HD2%)
3.100 1.200 1.200 peak 636 spectrum 1 weight .10000E+01 volume .12000E-02 ppm1 2.610 ppm2 .547 CV 1
ASSI { 670}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 64 and name HN ))
3.500 3.500 2.500 peak 670 spectrum 1 weight .10000E+01 volume .12260E-02 ppm1 1.066 ppm2 7.947 CV 1
ASSI { 671}
(( segid " " and resid 44 and name HB2 ))
( segid " " and resid 56 and name HD2%)
3.700 1.700 1.700 peak 671 spectrum 1 weight .10000E+01 volume .61039E-03 ppm1 3.098 ppm2 .557 CV 1
ASSI { 673}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 37 and name HG2%)
2.600 .800 .800 peak 673 spectrum 1 weight .10000E+01 volume .36676E-02 ppm1 4.139 ppm2 1.062 CV 1
OR { 673}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 37 and name HG1%)
ASSI { 681}
(( segid " " and resid 91 and name HB2 ))
( segid " " and resid 48 and name HD1%)
3.400 1.400 1.400 peak 681 spectrum 1 weight .10000E+01 volume .19299E-02 ppm1 1.936 ppm2 .688 CV 1
OR { 681}
(( segid " " and resid 91 and name HB2 ))
( segid " " and resid 48 and name HD2%)
ASSI { 753}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 43 and name HH2 ))
3.900 1.900 1.900 peak 753 spectrum 1 weight .10000E+01 volume .50649E-03 ppm1 .963 ppm2 6.846 CV 1
ASSI { 767}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 92 and name HZ ))
3.200 1.300 1.300 peak 767 spectrum 1 weight .10000E+01 volume .13871E-02 ppm1 .855 ppm2 6.993 CV 1
ASSI { 780}
( segid " " and resid 60 and name HD1%)
( segid " " and resid 92 and name HE% )
2.900 1.100 1.100 peak 780 spectrum 1 weight .10000E+01 volume .18208E-02 ppm1 .856 ppm2 7.219 CV 1
ASSI { 795}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 41 and name HA ))
2.900 1.100 1.100 peak 795 spectrum 1 weight .10000E+01 volume .18468E-02 ppm1 .859 ppm2 3.630 CV 1
ASSI { 799}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 57 and name HA ))
2.700 .900 .900 peak 799 spectrum 1 weight .10000E+01 volume .38884E-02 ppm1 .857 ppm2 3.838 CV 1
ASSI { 820}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 44 and name HB2 ))
3.200 1.300 1.300 peak 820 spectrum 1 weight .10000E+01 volume .98965E-03 ppm1 .858 ppm2 3.119 CV 1
ASSI { 836}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 60 and name HG ))
2.100 .500 .500 peak 836 spectrum 1 weight .10000E+01 volume .10091E-01 ppm1 .861 ppm2 2.065 CV 1
OR { 836}
( segid " " and resid 60 and name HD1%)
(( segid " " and resid 60 and name HB2 ))
ASSI { 850}
( segid " " and resid 60 and name HD1%)
( segid " " and resid 56 and name HD1%)
2.900 1.100 1.100 peak 850 spectrum 1 weight .10000E+01 volume .20052E-02 ppm1 .856 ppm2 .269 CV 1
ASSI { 852}
( segid " " and resid 60 and name HD1%)
( segid " " and resid 56 and name HD2%)
2.600 .800 .800 peak 852 spectrum 1 weight .10000E+01 volume .40494E-02 ppm1 .859 ppm2 .583 CV 1
ASSI { 1067}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 93 and name HE1 ))
3.200 1.300 1.300 peak 1067 spectrum 1 weight .10000E+01 volume .13818E-02 ppm1 .902 ppm2 2.930 CV 1
ASSI { 1087}
( segid " " and resid 27 and name HE% )
(( segid " " and resid 27 and name HA ))
4.000 2.000 2.000 peak 1087 spectrum 1 weight .10000E+01 volume .57923E-03 ppm1 1.922 ppm2 4.407 CV 1
ASSI { 1258}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HN ))
3.600 1.600 1.600 peak 1258 spectrum 1 weight .10000E+01 volume .46235E-03 ppm1 2.202 ppm2 7.240 CV 1
ASSI { 1762}
(( segid " " and resid 100 and name HB1 ))
(( segid " " and resid 100 and name HA ))
3.000 1.100 1.100 peak 1762 spectrum 1 weight .10000E+01 volume .24806E-02 ppm1 1.732 ppm2 4.038 CV 1
ASSI { 1776}
(( segid " " and resid 98 and name HE1 ))
(( segid " " and resid 98 and name HA ))
3.800 1.800 1.800 peak 1776 spectrum 1 weight .10000E+01 volume .80000E-03 ppm1 2.959 ppm2 4.109 CV 1
OR { 1776}
(( segid " " and resid 98 and name HE2 ))
(( segid " " and resid 98 and name HA ))
ASSI { 1786}
(( segid " " and resid 96 and name HB ))
(( segid " " and resid 96 and name HA ))
3.000 1.100 1.100 peak 1786 spectrum 1 weight .10000E+01 volume .16000E-02 ppm1 1.739 ppm2 3.560 CV 1
ASSI { 1837}
(( segid " " and resid 93 and name HB1 ))
(( segid " " and resid 93 and name HG2 ))
2.500 .800 .800 peak 1837 spectrum 1 weight .10000E+01 volume .40494E-02 ppm1 2.055 ppm2 1.453 CV 1
OR { 1837}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HG1 ))
OR { 1837}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HG2 ))
OR { 1837}
(( segid " " and resid 93 and name HB1 ))
(( segid " " and resid 93 and name HG1 ))
ASSI { 1849}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 91 and name HA ))
2.700 .900 .900 peak 1849 spectrum 1 weight .10000E+01 volume .36702E-02 ppm1 1.839 ppm2 3.916 CV 1
ASSI { 1868}
(( segid " " and resid 90 and name HB ))
( segid " " and resid 90 and name HG2%)
2.100 .500 .500 peak 1868 spectrum 1 weight .10000E+01 volume .10369E-01 ppm1 1.904 ppm2 .919 CV 1
OR { 1868}
(( segid " " and resid 90 and name HB ))
( segid " " and resid 90 and name HD1%)
ASSI { 1898}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 78 and name HN ))
4.600 2.600 1.400 peak 1898 spectrum 1 weight .10000E+01 volume .46754E-03 ppm1 2.157 ppm2 8.073 CV 1
ASSI { 1950}
(( segid " " and resid 79 and name HG2 ))
(( segid " " and resid 79 and name HA ))
2.700 .900 .900 peak 1950 spectrum 1 weight .10000E+01 volume .28546E-02 ppm1 2.261 ppm2 3.576 CV 1
ASSI { 1962}
(( segid " " and resid 76 and name HB1 ))
(( segid " " and resid 76 and name HA ))
2.800 .900 .900 peak 1962 spectrum 1 weight .10000E+01 volume .34182E-02 ppm1 2.024 ppm2 3.943 CV 1
ASSI { 2161}
(( segid " " and resid 55 and name HD2 ))
(( segid " " and resid 55 and name HG1 ))
2.500 .800 .800 peak 2161 spectrum 1 weight .10000E+01 volume .40313E-02 ppm1 3.894 ppm2 2.080 CV 1
OR { 2161}
(( segid " " and resid 55 and name HD2 ))
(( segid " " and resid 55 and name HG2 ))
ASSI { 2165}
(( segid " " and resid 55 and name HD1 ))
(( segid " " and resid 55 and name HG2 ))
2.500 .800 .800 peak 2165 spectrum 1 weight .10000E+01 volume .38391E-02 ppm1 3.657 ppm2 2.077 CV 1
OR { 2165}
(( segid " " and resid 55 and name HD1 ))
(( segid " " and resid 55 and name HG1 ))
ASSI { 2318}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 59 and name HB1 ))
3.300 1.300 1.300 peak 2318 spectrum 1 weight .10000E+01 volume .17974E-02 ppm1 4.321 ppm2 1.896 CV 1
OR { 2318}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 59 and name HG1 ))
OR { 2318}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 2407}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 92 and name HB2 ))
2.900 1.000 1.000 peak 2407 spectrum 1 weight .10000E+01 volume .15325E-02 ppm1 7.126 ppm2 3.191 CV 1
OR { 2407}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 92 and name HB1 ))
ASSI { 2416}
(( segid " " and resid 92 and name HZ ))
( segid " " and resid 40 and name HG1%)
2.900 1.100 1.100 peak 2416 spectrum 1 weight .10000E+01 volume .79221E-03 ppm1 6.970 ppm2 1.269 CV 1
ASSI { 2424}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 78 and name HB1 ))
3.200 1.300 1.300 peak 2424 spectrum 1 weight .10000E+01 volume .78703E-03 ppm1 7.128 ppm2 2.833 CV 1
ASSI { 2425}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 93 and name HB2 ))
3.700 1.700 1.700 peak 2425 spectrum 1 weight .10000E+01 volume .63377E-03 ppm1 7.125 ppm2 2.003 CV 1
OR { 2425}
( segid " " and resid 92 and name HD% )
(( segid " " and resid 93 and name HB1 ))
ASSI { 2431}
( segid " " and resid 92 and name HD% )
( segid " " and resid 96 and name HD1%)
3.000 1.200 1.200 peak 2431 spectrum 1 weight .10000E+01 volume .12442E-02 ppm1 7.126 ppm2 .255 CV 1
ASSI { 2442}
(( segid " " and resid 43 and name HD1 ))
( segid " " and resid 47 and name HG2%)
3.200 1.300 1.300 peak 2442 spectrum 1 weight .10000E+01 volume .14624E-02 ppm1 7.283 ppm2 .981 CV 1
ASSI { 2459}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 99 and name HG2 ))
3.700 1.700 1.700 peak 2459 spectrum 1 weight .10000E+01 volume .63638E-03 ppm1 7.299 ppm2 2.269 CV 1
OR { 2459}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 99 and name HG1 ))
ASSI { 2462}
(( segid " " and resid 43 and name HZ2 ))
(( segid " " and resid 96 and name HA ))
3.800 1.800 1.800 peak 2462 spectrum 1 weight .10000E+01 volume .53248E-03 ppm1 7.285 ppm2 3.569 CV 1
ASSI { 2490}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 33 and name HA ))
3.900 1.900 1.900 peak 2490 spectrum 1 weight .10000E+01 volume .51951E-03 ppm1 6.574 ppm2 3.660 CV 1
OR { 2490}
( segid " " and resid 32 and name HD% )
(( segid " " and resid 33 and name HB2 ))
ASSI { 2492}
( segid " " and resid 32 and name HD% )
( segid " " and resid 70 and name HD1%)
3.600 1.600 1.600 peak 2492 spectrum 1 weight .10000E+01 volume .66754E-03 ppm1 6.568 ppm2 .784 CV 1
OR { 2492}
( segid " " and resid 32 and name HD% )
( segid " " and resid 70 and name HD2%)
ASSI { 2504}
(( segid " " and resid 106 and name HH2 ))
( segid " " and resid 104 and name HD2%)
3.000 3.000 3.000 peak 2504 spectrum 1 weight .10000E+01 volume .62080E-03 ppm1 7.181 ppm2 .899 CV 1
OR { 2504}
(( segid " " and resid 106 and name HH2 ))
( segid " " and resid 104 and name HD1%)
ASSI { 2526}
(( segid " " and resid 43 and name HH2 ))
( segid " " and resid 96 and name HD1%)
4.300 2.300 1.700 peak 2526 spectrum 1 weight .10000E+01 volume .41300E-03 ppm1 6.833 ppm2 .244 CV 1
ASSI { 2527}
(( segid " " and resid 43 and name HE3 ))
( segid " " and resid 40 and name HG1%)
3.500 1.500 1.500 peak 2527 spectrum 1 weight .10000E+01 volume .68574E-03 ppm1 7.927 ppm2 1.274 CV 1
ASSI { 2537}
(( segid " " and resid 35 and name HZ2 ))
(( segid " " and resid 35 and name HZ3 ))
4.500 2.600 1.500 peak 2537 spectrum 1 weight .10000E+01 volume .52207E-03 ppm1 7.302 ppm2 6.035 CV 1
ASSI { 2540}
(( segid " " and resid 35 and name HZ2 ))
(( segid " " and resid 43 and name HB1 ))
4.000 2.000 2.000 peak 2540 spectrum 1 weight .10000E+01 volume .41040E-03 ppm1 7.308 ppm2 2.833 CV 1
ASSI { 2543}
(( segid " " and resid 35 and name HE3 ))
( segid " " and resid 70 and name HD1%)
3.100 1.200 1.200 peak 2543 spectrum 1 weight .10000E+01 volume .16182E-02 ppm1 7.125 ppm2 .780 CV 1
OR { 2543}
(( segid " " and resid 35 and name HE3 ))
( segid " " and resid 70 and name HD2%)
ASSI { 2546}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 26 and name HB1 ))
3.400 1.500 1.500 peak 2546 spectrum 1 weight .10000E+01 volume .92471E-03 ppm1 7.145 ppm2 3.157 CV 1
OR { 2546}
(( segid " " and resid 26 and name HD2 ))
(( segid " " and resid 26 and name HB2 ))
ASSI { 2548}
(( segid " " and resid 106 and name HZ2 ))
(( segid " " and resid 104 and name HB2 ))
3.500 1.500 1.500 peak 2548 spectrum 1 weight .10000E+01 volume .54288E-03 ppm1 7.463 ppm2 1.627 CV 1
OR { 2548}
(( segid " " and resid 106 and name HZ2 ))
(( segid " " and resid 104 and name HG ))
ASSI { 2572}
(( segid " " and resid 81 and name HB2 ))
(( segid " " and resid 78 and name HA ))
3.000 1.100 1.100 peak 2572 spectrum 1 weight .10000E+01 volume .15663E-02 ppm1 1.957 ppm2 4.069 CV 1
ASSI { 2644}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 57 and name HN ))
4.700 2.700 1.300 peak 2644 spectrum 1 weight .10000E+01 volume .47793E-03 ppm1 2.154 ppm2 7.117 CV 1
OR { 2644}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 57 and name HN ))
ASSI { 2682}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HA ))
2.500 .800 .800 peak 2682 spectrum 1 weight .10000E+01 volume .89897E-02 ppm1 .786 ppm2 3.990 CV 1
ASSI { 2684}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 63 and name HN ))
4.000 2.000 2.000 peak 2684 spectrum 1 weight .10000E+01 volume .74289E-03 ppm1 .790 ppm2 7.575 CV 1
ASSI { 2685}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 66 and name HN ))
2.900 2.900 3.100 peak 2685 spectrum 1 weight .10000E+01 volume .73510E-03 ppm1 .790 ppm2 6.549 CV 1
ASSI { 2693}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 81 and name HB2 ))
3.000 1.200 1.200 peak 2693 spectrum 1 weight .10000E+01 volume .19143E-02 ppm1 .789 ppm2 1.905 CV 1
OR { 2693}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 81 and name HG ))
ASSI { 2706}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 96 and name HG12))
2.500 .800 .800 peak 2706 spectrum 1 weight .10000E+01 volume .38183E-02 ppm1 .240 ppm2 1.578 CV 1
ASSI { 2707}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 70 and name HB1 ))
3.100 1.200 1.200 peak 2707 spectrum 1 weight .10000E+01 volume .11766E-02 ppm1 .240 ppm2 1.140 CV 1
ASSI { 2711}
( segid " " and resid 90 and name HG2%)
(( segid " " and resid 91 and name HN ))
3.100 1.200 1.200 peak 2711 spectrum 1 weight .10000E+01 volume .26234E-02 ppm1 .933 ppm2 7.320 CV 1
ASSI { 2712}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 95 and name HN ))
3.000 1.100 1.100 peak 2712 spectrum 1 weight .10000E+01 volume .23274E-02 ppm1 .921 ppm2 7.807 CV 1
ASSI { 2714}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 66 and name HN ))
3.300 1.300 1.300 peak 2714 spectrum 1 weight .10000E+01 volume .14857E-02 ppm1 .893 ppm2 6.537 CV 1
ASSI { 2716}
( segid " " and resid 90 and name HG2%)
(( segid " " and resid 87 and name HA ))
3.700 1.700 1.700 peak 2716 spectrum 1 weight .10000E+01 volume .21715E-02 ppm1 .934 ppm2 4.388 CV 1
ASSI { 2722}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 51 and name HA ))
3.000 1.100 1.100 peak 2722 spectrum 1 weight .10000E+01 volume .13663E-02 ppm1 .921 ppm2 4.488 CV 1
ASSI { 2724}
( segid " " and resid 94 and name HD1%)
(( segid " " and resid 94 and name HG11))
2.000 .500 .500 peak 2724 spectrum 1 weight .10000E+01 volume .14182E-01 ppm1 .837 ppm2 1.164 CV 1
ASSI { 2729}
( segid " " and resid 45 and name HG2%)
(( segid " " and resid 50 and name HN ))
3.600 1.600 1.600 peak 2729 spectrum 1 weight .10000E+01 volume .70650E-03 ppm1 .921 ppm2 6.706 CV 1
ASSI { 2736}
( segid " " and resid 94 and name HD1%)
(( segid " " and resid 94 and name HN ))
3.400 1.400 1.400 peak 2736 spectrum 1 weight .10000E+01 volume .22079E-02 ppm1 .836 ppm2 8.457 CV 1
ASSI { 2738}
( segid " " and resid 94 and name HD1%)
(( segid " " and resid 95 and name HN ))
3.100 1.200 1.200 peak 2738 spectrum 1 weight .10000E+01 volume .57405E-03 ppm1 .835 ppm2 7.807 CV 1
ASSI { 2740}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 91 and name HN ))
4.400 2.400 1.600 peak 2740 spectrum 1 weight .10000E+01 volume .72208E-03 ppm1 .861 ppm2 7.315 CV 1
ASSI { 2742}
( segid " " and resid 94 and name HD1%)
(( segid " " and resid 91 and name HA ))
2.500 .800 .800 peak 2742 spectrum 1 weight .10000E+01 volume .44780E-02 ppm1 .836 ppm2 3.933 CV 1
ASSI { 2744}
( segid " " and resid 94 and name HD1%)
(( segid " " and resid 94 and name HA ))
3.400 1.500 1.500 peak 2744 spectrum 1 weight .10000E+01 volume .29091E-02 ppm1 .836 ppm2 3.705 CV 1
ASSI { 2747}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 87 and name HB1 ))
3.100 1.200 1.200 peak 2747 spectrum 1 weight .10000E+01 volume .63120E-03 ppm1 .863 ppm2 2.821 CV 1
ASSI { 2750}
( segid " " and resid 90 and name HD1%)
(( segid " " and resid 86 and name HG ))
2.200 .600 .600 peak 2750 spectrum 1 weight .10000E+01 volume .78496E-02 ppm1 .863 ppm2 1.698 CV 1
ASSI { 2754}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 69 and name HN ))
2.600 .800 .800 peak 2754 spectrum 1 weight .10000E+01 volume .37300E-02 ppm1 .980 ppm2 7.549 CV 1
ASSI { 2756}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 66 and name HN ))
2.400 .700 .700 peak 2756 spectrum 1 weight .10000E+01 volume .48287E-02 ppm1 .981 ppm2 6.545 CV 1
ASSI { 2758}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 65 and name HA ))
3.400 1.400 1.400 peak 2758 spectrum 1 weight .10000E+01 volume .25767E-02 ppm1 .980 ppm2 3.990 CV 1
ASSI { 2759}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 67 and name HA1 ))
4.400 2.400 1.600 peak 2759 spectrum 1 weight .10000E+01 volume .51951E-03 ppm1 .980 ppm2 3.598 CV 1
ASSI { 2761}
( segid " " and resid 66 and name HG1%)
(( segid " " and resid 69 and name HB2 ))
2.700 .900 .900 peak 2761 spectrum 1 weight .10000E+01 volume .23819E-02 ppm1 .981 ppm2 1.889 CV 1
ASSI { 2770}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 57 and name HA ))
3.100 1.200 1.200 peak 2770 spectrum 1 weight .10000E+01 volume .21897E-02 ppm1 .933 ppm2 3.833 CV 1
ASSI { 2779}
( segid " " and resid 41 and name HD1%)
(( segid " " and resid 61 and name HG1 ))
2.600 .800 .800 peak 2779 spectrum 1 weight .10000E+01 volume .25611E-02 ppm1 .933 ppm2 1.600 CV 1
ASSI { 2785}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 51 and name HA ))
4.100 2.200 1.900 peak 2785 spectrum 1 weight .10000E+01 volume .69871E-03 ppm1 .811 ppm2 4.492 CV 1
ASSI { 2787}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 52 and name HA ))
2.500 .800 .800 peak 2787 spectrum 1 weight .10000E+01 volume .39845E-02 ppm1 .814 ppm2 4.003 CV 1
ASSI { 2790}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 44 and name HB2 ))
4.200 2.200 1.800 peak 2790 spectrum 1 weight .10000E+01 volume .52730E-03 ppm1 .816 ppm2 3.125 CV 1
ASSI { 2791}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 52 and name HG2 ))
2.800 1.000 1.000 peak 2791 spectrum 1 weight .10000E+01 volume .24286E-02 ppm1 .814 ppm2 2.279 CV 1
OR { 2791}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 52 and name HG1 ))
ASSI { 2792}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 52 and name HB1 ))
2.700 .900 .900 peak 2792 spectrum 1 weight .10000E+01 volume .40183E-02 ppm1 .814 ppm2 2.079 CV 1
OR { 2792}
( segid " " and resid 45 and name HD1%)
(( segid " " and resid 52 and name HB2 ))
ASSI { 2803}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 38 and name HA ))
3.900 1.900 1.900 peak 2803 spectrum 1 weight .10000E+01 volume .11662E-02 ppm1 1.066 ppm2 4.347 CV 1
ASSI { 2809}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 44 and name HB1 ))
3.800 1.800 1.800 peak 2809 spectrum 1 weight .10000E+01 volume .76883E-03 ppm1 1.063 ppm2 2.635 CV 1
ASSI { 2818}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 88 and name HN ))
4.200 2.200 1.800 peak 2818 spectrum 1 weight .10000E+01 volume .79221E-03 ppm1 1.369 ppm2 7.870 CV 1
ASSI { 2819}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 91 and name HN ))
3.400 1.500 1.500 peak 2819 spectrum 1 weight .10000E+01 volume .10364E-02 ppm1 1.369 ppm2 7.297 CV 1
ASSI { 2823}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 79 and name HA ))
2.200 .600 .600 peak 2823 spectrum 1 weight .10000E+01 volume .91741E-02 ppm1 1.370 ppm2 3.583 CV 1
ASSI { 2824}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 92 and name HB2 ))
3.100 1.200 1.200 peak 2824 spectrum 1 weight .10000E+01 volume .21793E-02 ppm1 1.370 ppm2 3.241 CV 1
ASSI { 2826}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 79 and name HB2 ))
2.900 1.100 1.100 peak 2826 spectrum 1 weight .10000E+01 volume .23092E-02 ppm1 1.370 ppm2 2.223 CV 1
OR { 2826}
( segid " " and resid 89 and name HB% )
(( segid " " and resid 79 and name HG2 ))
ASSI { 2842}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 96 and name HG12))
2.500 .800 .800 peak 2842 spectrum 1 weight .10000E+01 volume .31533E-02 ppm1 .565 ppm2 1.562 CV 1
ASSI { 2843}
( segid " " and resid 96 and name HG2%)
(( segid " " and resid 70 and name HB1 ))
2.700 .900 .900 peak 2843 spectrum 1 weight .10000E+01 volume .21351E-02 ppm1 .566 ppm2 1.132 CV 1
ASSI { 2850}
( segid " " and resid 50 and name HG1%)
(( segid " " and resid 54 and name HB2 ))
3.300 1.300 1.300 peak 2850 spectrum 1 weight .10000E+01 volume .11195E-02 ppm1 .529 ppm2 3.120 CV 1
ASSI { 2851}
( segid " " and resid 50 and name HG1%)
(( segid " " and resid 54 and name HB1 ))
3.800 1.800 1.800 peak 2851 spectrum 1 weight .10000E+01 volume .87017E-03 ppm1 .530 ppm2 2.704 CV 1
ASSI { 2866}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 57 and name HB2 ))
4.200 2.200 1.800 peak 2866 spectrum 1 weight .10000E+01 volume .51951E-03 ppm1 .565 ppm2 3.210 CV 1
ASSI { 2871}
( segid " " and resid 56 and name HD2%)
(( segid " " and resid 56 and name HB1 ))
2.300 .700 .700 peak 2871 spectrum 1 weight .10000E+01 volume .51872E-02 ppm1 .561 ppm2 1.361 CV 1
ASSI { 2873}
( segid " " and resid 56 and name HD2%)
( segid " " and resid 60 and name HD1%)
2.400 .700 .700 peak 2873 spectrum 1 weight .10000E+01 volume .59870E-02 ppm1 .560 ppm2 .899 CV 1
OR { 2873}
( segid " " and resid 56 and name HD2%)
( segid " " and resid 60 and name HD2%)
ASSI { 2877}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 48 and name HN ))
4.400 2.400 1.600 peak 2877 spectrum 1 weight .10000E+01 volume .45975E-03 ppm1 .643 ppm2 8.325 CV 1
ASSI { 2878}
( segid " " and resid 48 and name HD1%)
( segid " " and resid 92 and name HD% )
3.100 1.200 1.200 peak 2878 spectrum 1 weight .10000E+01 volume .12182E-02 ppm1 .645 ppm2 7.169 CV 1
OR { 2878}
( segid " " and resid 48 and name HD1%)
( segid " " and resid 92 and name HE% )
ASSI { 2879}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 48 and name HD1%)
3.400 1.500 1.500 peak 2879 spectrum 1 weight .10000E+01 volume .95070E-03 ppm1 3.872 ppm2 .679 CV 1
OR { 2879}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 48 and name HD2%)
ASSI { 2880}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 92 and name HA ))
3.000 1.100 1.100 peak 2880 spectrum 1 weight .10000E+01 volume .17117E-02 ppm1 .642 ppm2 4.455 CV 1
ASSI { 2883}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 92 and name HB1 ))
3.700 1.700 1.700 peak 2883 spectrum 1 weight .10000E+01 volume .13871E-02 ppm1 .642 ppm2 3.176 CV 1
ASSI { 2888}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 48 and name HN ))
4.200 2.200 1.800 peak 2888 spectrum 1 weight .10000E+01 volume .51172E-03 ppm1 .679 ppm2 8.322 CV 1
ASSI { 2889}
( segid " " and resid 48 and name HD2%)
( segid " " and resid 92 and name HD% )
3.000 1.100 1.100 peak 2889 spectrum 1 weight .10000E+01 volume .17948E-02 ppm1 .682 ppm2 7.165 CV 1
OR { 2889}
( segid " " and resid 48 and name HD2%)
( segid " " and resid 92 and name HE% )
ASSI { 2891}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 92 and name HA ))
3.000 1.100 1.100 peak 2891 spectrum 1 weight .10000E+01 volume .20104E-02 ppm1 .681 ppm2 4.455 CV 1
ASSI { 2902}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 48 and name HG ))
2.100 .600 .600 peak 2902 spectrum 1 weight .10000E+01 volume .11762E-01 ppm1 .681 ppm2 1.575 CV 1
OR { 2902}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 48 and name HB1 ))
OR { 2902}
( segid " " and resid 48 and name HD2%)
(( segid " " and resid 48 and name HB2 ))
ASSI { 2903}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 48 and name HG ))
2.100 .600 .600 peak 2903 spectrum 1 weight .10000E+01 volume .11650E-01 ppm1 .641 ppm2 1.576 CV 1
OR { 2903}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 48 and name HB2 ))
OR { 2903}
( segid " " and resid 48 and name HD1%)
(( segid " " and resid 48 and name HB1 ))
ASSI { 2906}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 41 and name HN ))
4.200 2.200 1.800 peak 2906 spectrum 1 weight .10000E+01 volume .63120E-03 ppm1 1.065 ppm2 8.550 CV 1
ASSI { 2912}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 61 and name HN ))
4.000 2.000 2.000 peak 2912 spectrum 1 weight .10000E+01 volume .69615E-03 ppm1 1.065 ppm2 7.450 CV 1
ASSI { 2915}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 36 and name HB2 ))
3.900 1.900 1.900 peak 2915 spectrum 1 weight .10000E+01 volume .95849E-03 ppm1 1.070 ppm2 4.504 CV 1
ASSI { 2916}
( segid " " and resid 66 and name HG2%)
(( segid " " and resid 66 and name HA ))
2.200 .600 .600 peak 2916 spectrum 1 weight .10000E+01 volume .89847E-02 ppm1 1.077 ppm2 4.264 CV 1
ASSI { 2925}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 66 and name HN ))
3.100 1.200 1.200 peak 2925 spectrum 1 weight .10000E+01 volume .15715E-02 ppm1 1.074 ppm2 6.546 CV 1
ASSI { 2927}
( segid " " and resid 69 and name HD2%)
(( segid " " and resid 65 and name HA ))
2.500 .800 .800 peak 2927 spectrum 1 weight .10000E+01 volume .41560E-02 ppm1 1.074 ppm2 3.989 CV 1
ASSI { 2943}
(( segid " " and resid 91 and name HB1 ))
( segid " " and resid 48 and name HD1%)
2.900 1.000 1.000 peak 2943 spectrum 1 weight .10000E+01 volume .19585E-02 ppm1 1.845 ppm2 .681 CV 1
OR { 2943}
(( segid " " and resid 91 and name HB1 ))
( segid " " and resid 48 and name HD2%)
ASSI { 2948}
( segid " " and resid 53 and name HG2%)
(( segid " " and resid 51 and name HG1 ))
2.400 .700 .700 peak 2948 spectrum 1 weight .10000E+01 volume .48313E-02 ppm1 1.190 ppm2 2.285 CV 1
ASSI { 2950}
( segid " " and resid 53 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
2.700 2.700 3.300 peak 2950 spectrum 1 weight .10000E+01 volume .14000E-02 ppm1 1.184 ppm2 1.875 CV 1
ASSI { 2960}
( segid " " and resid 104 and name HD1%)
(( segid " " and resid 105 and name HN ))
4.500 2.500 1.500 peak 2960 spectrum 1 weight .10000E+01 volume .75069E-03 ppm1 .836 ppm2 8.054 CV 1
ASSI { 2962}
( segid " " and resid 104 and name HD1%)
(( segid " " and resid 104 and name HA ))
2.600 .900 .900 peak 2962 spectrum 1 weight .10000E+01 volume .96805E-02 ppm1 .836 ppm2 4.267 CV 1
ASSI { 2974}
(( segid " " and resid 104 and name HB1 ))
( segid " " and resid 104 and name HD1%)
2.500 .800 .800 peak 2974 spectrum 1 weight .10000E+01 volume .51975E-02 ppm1 1.456 ppm2 .894 CV 1
OR { 2974}
(( segid " " and resid 104 and name HB1 ))
( segid " " and resid 104 and name HD2%)
ASSI { 2982}
(( segid " " and resid 104 and name HB2 ))
( segid " " and resid 104 and name HD2%)
2.300 .600 .600 peak 2982 spectrum 1 weight .10000E+01 volume .90676E-02 ppm1 1.614 ppm2 .892 CV 1
OR { 2982}
(( segid " " and resid 104 and name HB2 ))
( segid " " and resid 104 and name HD1%)
ASSI { 2986}
( segid " " and resid 104 and name HD2%)
(( segid " " and resid 104 and name HN ))
4.400 2.400 1.600 peak 2986 spectrum 1 weight .10000E+01 volume .69353E-03 ppm1 .897 ppm2 7.861 CV 1
ASSI { 2991}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 75 and name HA ))
2.900 1.100 1.100 peak 2991 spectrum 1 weight .10000E+01 volume .26676E-02 ppm1 .901 ppm2 3.966 CV 1
ASSI { 2992}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 90 and name HA ))
3.300 1.400 1.400 peak 2992 spectrum 1 weight .10000E+01 volume .93250E-03 ppm1 .901 ppm2 3.664 CV 1
ASSI { 2994}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 78 and name HB1 ))
3.200 3.200 2.800 peak 2994 spectrum 1 weight .10000E+01 volume .19117E-02 ppm1 .902 ppm2 2.780 CV 1
ASSI { 2995}
( segid " " and resid 104 and name HD2%)
(( segid " " and resid 104 and name HG ))
2.000 .500 .500 peak 2995 spectrum 1 weight .10000E+01 volume .18572E-01 ppm1 .901 ppm2 1.616 CV 1
OR { 2995}
( segid " " and resid 104 and name HD2%)
(( segid " " and resid 104 and name HB2 ))
ASSI { 2996}
( segid " " and resid 75 and name HD2%)
(( segid " " and resid 75 and name HB2 ))
2.300 .700 .700 peak 2996 spectrum 1 weight .10000E+01 volume .96342E-02 ppm1 .900 ppm2 1.902 CV 1
ASSI { 3000}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 41 and name HN ))
4.000 2.000 2.000 peak 3000 spectrum 1 weight .10000E+01 volume .49613E-03 ppm1 1.001 ppm2 8.551 CV 1
ASSI { 3002}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 61 and name HN ))
4.000 2.000 2.000 peak 3002 spectrum 1 weight .10000E+01 volume .68051E-03 ppm1 1.004 ppm2 7.470 CV 1
ASSI { 3003}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 38 and name HA ))
2.800 1.000 1.000 peak 3003 spectrum 1 weight .10000E+01 volume .31949E-02 ppm1 1.004 ppm2 4.291 CV 1
ASSI { 3009}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 61 and name HG2 ))
2.700 .900 .900 peak 3009 spectrum 1 weight .10000E+01 volume .27481E-02 ppm1 1.003 ppm2 1.768 CV 1
ASSI { 3010}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 61 and name HG1 ))
2.700 .900 .900 peak 3010 spectrum 1 weight .10000E+01 volume .22988E-02 ppm1 1.004 ppm2 1.595 CV 1
ASSI { 3013}
( segid " " and resid 70 and name HD2%)
( segid " " and resid 96 and name HD1%)
3.100 1.200 1.200 peak 3013 spectrum 1 weight .10000E+01 volume .12130E-02 ppm1 .750 ppm2 .259 CV 1
ASSI { 3029}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 63 and name HD22))
2.600 2.600 3.400 peak 3029 spectrum 1 weight .10000E+01 volume .15923E-02 ppm1 .786 ppm2 7.640 CV 1
OR { 3029}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 63 and name HN ))
ASSI { 3033}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 63 and name HB2 ))
2.600 .800 .800 peak 3033 spectrum 1 weight .10000E+01 volume .22806E-02 ppm1 .787 ppm2 2.924 CV 1
ASSI { 3034}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 63 and name HB1 ))
2.600 2.600 3.400 peak 3034 spectrum 1 weight .10000E+01 volume .15923E-02 ppm1 .785 ppm2 2.549 CV 1
ASSI { 3037}
( segid " " and resid 81 and name HD1%)
(( segid " " and resid 81 and name HB1 ))
2.700 .900 .900 peak 3037 spectrum 1 weight .10000E+01 volume .82288E-02 ppm1 .786 ppm2 1.392 CV 1
ASSI { 3043}
(( segid " " and resid 81 and name HG ))
(( segid " " and resid 81 and name HB1 ))
2.800 1.000 1.000 peak 3043 spectrum 1 weight .10000E+01 volume .19507E-02 ppm1 1.937 ppm2 1.390 CV 1
ASSI { 3052}
( segid " " and resid 81 and name HD2%)
(( segid " " and resid 92 and name HZ ))
3.400 1.500 1.500 peak 3052 spectrum 1 weight .10000E+01 volume .88832E-03 ppm1 .891 ppm2 6.994 CV 1
ASSI { 3053}
( segid " " and resid 81 and name HD2%)
( segid " " and resid 92 and name HE% )
2.700 .900 .900 peak 3053 spectrum 1 weight .10000E+01 volume .26105E-02 ppm1 .890 ppm2 7.224 CV 1
ASSI { 3057}
( segid " " and resid 81 and name HD2%)
(( segid " " and resid 81 and name HG ))
2.100 .600 .600 peak 3057 spectrum 1 weight .10000E+01 volume .13590E-01 ppm1 .890 ppm2 1.959 CV 1
OR { 3057}
( segid " " and resid 81 and name HD2%)
(( segid " " and resid 81 and name HB2 ))
ASSI { 3098}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 100 and name HB1 ))
2.500 .800 .800 peak 3098 spectrum 1 weight .10000E+01 volume .47040E-02 ppm1 3.083 ppm2 1.733 CV 1
OR { 3098}
(( segid " " and resid 100 and name HD2 ))
(( segid " " and resid 100 and name HG2 ))
ASSI { 3170}
( segid " " and resid 95 and name HD2%)
(( segid " " and resid 95 and name HA ))
2.900 1.100 1.100 peak 3170 spectrum 1 weight .10000E+01 volume .19819E-02 ppm1 .714 ppm2 4.105 CV 1
ASSI { 3171}
( segid " " and resid 95 and name HD2%)
(( segid " " and resid 47 and name HB ))
2.700 2.700 3.300 peak 3171 spectrum 1 weight .10000E+01 volume .11169E-02 ppm1 .711 ppm2 3.304 CV 1
ASSI { 3177}
( segid " " and resid 95 and name HD2%)
(( segid " " and resid 43 and name HZ2 ))
3.200 1.300 1.300 peak 3177 spectrum 1 weight .10000E+01 volume .12208E-02 ppm1 .714 ppm2 7.293 CV 1
ASSI { 3179}
(( segid " " and resid 70 and name HG ))
( segid " " and resid 70 and name HD1%)
2.100 .600 .600 peak 3179 spectrum 1 weight .10000E+01 volume .91406E-02 ppm1 1.790 ppm2 .783 CV 1
OR { 3179}
(( segid " " and resid 70 and name HG ))
( segid " " and resid 70 and name HD2%)
ASSI { 3190}
(( segid " " and resid 94 and name HG11))
( segid " " and resid 94 and name HD1%)
2.400 .700 .700 peak 3190 spectrum 1 weight .10000E+01 volume .64471E-02 ppm1 1.150 ppm2 .891 CV 1
OR { 3190}
(( segid " " and resid 94 and name HG11))
( segid " " and resid 94 and name HG2%)
ASSI { 3215}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 91 and name HN ))
3.100 1.200 1.200 peak 3215 spectrum 1 weight .10000E+01 volume .12442E-02 ppm1 3.878 ppm2 7.322 CV 1
ASSI { 3241}
(( segid " " and resid 80 and name HB1 ))
( segid " " and resid 81 and name HD2%)
3.500 3.500 2.500 peak 3241 spectrum 1 weight .10000E+01 volume .11273E-02 ppm1 2.739 ppm2 .890 CV 1
ASSI { 3246}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HG2 ))
2.800 1.000 1.000 peak 3246 spectrum 1 weight .10000E+01 volume .24364E-02 ppm1 3.954 ppm2 2.388 CV 1
OR { 3246}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HG1 ))
ASSI { 3256}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HB2 ))
2.400 .700 .700 peak 3256 spectrum 1 weight .10000E+01 volume .64964E-02 ppm1 4.285 ppm2 2.307 CV 1
OR { 3256}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HG2 ))
ASSI { 3264}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 71 and name HD2 ))
3.200 1.300 1.300 peak 3264 spectrum 1 weight .10000E+01 volume .24884E-02 ppm1 1.712 ppm2 3.552 CV 1
ASSI { 3267}
(( segid " " and resid 70 and name HB1 ))
(( segid " " and resid 70 and name HB2 ))
2.100 .600 .600 peak 3267 spectrum 1 weight .10000E+01 volume .38053E-02 ppm1 1.122 ppm2 1.738 CV 1
OR { 3267}
(( segid " " and resid 70 and name HB1 ))
(( segid " " and resid 70 and name HG ))
ASSI { 3268}
(( segid " " and resid 70 and name HB1 ))
( segid " " and resid 70 and name HD1%)
2.700 .900 .900 peak 3268 spectrum 1 weight .10000E+01 volume .28183E-02 ppm1 1.122 ppm2 .783 CV 1
OR { 3268}
(( segid " " and resid 70 and name HB1 ))
( segid " " and resid 70 and name HD2%)
ASSI { 3275}
(( segid " " and resid 70 and name HB2 ))
( segid " " and resid 70 and name HD2%)
2.500 .800 .800 peak 3275 spectrum 1 weight .10000E+01 volume .43689E-02 ppm1 1.713 ppm2 .781 CV 1
OR { 3275}
(( segid " " and resid 70 and name HB2 ))
( segid " " and resid 70 and name HD1%)
ASSI { 3283}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 33 and name HA ))
2.900 2.900 3.100 peak 3283 spectrum 1 weight .10000E+01 volume .76104E-03 ppm1 2.559 ppm2 3.682 CV 1
OR { 3283}
(( segid " " and resid 68 and name HB1 ))
(( segid " " and resid 33 and name HB2 ))
ASSI { 3285}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 33 and name HA ))
2.900 2.900 3.100 peak 3285 spectrum 1 weight .10000E+01 volume .80522E-03 ppm1 2.712 ppm2 3.705 CV 1
ASSI { 3304}
(( segid " " and resid 60 and name HB2 ))
( segid " " and resid 60 and name HD1%)
2.500 .800 .800 peak 3304 spectrum 1 weight .10000E+01 volume .47456E-02 ppm1 2.040 ppm2 .908 CV 1
OR { 3304}
(( segid " " and resid 60 and name HB2 ))
( segid " " and resid 60 and name HD2%)
ASSI { 3306}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB1 ))
2.500 .800 .800 peak 3306 spectrum 1 weight .10000E+01 volume .44806E-02 ppm1 3.978 ppm2 1.407 CV 1
ASSI { 3320}
(( segid " " and resid 59 and name HD1 ))
(( segid " " and resid 59 and name HG2 ))
2.500 .800 .800 peak 3320 spectrum 1 weight .10000E+01 volume .54367E-02 ppm1 3.173 ppm2 1.913 CV 1
OR { 3320}
(( segid " " and resid 59 and name HD1 ))
(( segid " " and resid 59 and name HG1 ))
OR { 3320}
(( segid " " and resid 59 and name HD1 ))
(( segid " " and resid 59 and name HB1 ))
ASSI { 3321}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HG1 ))
2.500 .800 .800 peak 3321 spectrum 1 weight .10000E+01 volume .39637E-02 ppm1 3.220 ppm2 1.905 CV 1
OR { 3321}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 3334}
(( segid " " and resid 52 and name HG2 ))
( segid " " and resid 53 and name HG2%)
3.300 3.300 2.700 peak 3334 spectrum 1 weight .10000E+01 volume .13325E-02 ppm1 2.293 ppm2 1.208 CV 1
ASSI { 3335}
(( segid " " and resid 52 and name HG1 ))
( segid " " and resid 53 and name HG2%)
3.400 1.500 1.500 peak 3335 spectrum 1 weight .10000E+01 volume .11715E-02 ppm1 2.242 ppm2 1.211 CV 1
ASSI { 3339}
(( segid " " and resid 52 and name HG1 ))
( segid " " and resid 45 and name HD1%)
3.100 1.200 1.200 peak 3339 spectrum 1 weight .10000E+01 volume .11325E-02 ppm1 2.243 ppm2 .853 CV 1
OR { 3339}
(( segid " " and resid 52 and name HG1 ))
( segid " " and resid 45 and name HG2%)
ASSI { 3341}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 62 and name HA ))
2.600 .800 .800 peak 3341 spectrum 1 weight .10000E+01 volume .54106E-02 ppm1 2.032 ppm2 4.055 CV 1
ASSI { 3343}
(( segid " " and resid 49 and name HB1 ))
(( segid " " and resid 49 and name HA ))
2.700 .900 .900 peak 3343 spectrum 1 weight .10000E+01 volume .41300E-02 ppm1 2.040 ppm2 4.039 CV 1
ASSI { 3359}
(( segid " " and resid 46 and name HB2 ))
( segid " " and resid 42 and name HG2%)
3.400 1.500 1.500 peak 3359 spectrum 1 weight .10000E+01 volume .77662E-03 ppm1 3.914 ppm2 1.189 CV 1
OR { 3359}
(( segid " " and resid 46 and name HB1 ))
( segid " " and resid 42 and name HG2%)
ASSI { 3361}
( segid " " and resid 47 and name HG2%)
(( segid " " and resid 47 and name HB ))
2.300 .700 .700 peak 3361 spectrum 1 weight .10000E+01 volume .65872E-02 ppm1 .963 ppm2 3.309 CV 1
ASSI { 3378}
(( segid " " and resid 61 and name HD2 ))
(( segid " " and resid 61 and name HA ))
3.600 1.600 1.600 peak 3378 spectrum 1 weight .10000E+01 volume .11481E-02 ppm1 3.294 ppm2 4.071 CV 1
ASSI { 3414}
(( segid " " and resid 106 and name HE3 ))
(( segid " " and resid 106 and name HA ))
3.500 1.600 1.600 peak 3414 spectrum 1 weight .10000E+01 volume .12935E-02 ppm1 7.618 ppm2 4.671 CV 1
ASSI { 3415}
(( segid " " and resid 106 and name HH2 ))
(( segid " " and resid 106 and name HE3 ))
4.400 2.400 1.600 peak 3415 spectrum 1 weight .10000E+01 volume .69092E-03 ppm1 7.173 ppm2 7.630 CV 1
ASSI { 3422}
(( segid " " and resid 104 and name HG ))
(( segid " " and resid 104 and name HN ))
3.500 1.500 1.500 peak 3422 spectrum 1 weight .10000E+01 volume .22130E-02 ppm1 1.623 ppm2 7.864 CV 1
ASSI { 3423}
(( segid " " and resid 104 and name HG ))
(( segid " " and resid 105 and name HN ))
4.500 2.500 1.500 peak 3423 spectrum 1 weight .10000E+01 volume .52207E-03 ppm1 1.617 ppm2 8.075 CV 1
ASSI { 3432}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 103 and name HB2 ))
3.400 1.500 1.500 peak 3432 spectrum 1 weight .10000E+01 volume .95849E-03 ppm1 4.372 ppm2 1.904 CV 1
ASSI { 3457}
(( segid " " and resid 96 and name HA ))
( segid " " and resid 94 and name HG2%)
3.500 3.500 2.500 peak 3457 spectrum 1 weight .10000E+01 volume .78964E-03 ppm1 3.553 ppm2 .943 CV 1
ASSI { 3462}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 101 and name HB1 ))
2.900 1.000 1.000 peak 3462 spectrum 1 weight .10000E+01 volume .21299E-02 ppm1 4.133 ppm2 2.742 CV 1
OR { 3462}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 101 and name HB2 ))
ASSI { 3471}
(( segid " " and resid 61 and name HG2 ))
(( segid " " and resid 61 and name HA ))
2.600 .900 .900 peak 3471 spectrum 1 weight .10000E+01 volume .24390E-02 ppm1 1.732 ppm2 4.081 CV 1
ASSI { 3473}
(( segid " " and resid 98 and name HB2 ))
( segid " " and resid 94 and name HG2%)
3.100 1.200 1.200 peak 3473 spectrum 1 weight .10000E+01 volume .19221E-02 ppm1 1.966 ppm2 .918 CV 1
OR { 3473}
(( segid " " and resid 98 and name HB1 ))
( segid " " and resid 94 and name HG2%)
ASSI { 3477}
(( segid " " and resid 98 and name HE2 ))
( segid " " and resid 94 and name HG2%)
2.800 1.000 1.000 peak 3477 spectrum 1 weight .10000E+01 volume .30105E-02 ppm1 2.958 ppm2 .926 CV 1
OR { 3477}
(( segid " " and resid 98 and name HE1 ))
( segid " " and resid 94 and name HG2%)
ASSI { 3492}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 98 and name HB2 ))
4.100 2.100 1.900 peak 3492 spectrum 1 weight .10000E+01 volume .62597E-03 ppm1 2.834 ppm2 1.965 CV 1
OR { 3492}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 98 and name HB1 ))
ASSI { 3497}
(( segid " " and resid 96 and name HB ))
(( segid " " and resid 97 and name HB2 ))
4.100 2.100 1.900 peak 3497 spectrum 1 weight .10000E+01 volume .54027E-03 ppm1 1.738 ppm2 3.042 CV 1
ASSI { 3500}
( segid " " and resid 70 and name HD2%)
(( segid " " and resid 92 and name HZ ))
3.100 1.200 1.200 peak 3500 spectrum 1 weight .10000E+01 volume .14312E-02 ppm1 .751 ppm2 6.980 CV 1
ASSI { 3501}
(( segid " " and resid 96 and name HG12))
(( segid " " and resid 43 and name HH2 ))
3.700 1.700 1.700 peak 3501 spectrum 1 weight .10000E+01 volume .50393E-03 ppm1 1.570 ppm2 6.864 CV 1
ASSI { 3508}
(( segid " " and resid 95 and name HA ))
( segid " " and resid 95 and name HD1%)
2.800 1.000 1.000 peak 3508 spectrum 1 weight .10000E+01 volume .69146E-02 ppm1 4.069 ppm2 .810 CV 1
ASSI { 3521}
(( segid " " and resid 87 and name HA ))
( segid " " and resid 90 and name HD1%)
2.400 .700 .700 peak 3521 spectrum 1 weight .10000E+01 volume .40521E-02 ppm1 4.371 ppm2 .903 CV 1
ASSI { 3529}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 91 and name HN ))
3.500 1.600 1.600 peak 3529 spectrum 1 weight .10000E+01 volume .71429E-03 ppm1 3.643 ppm2 7.309 CV 1
ASSI { 3530}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 89 and name HA ))
3.400 1.400 1.400 peak 3530 spectrum 1 weight .10000E+01 volume .10858E-02 ppm1 3.643 ppm2 4.009 CV 1
ASSI { 3532}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HG12))
2.400 .700 .700 peak 3532 spectrum 1 weight .10000E+01 volume .55274E-02 ppm1 3.642 ppm2 1.879 CV 1
OR { 3532}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HB ))
ASSI { 3536}
(( segid " " and resid 90 and name HA ))
( segid " " and resid 90 and name HG2%)
2.200 .600 .600 peak 3536 spectrum 1 weight .10000E+01 volume .13689E-01 ppm1 3.642 ppm2 .903 CV 1
OR { 3536}
(( segid " " and resid 90 and name HA ))
( segid " " and resid 90 and name HD1%)
ASSI { 3537}
(( segid " " and resid 94 and name HA ))
( segid " " and resid 94 and name HG2%)
2.300 .700 .700 peak 3537 spectrum 1 weight .10000E+01 volume .76676E-02 ppm1 3.687 ppm2 .926 CV 1
ASSI { 3538}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 56 and name HD2%)
2.700 .900 .900 peak 3538 spectrum 1 weight .10000E+01 volume .35455E-02 ppm1 3.643 ppm2 .548 CV 1
ASSI { 3539}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HG1 ))
2.600 .900 .900 peak 3539 spectrum 1 weight .10000E+01 volume .38365E-02 ppm1 3.791 ppm2 1.454 CV 1
OR { 3539}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HG2 ))
ASSI { 3541}
(( segid " " and resid 93 and name HB1 ))
(( segid " " and resid 94 and name HN ))
3.200 1.300 1.300 peak 3541 spectrum 1 weight .10000E+01 volume .10234E-02 ppm1 2.055 ppm2 8.457 CV 1
OR { 3541}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 94 and name HN ))
ASSI { 3545}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 96 and name HG11))
3.400 1.400 1.400 peak 3545 spectrum 1 weight .10000E+01 volume .14000E-02 ppm1 3.793 ppm2 .608 CV 1
OR { 3545}
(( segid " " and resid 93 and name HA ))
( segid " " and resid 96 and name HG2%)
ASSI { 3551}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 96 and name HN ))
3.200 1.300 1.300 peak 3551 spectrum 1 weight .10000E+01 volume .10520E-02 ppm1 3.792 ppm2 8.265 CV 1
ASSI { 3556}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HB2 ))
2.400 .700 .700 peak 3556 spectrum 1 weight .10000E+01 volume .46625E-02 ppm1 4.441 ppm2 3.229 CV 1
ASSI { 3564}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 92 and name HD% )
3.200 1.200 1.200 peak 3564 spectrum 1 weight .10000E+01 volume .10208E-02 ppm1 2.826 ppm2 7.157 CV 1
OR { 3564}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 92 and name HE% )
ASSI { 3571}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 78 and name HB1 ))
2.900 1.000 1.000 peak 3571 spectrum 1 weight .10000E+01 volume .15273E-02 ppm1 4.044 ppm2 2.847 CV 1
ASSI { 3597}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 79 and name HG2 ))
3.800 1.800 1.800 peak 3597 spectrum 1 weight .10000E+01 volume .81040E-03 ppm1 3.927 ppm2 2.266 CV 1
ASSI { 3598}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HB2 ))
2.400 .700 .700 peak 3598 spectrum 1 weight .10000E+01 volume .49406E-02 ppm1 3.928 ppm2 1.685 CV 1
OR { 3598}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HG ))
ASSI { 3604}
(( segid " " and resid 86 and name HG ))
( segid " " and resid 86 and name HD1%)
2.000 .500 .500 peak 3604 spectrum 1 weight .10000E+01 volume .14392E-01 ppm1 1.687 ppm2 .893 CV 1
OR { 3604}
(( segid " " and resid 86 and name HG ))
( segid " " and resid 86 and name HD2%)
ASSI { 3608}
( segid " " and resid 86 and name HD2%)
(( segid " " and resid 79 and name HE22))
3.100 1.200 1.200 peak 3608 spectrum 1 weight .10000E+01 volume .52986E-03 ppm1 .862 ppm2 7.083 CV 1
ASSI { 3610}
( segid " " and resid 86 and name HD2%)
(( segid " " and resid 87 and name HB2 ))
4.200 2.200 1.800 peak 3610 spectrum 1 weight .10000E+01 volume .71691E-03 ppm1 .865 ppm2 2.924 CV 1
ASSI { 3613}
(( segid " " and resid 77 and name HB1 ))
(( segid " " and resid 73 and name HB1 ))
3.200 1.300 1.300 peak 3613 spectrum 1 weight .10000E+01 volume .96628E-03 ppm1 2.762 ppm2 1.380 CV 1
ASSI { 3619}
(( segid " " and resid 84 and name HA1 ))
(( segid " " and resid 79 and name HG2 ))
3.700 1.700 1.700 peak 3619 spectrum 1 weight .10000E+01 volume .16988E-02 ppm1 3.549 ppm2 2.277 CV 1
ASSI { 3620}
(( segid " " and resid 84 and name HA2 ))
(( segid " " and resid 79 and name HG2 ))
2.800 1.000 1.000 peak 3620 spectrum 1 weight .10000E+01 volume .13455E-02 ppm1 4.267 ppm2 2.260 CV 1
ASSI { 3621}
(( segid " " and resid 84 and name HA1 ))
(( segid " " and resid 79 and name HG1 ))
4.200 2.200 1.800 peak 3621 spectrum 1 weight .10000E+01 volume .93250E-03 ppm1 3.539 ppm2 1.904 CV 1
ASSI { 3622}
(( segid " " and resid 84 and name HA2 ))
(( segid " " and resid 79 and name HG1 ))
3.600 1.600 1.600 peak 3622 spectrum 1 weight .10000E+01 volume .79482E-03 ppm1 4.272 ppm2 1.908 CV 1
ASSI { 3641}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 85 and name HB1 ))
4.000 2.000 2.000 peak 3641 spectrum 1 weight .10000E+01 volume .72988E-03 ppm1 3.223 ppm2 2.690 CV 1
ASSI { 3643}
(( segid " " and resid 85 and name HB1 ))
(( segid " " and resid 85 and name HB2 ))
1.900 .400 .400 peak 3643 spectrum 1 weight .10000E+01 volume .89325E-02 ppm1 2.670 ppm2 3.089 CV 1
ASSI { 3656}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 80 and name HB2 ))
4.600 2.600 1.400 peak 3656 spectrum 1 weight .10000E+01 volume .55324E-03 ppm1 2.162 ppm2 2.903 CV 1
ASSI { 3657}
(( segid " " and resid 79 and name HB2 ))
( segid " " and resid 89 and name HB% )
3.100 1.200 1.200 peak 3657 spectrum 1 weight .10000E+01 volume .12234E-02 ppm1 2.159 ppm2 1.390 CV 1
ASSI { 3660}
(( segid " " and resid 79 and name HG1 ))
( segid " " and resid 86 and name HD1%)
3.100 1.200 1.200 peak 3660 spectrum 1 weight .10000E+01 volume .13585E-02 ppm1 1.886 ppm2 .896 CV 1
OR { 3660}
(( segid " " and resid 79 and name HG1 ))
( segid " " and resid 86 and name HD2%)
ASSI { 3661}
(( segid " " and resid 79 and name HB1 ))
( segid " " and resid 89 and name HB% )
3.600 1.600 1.600 peak 3661 spectrum 1 weight .10000E+01 volume .20832E-02 ppm1 1.907 ppm2 1.393 CV 1
ASSI { 3669}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HB2 ))
3.000 1.200 1.200 peak 3669 spectrum 1 weight .10000E+01 volume .18286E-02 ppm1 4.094 ppm2 3.437 CV 1
ASSI { 3673}
(( segid " " and resid 73 and name HB1 ))
(( segid " " and resid 77 and name HB2 ))
3.100 1.200 1.200 peak 3673 spectrum 1 weight .10000E+01 volume .88575E-03 ppm1 1.354 ppm2 3.102 CV 1
ASSI { 3675}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 89 and name HB% )
2.800 1.000 1.000 peak 3675 spectrum 1 weight .10000E+01 volume .24494E-02 ppm1 2.819 ppm2 1.392 CV 1
ASSI { 3682}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HB2 ))
2.700 .900 .900 peak 3682 spectrum 1 weight .10000E+01 volume .60442E-02 ppm1 4.072 ppm2 1.994 CV 1
OR { 3682}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HG2 ))
ASSI { 3688}
(( segid " " and resid 78 and name HB2 ))
( segid " " and resid 89 and name HB% )
3.100 1.200 1.200 peak 3688 spectrum 1 weight .10000E+01 volume .16208E-02 ppm1 3.427 ppm2 1.393 CV 1
ASSI { 3692}
( segid " " and resid 75 and name HD1%)
(( segid " " and resid 78 and name HB2 ))
3.000 1.100 1.100 peak 3692 spectrum 1 weight .10000E+01 volume .20572E-02 ppm1 .858 ppm2 3.449 CV 1
ASSI { 3694}
(( segid " " and resid 77 and name HB1 ))
( segid " " and resid 73 and name HD1%)
2.700 .900 .900 peak 3694 spectrum 1 weight .10000E+01 volume .37689E-02 ppm1 2.760 ppm2 .835 CV 1
OR { 3694}
(( segid " " and resid 77 and name HB1 ))
( segid " " and resid 73 and name HD2%)
ASSI { 3695}
(( segid " " and resid 77 and name HB2 ))
( segid " " and resid 73 and name HD1%)
2.900 1.100 1.100 peak 3695 spectrum 1 weight .10000E+01 volume .22624E-02 ppm1 3.087 ppm2 .844 CV 1
OR { 3695}
(( segid " " and resid 77 and name HB2 ))
( segid " " and resid 73 and name HD2%)
ASSI { 3701}
(( segid " " and resid 76 and name HG2 ))
(( segid " " and resid 76 and name HB1 ))
2.500 .800 .800 peak 3701 spectrum 1 weight .10000E+01 volume .51379E-02 ppm1 2.422 ppm2 2.045 CV 1
ASSI { 3707}
(( segid " " and resid 75 and name HB2 ))
( segid " " and resid 75 and name HD2%)
2.500 .800 .800 peak 3707 spectrum 1 weight .10000E+01 volume .46936E-02 ppm1 1.880 ppm2 .904 CV 1
OR { 3707}
(( segid " " and resid 75 and name HB2 ))
( segid " " and resid 75 and name HD1%)
ASSI { 3721}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HA ))
2.800 1.000 1.000 peak 3721 spectrum 1 weight .10000E+01 volume .89561E-02 ppm1 .805 ppm2 4.488 CV 1
ASSI { 3723}
( segid " " and resid 73 and name HD1%)
(( segid " " and resid 73 and name HN ))
3.200 1.300 1.300 peak 3723 spectrum 1 weight .10000E+01 volume .24806E-02 ppm1 .804 ppm2 7.205 CV 1
ASSI { 3730}
( segid " " and resid 73 and name HD2%)
(( segid " " and resid 77 and name HB1 ))
3.400 1.400 1.400 peak 3730 spectrum 1 weight .10000E+01 volume .92471E-03 ppm1 .840 ppm2 2.788 CV 1
ASSI { 3731}
( segid " " and resid 73 and name HD2%)
(( segid " " and resid 77 and name HB2 ))
3.500 1.500 1.500 peak 3731 spectrum 1 weight .10000E+01 volume .69615E-03 ppm1 .839 ppm2 3.092 CV 1
ASSI { 3741}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 71 and name HD2 ))
3.700 1.700 1.700 peak 3741 spectrum 1 weight .10000E+01 volume .97146E-03 ppm1 1.976 ppm2 3.499 CV 1
OR { 3741}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 71 and name HD1 ))
ASSI { 3747}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 71 and name HD2 ))
2.500 .800 .800 peak 3747 spectrum 1 weight .10000E+01 volume .34182E-02 ppm1 1.983 ppm2 3.484 CV 1
OR { 3747}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 71 and name HD1 ))
ASSI { 3752}
(( segid " " and resid 71 and name HG2 ))
( segid " " and resid 32 and name HE% )
3.100 1.200 1.200 peak 3752 spectrum 1 weight .10000E+01 volume .13740E-02 ppm1 1.983 ppm2 6.992 CV 1
ASSI { 3753}
(( segid " " and resid 71 and name HG1 ))
( segid " " and resid 32 and name HE% )
3.300 1.400 1.400 peak 3753 spectrum 1 weight .10000E+01 volume .65975E-03 ppm1 1.503 ppm2 6.993 CV 1
ASSI { 3755}
(( segid " " and resid 71 and name HD2 ))
(( segid " " and resid 71 and name HG2 ))
2.500 .800 .800 peak 3755 spectrum 1 weight .10000E+01 volume .26598E-02 ppm1 3.549 ppm2 1.996 CV 1
OR { 3755}
(( segid " " and resid 71 and name HD2 ))
(( segid " " and resid 71 and name HB2 ))
ASSI { 3765}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 71 and name HG2 ))
2.800 1.000 1.000 peak 3765 spectrum 1 weight .10000E+01 volume .37430E-02 ppm1 3.440 ppm2 1.998 CV 1
OR { 3765}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 71 and name HB2 ))
ASSI { 3770}
(( segid " " and resid 71 and name HD1 ))
( segid " " and resid 70 and name HD1%)
3.500 1.600 1.600 peak 3770 spectrum 1 weight .10000E+01 volume .90390E-03 ppm1 3.443 ppm2 .790 CV 1
OR { 3770}
(( segid " " and resid 71 and name HD1 ))
( segid " " and resid 70 and name HD2%)
ASSI { 3773}
(( segid " " and resid 71 and name HD1 ))
( segid " " and resid 32 and name HE% )
3.300 1.400 1.400 peak 3773 spectrum 1 weight .10000E+01 volume .72208E-03 ppm1 3.438 ppm2 6.990 CV 1
OR { 3773}
(( segid " " and resid 71 and name HD1 ))
(( segid " " and resid 32 and name HZ ))
ASSI { 3774}
(( segid " " and resid 71 and name HD2 ))
( segid " " and resid 32 and name HE% )
3.000 1.100 1.100 peak 3774 spectrum 1 weight .10000E+01 volume .67016E-03 ppm1 3.554 ppm2 6.985 CV 1
ASSI { 3778}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 70 and name HG ))
3.600 1.600 1.600 peak 3778 spectrum 1 weight .10000E+01 volume .12883E-02 ppm1 3.569 ppm2 1.800 CV 1
ASSI { 3779}
(( segid " " and resid 70 and name HB2 ))
( segid " " and resid 96 and name HG2%)
3.200 1.300 1.300 peak 3779 spectrum 1 weight .10000E+01 volume .18338E-02 ppm1 1.709 ppm2 .596 CV 1
ASSI { 3784}
( segid " " and resid 70 and name HD2%)
( segid " " and resid 92 and name HE% )
3.100 1.200 1.200 peak 3784 spectrum 1 weight .10000E+01 volume .13922E-02 ppm1 .752 ppm2 7.160 CV 1
OR { 3784}
( segid " " and resid 70 and name HD2%)
( segid " " and resid 92 and name HD% )
ASSI { 3788}
(( segid " " and resid 67 and name HA1 ))
( segid " " and resid 70 and name HD1%)
3.700 1.700 1.700 peak 3788 spectrum 1 weight .10000E+01 volume .15325E-02 ppm1 3.578 ppm2 .779 CV 1
OR { 3788}
(( segid " " and resid 67 and name HA1 ))
( segid " " and resid 70 and name HD2%)
ASSI { 3791}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB2 ))
2.500 .800 .800 peak 3791 spectrum 1 weight .10000E+01 volume .38157E-02 ppm1 4.331 ppm2 1.907 CV 1
ASSI { 3806}
(( segid " " and resid 68 and name HB1 ))
( segid " " and resid 66 and name HG1%)
3.200 1.300 1.300 peak 3806 spectrum 1 weight .10000E+01 volume .15429E-02 ppm1 2.559 ppm2 .995 CV 1
ASSI { 3807}
(( segid " " and resid 68 and name HB2 ))
( segid " " and resid 66 and name HG1%)
3.100 1.200 1.200 peak 3807 spectrum 1 weight .10000E+01 volume .16702E-02 ppm1 2.712 ppm2 .971 CV 1
ASSI { 3812}
(( segid " " and resid 67 and name HA1 ))
( segid " " and resid 40 and name HG1%)
3.300 1.300 1.300 peak 3812 spectrum 1 weight .10000E+01 volume .13039E-02 ppm1 3.569 ppm2 1.347 CV 1
OR { 3812}
(( segid " " and resid 67 and name HA1 ))
( segid " " and resid 40 and name HG2%)
ASSI { 3815}
(( segid " " and resid 66 and name HA ))
( segid " " and resid 40 and name HG2%)
2.900 1.100 1.100 peak 3815 spectrum 1 weight .10000E+01 volume .17377E-02 ppm1 4.245 ppm2 1.335 CV 1
ASSI { 3825}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 66 and name HN ))
2.500 .800 .800 peak 3825 spectrum 1 weight .10000E+01 volume .30494E-02 ppm1 3.969 ppm2 6.543 CV 1
ASSI { 3870}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HA ))
2.600 .800 .800 peak 3870 spectrum 1 weight .10000E+01 volume .37975E-02 ppm1 2.142 ppm2 4.070 CV 1
ASSI { 3875}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 37 and name HG1%)
2.300 .700 .700 peak 3875 spectrum 1 weight .10000E+01 volume .75793E-02 ppm1 4.067 ppm2 1.040 CV 1
ASSI { 3897}
(( segid " " and resid 59 and name HG2 ))
(( segid " " and resid 59 and name HA ))
2.700 .900 .900 peak 3897 spectrum 1 weight .10000E+01 volume .31247E-02 ppm1 1.916 ppm2 4.060 CV 1
OR { 3897}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 59 and name HA ))
ASSI { 3904}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 41 and name HG12))
3.400 1.500 1.500 peak 3904 spectrum 1 weight .10000E+01 volume .57143E-03 ppm1 3.808 ppm2 1.852 CV 1
ASSI { 3934}
(( segid " " and resid 55 and name HD1 ))
(( segid " " and resid 54 and name HB2 ))
4.400 2.400 1.600 peak 3934 spectrum 1 weight .10000E+01 volume .65196E-03 ppm1 3.660 ppm2 3.116 CV 1
ASSI { 3935}
(( segid " " and resid 55 and name HD2 ))
(( segid " " and resid 54 and name HB2 ))
3.900 1.900 1.900 peak 3935 spectrum 1 weight .10000E+01 volume .57923E-03 ppm1 3.889 ppm2 3.115 CV 1
ASSI { 3937}
(( segid " " and resid 55 and name HD1 ))
(( segid " " and resid 54 and name HB1 ))
4.400 2.400 1.600 peak 3937 spectrum 1 weight .10000E+01 volume .48832E-03 ppm1 3.658 ppm2 2.739 CV 1
ASSI { 3944}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 50 and name HB ))
3.200 1.200 1.200 peak 3944 spectrum 1 weight .10000E+01 volume .19143E-02 ppm1 2.726 ppm2 2.284 CV 1
ASSI { 3955}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 53 and name HG2%)
2.200 .600 .600 peak 3955 spectrum 1 weight .10000E+01 volume .10673E-01 ppm1 4.128 ppm2 1.210 CV 1
ASSI { 3962}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 51 and name HB2 ))
1.800 .400 .400 peak 3962 spectrum 1 weight .10000E+01 volume .12099E-01 ppm1 1.870 ppm2 2.252 CV 1
OR { 3962}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 51 and name HG1 ))
ASSI { 3965}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HB1 ))
1.800 .400 .400 peak 3965 spectrum 1 weight .10000E+01 volume .98211E-02 ppm1 2.215 ppm2 1.892 CV 1
ASSI { 3976}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 54 and name HB2 ))
3.100 1.200 1.200 peak 3976 spectrum 1 weight .10000E+01 volume .10832E-02 ppm1 .738 ppm2 3.119 CV 1
ASSI { 3980}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 50 and name HB ))
2.200 .600 .600 peak 3980 spectrum 1 weight .10000E+01 volume .77169E-02 ppm1 .737 ppm2 2.281 CV 1
ASSI { 3984}
(( segid " " and resid 60 and name HG ))
(( segid " " and resid 60 and name HN ))
3.400 1.400 1.400 peak 3984 spectrum 1 weight .10000E+01 volume .12364E-02 ppm1 2.032 ppm2 8.594 CV 1
ASSI { 3988}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HB1 ))
2.200 .600 .600 peak 3988 spectrum 1 weight .10000E+01 volume .87273E-02 ppm1 4.183 ppm2 1.575 CV 1
OR { 3988}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HG ))
OR { 3988}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HB2 ))
ASSI { 3990}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 48 and name HD2%)
2.600 .800 .800 peak 3990 spectrum 1 weight .10000E+01 volume .69560E-02 ppm1 4.183 ppm2 .684 CV 1
OR { 3990}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 48 and name HD1%)
ASSI { 3998}
(( segid " " and resid 48 and name HB2 ))
( segid " " and resid 48 and name HD1%)
2.300 .600 .600 peak 3998 spectrum 1 weight .10000E+01 volume .87377E-02 ppm1 1.556 ppm2 .709 CV 1
OR { 3998}
(( segid " " and resid 48 and name HB1 ))
( segid " " and resid 48 and name HD2%)
OR { 3998}
(( segid " " and resid 48 and name HB2 ))
( segid " " and resid 48 and name HD2%)
OR { 3998}
(( segid " " and resid 48 and name HB1 ))
( segid " " and resid 48 and name HD1%)
ASSI { 4000}
(( segid " " and resid 48 and name HG ))
( segid " " and resid 48 and name HD1%)
2.300 .700 .700 peak 4000 spectrum 1 weight .10000E+01 volume .55871E-02 ppm1 1.547 ppm2 .699 CV 1
OR { 4000}
(( segid " " and resid 48 and name HG ))
( segid " " and resid 48 and name HD2%)
ASSI { 4003}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 48 and name HB1 ))
4.100 2.100 1.900 peak 4003 spectrum 1 weight .10000E+01 volume .57923E-03 ppm1 3.295 ppm2 1.583 CV 1
OR { 4003}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 48 and name HB2 ))
OR { 4003}
(( segid " " and resid 47 and name HB ))
(( segid " " and resid 48 and name HG ))
ASSI { 4005}
(( segid " " and resid 47 and name HB ))
( segid " " and resid 95 and name HD1%)
3.200 1.300 1.300 peak 4005 spectrum 1 weight .10000E+01 volume .14728E-02 ppm1 3.289 ppm2 .759 CV 1
OR { 4005}
(( segid " " and resid 47 and name HB ))
( segid " " and resid 95 and name HD2%)
ASSI { 4021}
(( segid " " and resid 45 and name HB ))
( segid " " and resid 45 and name HG2%)
2.300 .600 .600 peak 4021 spectrum 1 weight .10000E+01 volume .61562E-02 ppm1 1.817 ppm2 .881 CV 1
OR { 4021}
(( segid " " and resid 45 and name HB ))
( segid " " and resid 45 and name HD1%)
ASSI { 4029}
(( segid " " and resid 45 and name HG11))
(( segid " " and resid 52 and name HA ))
4.200 2.200 1.800 peak 4029 spectrum 1 weight .10000E+01 volume .70394E-03 ppm1 .813 ppm2 3.995 CV 1
ASSI { 4030}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 45 and name HD1%)
2.500 .800 .800 peak 4030 spectrum 1 weight .10000E+01 volume .53844E-02 ppm1 3.792 ppm2 .834 CV 1
OR { 4030}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 45 and name HG11))
ASSI { 4031}
(( segid " " and resid 45 and name HG11))
( segid " " and resid 56 and name HD2%)
3.100 1.200 1.200 peak 4031 spectrum 1 weight .10000E+01 volume .12182E-02 ppm1 .812 ppm2 .544 CV 1
ASSI { 4032}
(( segid " " and resid 45 and name HG12))
(( segid " " and resid 45 and name HG11))
1.800 .400 .400 peak 4032 spectrum 1 weight .10000E+01 volume .99897E-02 ppm1 1.637 ppm2 .835 CV 1
OR { 4032}
(( segid " " and resid 45 and name HG12))
( segid " " and resid 45 and name HD1%)
ASSI { 4035}
(( segid " " and resid 45 and name HG12))
( segid " " and resid 56 and name HD2%)
3.200 1.300 1.300 peak 4035 spectrum 1 weight .10000E+01 volume .10052E-02 ppm1 1.634 ppm2 .561 CV 1
ASSI { 4041}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 48 and name HN ))
3.700 1.700 1.700 peak 4041 spectrum 1 weight .10000E+01 volume .49613E-03 ppm1 3.434 ppm2 8.315 CV 1
ASSI { 4069}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 43 and name HE3 ))
3.300 1.400 1.400 peak 4069 spectrum 1 weight .10000E+01 volume .96105E-03 ppm1 3.789 ppm2 7.951 CV 1
ASSI { 4071}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 45 and name HG12))
4.000 2.000 2.000 peak 4071 spectrum 1 weight .10000E+01 volume .87017E-03 ppm1 3.794 ppm2 1.653 CV 1
ASSI { 4081}
(( segid " " and resid 41 and name HG11))
(( segid " " and resid 41 and name HN ))
2.700 .900 .900 peak 4081 spectrum 1 weight .10000E+01 volume .12987E-02 ppm1 1.222 ppm2 8.533 CV 1
ASSI { 4083}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HN ))
3.400 1.400 1.400 peak 4083 spectrum 1 weight .10000E+01 volume .91692E-03 ppm1 3.607 ppm2 8.993 CV 1
ASSI { 4089}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 41 and name HG11))
2.500 .800 .800 peak 4089 spectrum 1 weight .10000E+01 volume .36079E-02 ppm1 3.611 ppm2 1.244 CV 1
ASSI { 4111}
(( segid " " and resid 40 and name HB ))
( segid " " and resid 40 and name HG1%)
2.500 .800 .800 peak 4111 spectrum 1 weight .10000E+01 volume .38780E-02 ppm1 2.721 ppm2 1.306 CV 1
OR { 4111}
(( segid " " and resid 40 and name HB ))
( segid " " and resid 40 and name HG2%)
ASSI { 4125}
( segid " " and resid 40 and name HG2%)
(( segid " " and resid 67 and name HA2 ))
3.300 1.400 1.400 peak 4125 spectrum 1 weight .10000E+01 volume .80522E-03 ppm1 1.329 ppm2 4.605 CV 1
ASSI { 4154}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 40 and name HN ))
3.500 1.500 1.500 peak 4154 spectrum 1 weight .10000E+01 volume .73249E-03 ppm1 4.135 ppm2 8.226 CV 1
ASSI { 4156}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 40 and name HG1%)
3.100 1.200 1.200 peak 4156 spectrum 1 weight .10000E+01 volume .13715E-02 ppm1 4.135 ppm2 1.335 CV 1
OR { 4156}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 40 and name HG2%)
ASSI { 4182}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 68 and name HB1 ))
4.000 2.000 2.000 peak 4182 spectrum 1 weight .10000E+01 volume .47793E-03 ppm1 3.670 ppm2 2.570 CV 1
ASSI { 417}
(( segid " " and resid 108 and name HN ))
(( segid " " and resid 107 and name HA ))
2.500 .800 .800 peak 417 spectrum 1 weight .10000E+01 volume .39977E-02 ppm1 7.809 ppm2 4.307 CV 1
ASSI { 420}
(( segid " " and resid 108 and name HN ))
(( segid " " and resid 108 and name HB1 ))
3.400 1.500 1.500 peak 420 spectrum 1 weight .10000E+01 volume .12884E-02 ppm1 7.807 ppm2 2.526 CV 1
ASSI { 430}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 106 and name HA ))
2.800 1.000 1.000 peak 430 spectrum 1 weight .10000E+01 volume .63638E-02 ppm1 7.904 ppm2 4.665 CV 1
ASSI { 434}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 107 and name HA ))
3.000 1.100 1.100 peak 434 spectrum 1 weight .10000E+01 volume .13188E-02 ppm1 7.899 ppm2 4.303 CV 1
ASSI { 441}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 104 and name HN ))
2.200 .600 .600 peak 441 spectrum 1 weight .10000E+01 volume .73634E-02 ppm1 8.079 ppm2 7.885 CV 1
ASSI { 445}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 104 and name HB1 ))
2.200 .600 .600 peak 445 spectrum 1 weight .10000E+01 volume .60053E-02 ppm1 8.080 ppm2 1.457 CV 1
ASSI { 452}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 106 and name HE3 ))
3.500 1.600 1.600 peak 452 spectrum 1 weight .10000E+01 volume .81474E-03 ppm1 8.060 ppm2 7.653 CV 1
ASSI { 453}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 106 and name HA ))
2.300 .700 .700 peak 453 spectrum 1 weight .10000E+01 volume .86800E-02 ppm1 8.046 ppm2 4.662 CV 1
ASSI { 465}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 106 and name HE3 ))
3.400 3.400 2.600 peak 465 spectrum 1 weight .10000E+01 volume .96682E-03 ppm1 7.870 ppm2 7.603 CV 1
ASSI { 472}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 107 and name HB2 ))
3.200 1.300 1.300 peak 472 spectrum 1 weight .10000E+01 volume .61488E-03 ppm1 7.909 ppm2 1.749 CV 1
ASSI { 477}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 103 and name HB2 ))
3.800 1.800 1.800 peak 477 spectrum 1 weight .10000E+01 volume .95163E-03 ppm1 7.867 ppm2 1.887 CV 1
ASSI { 478}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 103 and name HB1 ))
3.600 1.600 1.600 peak 478 spectrum 1 weight .10000E+01 volume .95163E-03 ppm1 7.871 ppm2 1.787 CV 1
ASSI { 483}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 103 and name HG1 ))
3.500 1.500 1.500 peak 483 spectrum 1 weight .10000E+01 volume .14992E-02 ppm1 7.872 ppm2 1.391 CV 1
OR { 483}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 103 and name HG2 ))
ASSI { 492}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 103 and name HA ))
2.900 1.000 1.000 peak 492 spectrum 1 weight .10000E+01 volume .20466E-02 ppm1 7.941 ppm2 4.238 CV 1
ASSI { 493}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 102 and name HB2 ))
3.400 1.400 1.400 peak 493 spectrum 1 weight .10000E+01 volume .12080E-02 ppm1 7.948 ppm2 4.024 CV 1
OR { 493}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 102 and name HB1 ))
ASSI { 495}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 103 and name HG1 ))
3.500 1.600 1.600 peak 495 spectrum 1 weight .10000E+01 volume .13101E-02 ppm1 7.943 ppm2 1.378 CV 1
OR { 495}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 103 and name HG2 ))
ASSI { 496}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 103 and name HB1 ))
3.100 1.200 1.200 peak 496 spectrum 1 weight .10000E+01 volume .24747E-02 ppm1 7.943 ppm2 1.782 CV 1
ASSI { 497}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 103 and name HB2 ))
3.000 1.100 1.100 peak 497 spectrum 1 weight .10000E+01 volume .15665E-02 ppm1 7.947 ppm2 1.885 CV 1
ASSI { 502}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 101 and name HA ))
2.800 1.000 1.000 peak 502 spectrum 1 weight .10000E+01 volume .38673E-02 ppm1 8.004 ppm2 4.585 CV 1
ASSI { 504}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 102 and name HA ))
2.600 .800 .800 peak 504 spectrum 1 weight .10000E+01 volume .36457E-02 ppm1 8.002 ppm2 4.392 CV 1
ASSI { 506}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 102 and name HB1 ))
2.600 .800 .800 peak 506 spectrum 1 weight .10000E+01 volume .51364E-02 ppm1 8.002 ppm2 4.021 CV 1
OR { 506}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 102 and name HB2 ))
ASSI { 509}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 101 and name HB2 ))
3.400 1.400 1.400 peak 509 spectrum 1 weight .10000E+01 volume .14904E-02 ppm1 8.009 ppm2 2.760 CV 1
ASSI { 510}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 101 and name HB1 ))
3.000 1.100 1.100 peak 510 spectrum 1 weight .10000E+01 volume .14904E-02 ppm1 8.011 ppm2 2.679 CV 1
ASSI { 511}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 102 and name HN ))
2.500 .800 .800 peak 511 spectrum 1 weight .10000E+01 volume .37065E-02 ppm1 8.160 ppm2 8.006 CV 1
ASSI { 513}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 99 and name HN ))
4.000 2.000 2.000 peak 513 spectrum 1 weight .10000E+01 volume .45408E-03 ppm1 8.160 ppm2 7.751 CV 1
ASSI { 514}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 101 and name HA ))
2.700 .900 .900 peak 514 spectrum 1 weight .10000E+01 volume .32916E-02 ppm1 8.161 ppm2 4.583 CV 1
ASSI { 515}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 98 and name HA ))
3.200 1.300 1.300 peak 515 spectrum 1 weight .10000E+01 volume .11254E-02 ppm1 8.163 ppm2 4.162 CV 1
ASSI { 516}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HA ))
2.900 1.100 1.100 peak 516 spectrum 1 weight .10000E+01 volume .24095E-02 ppm1 8.158 ppm2 4.022 CV 1
ASSI { 519}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HB2 ))
3.300 1.400 1.400 peak 519 spectrum 1 weight .10000E+01 volume .26181E-02 ppm1 8.163 ppm2 1.931 CV 1
ASSI { 521}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HB1 ))
2.600 .900 .900 peak 521 spectrum 1 weight .10000E+01 volume .18945E-02 ppm1 8.163 ppm2 1.713 CV 1
ASSI { 523}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HG1 ))
4.600 2.600 1.400 peak 523 spectrum 1 weight .10000E+01 volume .54318E-03 ppm1 8.163 ppm2 1.523 CV 1
ASSI { 531}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 99 and name HA ))
3.100 1.200 1.200 peak 531 spectrum 1 weight .10000E+01 volume .17229E-02 ppm1 8.055 ppm2 4.126 CV 1
ASSI { 537}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 100 and name HB2 ))
2.300 .700 .700 peak 537 spectrum 1 weight .10000E+01 volume .48493E-02 ppm1 8.053 ppm2 1.942 CV 1
ASSI { 538}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 100 and name HB1 ))
2.400 .700 .700 peak 538 spectrum 1 weight .10000E+01 volume .57794E-02 ppm1 8.054 ppm2 1.716 CV 1
ASSI { 541}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 100 and name HN ))
2.400 .700 .700 peak 541 spectrum 1 weight .10000E+01 volume .39912E-02 ppm1 7.778 ppm2 8.060 CV 1
ASSI { 546}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 96 and name HA ))
3.200 1.300 1.300 peak 546 spectrum 1 weight .10000E+01 volume .11602E-02 ppm1 7.778 ppm2 3.559 CV 1
ASSI { 548}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 99 and name HG1 ))
4.100 2.100 1.900 peak 548 spectrum 1 weight .10000E+01 volume .89078E-03 ppm1 7.771 ppm2 2.255 CV 1
OR { 548}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 99 and name HG2 ))
ASSI { 550}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 99 and name HB2 ))
2.200 .600 .600 peak 550 spectrum 1 weight .10000E+01 volume .49124E-02 ppm1 7.775 ppm2 1.978 CV 1
ASSI { 551}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 99 and name HB1 ))
3.100 1.200 1.200 peak 551 spectrum 1 weight .10000E+01 volume .23921E-02 ppm1 7.779 ppm2 1.781 CV 1
ASSI { 558}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 97 and name HN ))
2.800 1.000 1.000 peak 558 spectrum 1 weight .10000E+01 volume .19119E-02 ppm1 8.105 ppm2 8.353 CV 1
ASSI { 561}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 99 and name HN ))
2.500 .800 .800 peak 561 spectrum 1 weight .10000E+01 volume .30960E-02 ppm1 8.108 ppm2 7.750 CV 1
ASSI { 563}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 97 and name HB2 ))
3.300 1.400 1.400 peak 563 spectrum 1 weight .10000E+01 volume .17925E-02 ppm1 8.107 ppm2 3.007 CV 1
ASSI { 565}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 97 and name HB1 ))
2.800 1.000 1.000 peak 565 spectrum 1 weight .10000E+01 volume .14731E-02 ppm1 8.107 ppm2 2.819 CV 1
ASSI { 566}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 98 and name HB2 ))
2.200 .600 .600 peak 566 spectrum 1 weight .10000E+01 volume .72154E-02 ppm1 8.109 ppm2 1.976 CV 1
OR { 566}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 98 and name HB1 ))
ASSI { 567}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 98 and name HD1 ))
3.000 1.100 1.100 peak 567 spectrum 1 weight .10000E+01 volume .31286E-02 ppm1 8.108 ppm2 1.698 CV 1
OR { 567}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 98 and name HD2 ))
ASSI { 572}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 97 and name HA ))
2.700 .900 .900 peak 572 spectrum 1 weight .10000E+01 volume .26984E-02 ppm1 8.371 ppm2 4.213 CV 1
ASSI { 573}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 95 and name HA ))
3.800 1.800 1.800 peak 573 spectrum 1 weight .10000E+01 volume .45408E-03 ppm1 8.374 ppm2 4.075 CV 1
ASSI { 574}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 94 and name HA ))
3.100 1.200 1.200 peak 574 spectrum 1 weight .10000E+01 volume .13774E-02 ppm1 8.374 ppm2 3.700 CV 1
ASSI { 576}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 96 and name HA ))
3.600 1.600 1.600 peak 576 spectrum 1 weight .10000E+01 volume .57360E-03 ppm1 8.368 ppm2 3.558 CV 1
ASSI { 577}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 97 and name HB2 ))
2.400 .700 .700 peak 577 spectrum 1 weight .10000E+01 volume .35349E-02 ppm1 8.371 ppm2 3.009 CV 1
ASSI { 578}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 97 and name HB1 ))
3.200 1.300 1.300 peak 578 spectrum 1 weight .10000E+01 volume .23790E-02 ppm1 8.372 ppm2 2.819 CV 1
ASSI { 579}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 96 and name HB ))
2.500 .800 .800 peak 579 spectrum 1 weight .10000E+01 volume .30004E-02 ppm1 8.373 ppm2 1.745 CV 1
ASSI { 589}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 97 and name HN ))
2.500 .800 .800 peak 589 spectrum 1 weight .10000E+01 volume .34502E-02 ppm1 8.297 ppm2 8.397 CV 1
ASSI { 590}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 95 and name HN ))
2.700 .900 .900 peak 590 spectrum 1 weight .10000E+01 volume .23986E-02 ppm1 8.289 ppm2 7.795 CV 1
ASSI { 593}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 95 and name HA ))
3.400 1.500 1.500 peak 593 spectrum 1 weight .10000E+01 volume .78649E-03 ppm1 8.294 ppm2 4.072 CV 1
ASSI { 595}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 96 and name HA ))
2.800 1.000 1.000 peak 595 spectrum 1 weight .10000E+01 volume .20206E-02 ppm1 8.291 ppm2 3.559 CV 1
ASSI { 598}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 96 and name HB ))
2.300 .700 .700 peak 598 spectrum 1 weight .10000E+01 volume .53317E-02 ppm1 8.291 ppm2 1.742 CV 1
ASSI { 600}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 96 and name HG12))
3.200 1.300 1.300 peak 600 spectrum 1 weight .10000E+01 volume .31851E-02 ppm1 8.291 ppm2 1.566 CV 1
ASSI { 601}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 96 and name HG11))
2.600 .800 .800 peak 601 spectrum 1 weight .10000E+01 volume .20336E-02 ppm1 8.289 ppm2 .678 CV 1
ASSI { 602}
(( segid " " and resid 96 and name HN ))
( segid " " and resid 96 and name HG2%)
3.600 1.600 1.600 peak 602 spectrum 1 weight .10000E+01 volume .21031E-02 ppm1 8.288 ppm2 .566 CV 1
ASSI { 603}
(( segid " " and resid 96 and name HN ))
( segid " " and resid 96 and name HD1%)
3.500 1.600 1.600 peak 603 spectrum 1 weight .10000E+01 volume .13623E-02 ppm1 8.288 ppm2 .256 CV 1
ASSI { 606}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 94 and name HN ))
2.600 .900 .900 peak 606 spectrum 1 weight .10000E+01 volume .28157E-02 ppm1 7.827 ppm2 8.443 CV 1
ASSI { 609}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 92 and name HA ))
3.100 1.200 1.200 peak 609 spectrum 1 weight .10000E+01 volume .12058E-02 ppm1 7.828 ppm2 4.448 CV 1
ASSI { 613}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 94 and name HA ))
3.300 1.400 1.400 peak 613 spectrum 1 weight .10000E+01 volume .10624E-02 ppm1 7.826 ppm2 3.699 CV 1
ASSI { 616}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 94 and name HB ))
2.400 .700 .700 peak 616 spectrum 1 weight .10000E+01 volume .36587E-02 ppm1 7.828 ppm2 2.009 CV 1
ASSI { 617}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 95 and name HG ))
2.600 .800 .800 peak 617 spectrum 1 weight .10000E+01 volume .40368E-02 ppm1 7.827 ppm2 1.840 CV 1
ASSI { 618}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 95 and name HB1 ))
3.100 1.200 1.200 peak 618 spectrum 1 weight .10000E+01 volume .34089E-02 ppm1 7.827 ppm2 1.729 CV 1
ASSI { 624}
(( segid " " and resid 95 and name HN ))
( segid " " and resid 95 and name HD2%)
3.600 1.700 1.700 peak 624 spectrum 1 weight .10000E+01 volume .16838E-02 ppm1 7.829 ppm2 .731 CV 1
ASSI { 630}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 94 and name HB ))
2.300 .700 .700 peak 630 spectrum 1 weight .10000E+01 volume .47385E-02 ppm1 8.466 ppm2 2.024 CV 1
ASSI { 637}
(( segid " " and resid 94 and name HN ))
( segid " " and resid 94 and name HG2%)
3.700 1.700 1.700 peak 637 spectrum 1 weight .10000E+01 volume .19250E-02 ppm1 8.460 ppm2 .938 CV 1
ASSI { 638}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HA ))
3.900 1.900 1.900 peak 638 spectrum 1 weight .10000E+01 volume .42367E-03 ppm1 8.705 ppm2 4.446 CV 1
ASSI { 641}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 90 and name HA ))
3.200 1.300 1.300 peak 641 spectrum 1 weight .10000E+01 volume .97550E-03 ppm1 8.711 ppm2 3.653 CV 1
ASSI { 642}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HB2 ))
3.700 1.700 1.700 peak 642 spectrum 1 weight .10000E+01 volume .16882E-02 ppm1 8.710 ppm2 3.266 CV 1
ASSI { 643}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HB1 ))
2.800 1.000 1.000 peak 643 spectrum 1 weight .10000E+01 volume .11646E-02 ppm1 8.705 ppm2 3.144 CV 1
ASSI { 646}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HB2 ))
2.300 .700 .700 peak 646 spectrum 1 weight .10000E+01 volume .50777E-02 ppm1 8.711 ppm2 2.067 CV 1
OR { 646}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HB1 ))
ASSI { 651}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 93 and name HN ))
2.700 .900 .900 peak 651 spectrum 1 weight .10000E+01 volume .24008E-02 ppm1 8.467 ppm2 8.678 CV 1
ASSI { 652}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HN ))
2.500 .800 .800 peak 652 spectrum 1 weight .10000E+01 volume .30786E-02 ppm1 8.468 ppm2 7.284 CV 1
ASSI { 653}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 92 and name HA ))
2.700 .900 .900 peak 653 spectrum 1 weight .10000E+01 volume .26637E-02 ppm1 8.470 ppm2 4.443 CV 1
ASSI { 657}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HA ))
3.000 1.100 1.100 peak 657 spectrum 1 weight .10000E+01 volume .17251E-02 ppm1 8.467 ppm2 3.898 CV 1
ASSI { 659}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 92 and name HB1 ))
2.400 .700 .700 peak 659 spectrum 1 weight .10000E+01 volume .53336E-02 ppm1 8.471 ppm2 3.143 CV 1
ASSI { 660}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 92 and name HB2 ))
2.400 .700 .700 peak 660 spectrum 1 weight .10000E+01 volume .42323E-02 ppm1 8.471 ppm2 3.274 CV 1
ASSI { 666}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HG1 ))
3.700 1.800 1.800 peak 666 spectrum 1 weight .10000E+01 volume .93640E-03 ppm1 8.467 ppm2 1.375 CV 1
ASSI { 672}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 42 and name HA ))
3.200 1.300 1.300 peak 672 spectrum 1 weight .10000E+01 volume .11298E-02 ppm1 8.586 ppm2 3.793 CV 1
ASSI { 674}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HA ))
2.600 .800 .800 peak 674 spectrum 1 weight .10000E+01 volume .33828E-02 ppm1 7.311 ppm2 3.905 CV 1
ASSI { 677}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HB ))
2.100 .600 .600 peak 677 spectrum 1 weight .10000E+01 volume .71178E-02 ppm1 7.311 ppm2 1.902 CV 1
ASSI { 680}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HG1 ))
3.900 1.900 1.900 peak 680 spectrum 1 weight .10000E+01 volume .10689E-02 ppm1 7.308 ppm2 1.374 CV 1
ASSI { 690}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 91 and name HN ))
2.600 .900 .900 peak 690 spectrum 1 weight .10000E+01 volume .24812E-02 ppm1 8.396 ppm2 7.282 CV 1
ASSI { 691}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 87 and name HA ))
3.300 1.400 1.400 peak 691 spectrum 1 weight .10000E+01 volume .10385E-02 ppm1 8.398 ppm2 4.390 CV 1
ASSI { 692}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 89 and name HA ))
3.500 1.500 1.500 peak 692 spectrum 1 weight .10000E+01 volume .74521E-03 ppm1 8.398 ppm2 4.027 CV 1
ASSI { 700}
(( segid " " and resid 90 and name HN ))
( segid " " and resid 90 and name HD1%)
3.200 1.300 1.300 peak 700 spectrum 1 weight .10000E+01 volume .32068E-02 ppm1 8.395 ppm2 .882 CV 1
ASSI { 701}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 88 and name HN ))
2.200 .600 .600 peak 701 spectrum 1 weight .10000E+01 volume .73634E-02 ppm1 8.095 ppm2 7.854 CV 1
ASSI { 704}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 89 and name HA ))
2.600 .900 .900 peak 704 spectrum 1 weight .10000E+01 volume .33416E-02 ppm1 8.097 ppm2 4.034 CV 1
ASSI { 712}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 88 and name HB1 ))
2.400 .700 .700 peak 712 spectrum 1 weight .10000E+01 volume .39998E-02 ppm1 8.095 ppm2 1.684 CV 1
ASSI { 718}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 39 and name HB1 ))
4.100 2.100 1.900 peak 718 spectrum 1 weight .10000E+01 volume .75828E-03 ppm1 9.649 ppm2 1.843 CV 1
ASSI { 721}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HA ))
2.600 .900 .900 peak 721 spectrum 1 weight .10000E+01 volume .32916E-02 ppm1 7.878 ppm2 3.885 CV 1
ASSI { 723}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HB2 ))
2.700 .900 .900 peak 723 spectrum 1 weight .10000E+01 volume .23725E-02 ppm1 7.879 ppm2 2.951 CV 1
ASSI { 725}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HB1 ))
3.000 1.200 1.200 peak 725 spectrum 1 weight .10000E+01 volume .16251E-02 ppm1 7.881 ppm2 2.772 CV 1
ASSI { 727}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HB2 ))
2.300 .700 .700 peak 727 spectrum 1 weight .10000E+01 volume .39021E-02 ppm1 7.881 ppm2 1.835 CV 1
ASSI { 729}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 88 and name HB1 ))
2.800 1.000 1.000 peak 729 spectrum 1 weight .10000E+01 volume .34697E-02 ppm1 7.878 ppm2 1.685 CV 1
ASSI { 731}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HN ))
2.700 .900 .900 peak 731 spectrum 1 weight .10000E+01 volume .21401E-02 ppm1 8.109 ppm2 8.351 CV 1
ASSI { 734}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 88 and name HN ))
2.400 .700 .700 peak 734 spectrum 1 weight .10000E+01 volume .50841E-02 ppm1 8.108 ppm2 7.840 CV 1
ASSI { 736}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 85 and name HA ))
3.600 1.600 1.600 peak 736 spectrum 1 weight .10000E+01 volume .10907E-02 ppm1 8.108 ppm2 4.632 CV 1
ASSI { 737}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HA ))
2.500 .800 .800 peak 737 spectrum 1 weight .10000E+01 volume .39738E-02 ppm1 8.109 ppm2 4.390 CV 1
ASSI { 738}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HA ))
3.200 1.300 1.300 peak 738 spectrum 1 weight .10000E+01 volume .11884E-02 ppm1 8.115 ppm2 3.921 CV 1
ASSI { 741}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HB2 ))
2.100 .600 .600 peak 741 spectrum 1 weight .10000E+01 volume .68263E-02 ppm1 8.109 ppm2 2.952 CV 1
ASSI { 742}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 87 and name HB1 ))
3.200 1.300 1.300 peak 742 spectrum 1 weight .10000E+01 volume .42910E-02 ppm1 8.109 ppm2 2.773 CV 1
ASSI { 744}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HB2 ))
3.200 1.300 1.300 peak 744 spectrum 1 weight .10000E+01 volume .25898E-02 ppm1 8.109 ppm2 1.737 CV 1
ASSI { 745}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 86 and name HB1 ))
2.600 .900 .900 peak 745 spectrum 1 weight .10000E+01 volume .21944E-02 ppm1 8.109 ppm2 1.620 CV 1
ASSI { 754}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HA ))
2.700 .900 .900 peak 754 spectrum 1 weight .10000E+01 volume .25181E-02 ppm1 7.293 ppm2 4.629 CV 1
ASSI { 755}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 86 and name HN ))
4.000 2.000 2.000 peak 755 spectrum 1 weight .10000E+01 volume .67134E-03 ppm1 7.292 ppm2 8.353 CV 1
ASSI { 757}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 84 and name HA2 ))
3.400 1.500 1.500 peak 757 spectrum 1 weight .10000E+01 volume .10538E-02 ppm1 7.293 ppm2 4.259 CV 1
ASSI { 760}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 82 and name HB2 ))
4.200 2.200 1.800 peak 760 spectrum 1 weight .10000E+01 volume .12254E-02 ppm1 7.297 ppm2 3.231 CV 1
ASSI { 761}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 84 and name HA1 ))
3.400 1.500 1.500 peak 761 spectrum 1 weight .10000E+01 volume .12189E-02 ppm1 7.301 ppm2 3.558 CV 1
ASSI { 762}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HB2 ))
2.400 .700 .700 peak 762 spectrum 1 weight .10000E+01 volume .33785E-02 ppm1 7.294 ppm2 3.068 CV 1
ASSI { 763}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 82 and name HB1 ))
3.300 1.300 1.300 peak 763 spectrum 1 weight .10000E+01 volume .10885E-02 ppm1 7.297 ppm2 2.916 CV 1
ASSI { 764}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HB1 ))
2.800 1.000 1.000 peak 764 spectrum 1 weight .10000E+01 volume .42780E-02 ppm1 7.295 ppm2 2.674 CV 1
ASSI { 768}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 88 and name HN ))
4.000 2.000 2.000 peak 768 spectrum 1 weight .10000E+01 volume .46712E-03 ppm1 8.359 ppm2 7.841 CV 1
ASSI { 769}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HA ))
2.100 .500 .500 peak 769 spectrum 1 weight .10000E+01 volume .10311E-01 ppm1 8.363 ppm2 4.629 CV 1
ASSI { 771}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HA ))
2.600 .900 .900 peak 771 spectrum 1 weight .10000E+01 volume .29939E-02 ppm1 8.364 ppm2 3.929 CV 1
ASSI { 772}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HB2 ))
4.400 2.500 1.600 peak 772 spectrum 1 weight .10000E+01 volume .62139E-03 ppm1 8.360 ppm2 3.096 CV 1
ASSI { 773}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 85 and name HB1 ))
3.800 1.800 1.800 peak 773 spectrum 1 weight .10000E+01 volume .75389E-03 ppm1 8.367 ppm2 2.674 CV 1
ASSI { 775}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HB1 ))
2.500 .800 .800 peak 775 spectrum 1 weight .10000E+01 volume .49342E-02 ppm1 8.362 ppm2 1.610 CV 1
ASSI { 777}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HB2 ))
2.300 .700 .700 peak 777 spectrum 1 weight .10000E+01 volume .48037E-02 ppm1 8.363 ppm2 1.734 CV 1
ASSI { 782}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 85 and name HN ))
2.400 .700 .700 peak 782 spectrum 1 weight .10000E+01 volume .24920E-02 ppm1 8.539 ppm2 7.278 CV 1
ASSI { 783}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HA ))
2.700 .900 .900 peak 783 spectrum 1 weight .10000E+01 volume .32068E-02 ppm1 8.540 ppm2 4.416 CV 1
ASSI { 784}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 84 and name HA2 ))
2.500 .800 .800 peak 784 spectrum 1 weight .10000E+01 volume .31156E-02 ppm1 8.539 ppm2 4.267 CV 1
ASSI { 786}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 84 and name HA1 ))
2.600 .800 .800 peak 786 spectrum 1 weight .10000E+01 volume .44474E-02 ppm1 8.543 ppm2 3.554 CV 1
ASSI { 791}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 79 and name HG2 ))
3.500 1.600 1.600 peak 791 spectrum 1 weight .10000E+01 volume .77564E-03 ppm1 8.533 ppm2 2.252 CV 1
ASSI { 793}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 84 and name HN ))
2.600 .800 .800 peak 793 spectrum 1 weight .10000E+01 volume .27332E-02 ppm1 8.131 ppm2 8.524 CV 1
ASSI { 800}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HB2 ))
4.200 2.200 1.800 peak 800 spectrum 1 weight .10000E+01 volume .78649E-03 ppm1 8.132 ppm2 3.232 CV 1
ASSI { 801}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HB2 ))
3.100 1.200 1.200 peak 801 spectrum 1 weight .10000E+01 volume .11059E-02 ppm1 8.139 ppm2 3.048 CV 1
ASSI { 803}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HB1 ))
3.200 1.200 1.200 peak 803 spectrum 1 weight .10000E+01 volume .79738E-03 ppm1 8.131 ppm2 2.909 CV 1
ASSI { 804}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HB1 ))
3.200 1.300 1.300 peak 804 spectrum 1 weight .10000E+01 volume .19054E-02 ppm1 8.134 ppm2 2.452 CV 1
ASSI { 806}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 83 and name HN ))
3.600 1.600 1.600 peak 806 spectrum 1 weight .10000E+01 volume .15187E-02 ppm1 7.280 ppm2 8.114 CV 1
ASSI { 808}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 82 and name HA ))
3.000 1.100 1.100 peak 808 spectrum 1 weight .10000E+01 volume .16686E-02 ppm1 7.288 ppm2 4.440 CV 1
ASSI { 810}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 82 and name HB2 ))
3.000 1.100 1.100 peak 810 spectrum 1 weight .10000E+01 volume .11428E-02 ppm1 7.278 ppm2 3.228 CV 1
ASSI { 812}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 82 and name HB1 ))
3.100 1.200 1.200 peak 812 spectrum 1 weight .10000E+01 volume .21183E-02 ppm1 7.278 ppm2 2.913 CV 1
ASSI { 819}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HN ))
2.500 .800 .800 peak 819 spectrum 1 weight .10000E+01 volume .34719E-02 ppm1 8.304 ppm2 8.907 CV 1
ASSI { 822}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HA ))
3.300 1.400 1.400 peak 822 spectrum 1 weight .10000E+01 volume .97116E-03 ppm1 8.303 ppm2 3.561 CV 1
ASSI { 824}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 80 and name HB2 ))
2.100 .600 .600 peak 824 spectrum 1 weight .10000E+01 volume .68135E-02 ppm1 8.304 ppm2 2.906 CV 1
ASSI { 827}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HB2 ))
3.000 1.200 1.200 peak 827 spectrum 1 weight .10000E+01 volume .30721E-02 ppm1 8.305 ppm2 2.166 CV 1
ASSI { 830}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 79 and name HB1 ))
2.400 .700 .700 peak 830 spectrum 1 weight .10000E+01 volume .37153E-02 ppm1 8.305 ppm2 1.905 CV 1
ASSI { 838}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HA ))
3.600 1.600 1.600 peak 838 spectrum 1 weight .10000E+01 volume .64092E-03 ppm1 8.924 ppm2 4.114 CV 1
ASSI { 840}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HA ))
2.800 1.000 1.000 peak 840 spectrum 1 weight .10000E+01 volume .21813E-02 ppm1 8.921 ppm2 3.563 CV 1
ASSI { 841}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HB2 ))
2.800 1.000 1.000 peak 841 spectrum 1 weight .10000E+01 volume .19141E-02 ppm1 8.921 ppm2 3.429 CV 1
ASSI { 843}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HB1 ))
3.300 1.300 1.300 peak 843 spectrum 1 weight .10000E+01 volume .12471E-02 ppm1 8.922 ppm2 2.819 CV 1
ASSI { 844}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HB2 ))
2.400 .700 .700 peak 844 spectrum 1 weight .10000E+01 volume .30374E-02 ppm1 8.919 ppm2 2.162 CV 1
ASSI { 849}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 79 and name HN ))
2.600 .800 .800 peak 849 spectrum 1 weight .10000E+01 volume .31395E-02 ppm1 8.069 ppm2 8.902 CV 1
ASSI { 851}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HN ))
2.500 .800 .800 peak 851 spectrum 1 weight .10000E+01 volume .39260E-02 ppm1 8.070 ppm2 7.330 CV 1
ASSI { 853}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HA ))
2.800 1.000 1.000 peak 853 spectrum 1 weight .10000E+01 volume .23617E-02 ppm1 8.070 ppm2 4.108 CV 1
ASSI { 854}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 75 and name HA ))
3.000 1.100 1.100 peak 854 spectrum 1 weight .10000E+01 volume .17772E-02 ppm1 8.068 ppm2 3.937 CV 1
ASSI { 855}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HA ))
3.400 1.400 1.400 peak 855 spectrum 1 weight .10000E+01 volume .10146E-02 ppm1 8.062 ppm2 4.440 CV 1
ASSI { 856}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HB2 ))
2.500 .800 .800 peak 856 spectrum 1 weight .10000E+01 volume .35132E-02 ppm1 8.071 ppm2 3.427 CV 1
ASSI { 858}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 77 and name HB2 ))
3.000 1.100 1.100 peak 858 spectrum 1 weight .10000E+01 volume .24269E-02 ppm1 8.069 ppm2 3.094 CV 1
ASSI { 860}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HB1 ))
3.000 1.100 1.100 peak 860 spectrum 1 weight .10000E+01 volume .34849E-02 ppm1 8.071 ppm2 2.807 CV 1
ASSI { 871}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HA ))
3.000 1.100 1.100 peak 871 spectrum 1 weight .10000E+01 volume .17142E-02 ppm1 7.363 ppm2 4.441 CV 1
ASSI { 874}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HA ))
3.300 1.400 1.400 peak 874 spectrum 1 weight .10000E+01 volume .11015E-02 ppm1 7.350 ppm2 3.936 CV 1
ASSI { 875}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HB2 ))
2.700 .900 .900 peak 875 spectrum 1 weight .10000E+01 volume .18055E-02 ppm1 7.350 ppm2 3.089 CV 1
ASSI { 876}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HB1 ))
3.400 1.400 1.400 peak 876 spectrum 1 weight .10000E+01 volume .15339E-02 ppm1 7.356 ppm2 2.773 CV 1
ASSI { 878}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HB2 ))
3.800 1.800 1.800 peak 878 spectrum 1 weight .10000E+01 volume .74304E-03 ppm1 7.355 ppm2 2.169 CV 1
ASSI { 880}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HB1 ))
2.900 1.000 1.000 peak 880 spectrum 1 weight .10000E+01 volume .12840E-02 ppm1 7.356 ppm2 2.028 CV 1
ASSI { 884}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 77 and name HN ))
3.100 1.200 1.200 peak 884 spectrum 1 weight .10000E+01 volume .98206E-03 ppm1 8.810 ppm2 7.328 CV 1
ASSI { 889}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 76 and name HB1 ))
3.200 1.300 1.300 peak 889 spectrum 1 weight .10000E+01 volume .16882E-02 ppm1 8.805 ppm2 2.028 CV 1
ASSI { 892}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HB2 ))
3.600 1.700 1.700 peak 892 spectrum 1 weight .10000E+01 volume .75828E-03 ppm1 8.813 ppm2 1.874 CV 1
ASSI { 894}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HB1 ))
3.500 1.500 1.500 peak 894 spectrum 1 weight .10000E+01 volume .61922E-03 ppm1 8.813 ppm2 1.558 CV 1
ASSI { 898}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 73 and name HA ))
2.700 .900 .900 peak 898 spectrum 1 weight .10000E+01 volume .28157E-02 ppm1 9.290 ppm2 4.490 CV 1
ASSI { 900}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HB1 ))
3.400 1.400 1.400 peak 900 spectrum 1 weight .10000E+01 volume .88644E-03 ppm1 9.289 ppm2 3.321 CV 1
OR { 900}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HB2 ))
ASSI { 901}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 77 and name HB2 ))
3.300 1.300 1.300 peak 901 spectrum 1 weight .10000E+01 volume .89295E-03 ppm1 9.291 ppm2 3.097 CV 1
ASSI { 911}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 72 and name HN ))
2.700 .900 .900 peak 911 spectrum 1 weight .10000E+01 volume .24181E-02 ppm1 7.191 ppm2 7.335 CV 1
ASSI { 912}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HA ))
3.100 1.200 1.200 peak 912 spectrum 1 weight .10000E+01 volume .11406E-02 ppm1 7.190 ppm2 4.492 CV 1
ASSI { 918}
(( segid " " and resid 73 and name HN ))
(( segid " " and resid 73 and name HG ))
2.700 .900 .900 peak 918 spectrum 1 weight .10000E+01 volume .24920E-02 ppm1 7.196 ppm2 2.034 CV 1
ASSI { 930}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HB1 ))
3.200 1.300 1.300 peak 930 spectrum 1 weight .10000E+01 volume .15295E-02 ppm1 7.340 ppm2 1.937 CV 1
ASSI { 937}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HA ))
3.400 1.400 1.400 peak 937 spectrum 1 weight .10000E+01 volume .88427E-03 ppm1 7.477 ppm2 4.347 CV 1
ASSI { 939}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 71 and name HD2 ))
2.600 .800 .800 peak 939 spectrum 1 weight .10000E+01 volume .23182E-02 ppm1 7.481 ppm2 3.560 CV 1
ASSI { 944}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HB1 ))
3.300 1.300 1.300 peak 944 spectrum 1 weight .10000E+01 volume .11537E-02 ppm1 7.482 ppm2 1.101 CV 1
ASSI { 951}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HN ))
2.800 1.000 1.000 peak 951 spectrum 1 weight .10000E+01 volume .14296E-02 ppm1 7.553 ppm2 8.287 CV 1
ASSI { 955}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HB2 ))
3.700 1.800 1.800 peak 955 spectrum 1 weight .10000E+01 volume .66483E-03 ppm1 7.559 ppm2 2.715 CV 1
ASSI { 956}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 68 and name HB1 ))
3.900 1.900 1.900 peak 956 spectrum 1 weight .10000E+01 volume .44322E-03 ppm1 7.560 ppm2 2.543 CV 1
ASSI { 957}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HB2 ))
2.600 .800 .800 peak 957 spectrum 1 weight .10000E+01 volume .28766E-02 ppm1 7.552 ppm2 1.881 CV 1
ASSI { 963}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HN ))
2.800 1.000 1.000 peak 963 spectrum 1 weight .10000E+01 volume .16990E-02 ppm1 8.297 ppm2 8.120 CV 1
ASSI { 967}
(( segid " " and resid 69 and name HN ))
( segid " " and resid 69 and name HD2%)
3.700 1.700 1.700 peak 967 spectrum 1 weight .10000E+01 volume .13188E-02 ppm1 7.548 ppm2 1.091 CV 1
ASSI { 972}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HA ))
2.800 1.000 1.000 peak 972 spectrum 1 weight .10000E+01 volume .23552E-02 ppm1 8.296 ppm2 4.370 CV 1
ASSI { 974}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HA1 ))
3.200 1.200 1.200 peak 974 spectrum 1 weight .10000E+01 volume .91253E-03 ppm1 8.296 ppm2 3.561 CV 1
ASSI { 986}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HA ))
2.500 .800 .800 peak 986 spectrum 1 weight .10000E+01 volume .33654E-02 ppm1 8.109 ppm2 4.257 CV 1
ASSI { 988}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HA1 ))
2.600 .800 .800 peak 988 spectrum 1 weight .10000E+01 volume .24616E-02 ppm1 8.108 ppm2 3.562 CV 1
ASSI { 989}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 35 and name HB1 ))
3.100 1.200 1.200 peak 989 spectrum 1 weight .10000E+01 volume .14144E-02 ppm1 8.109 ppm2 3.379 CV 1
OR { 989}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 35 and name HB2 ))
ASSI { 990}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HB ))
3.100 1.200 1.200 peak 990 spectrum 1 weight .10000E+01 volume .36023E-02 ppm1 8.108 ppm2 2.672 CV 1
ASSI { 991}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 40 and name HG2%)
3.000 1.100 1.100 peak 991 spectrum 1 weight .10000E+01 volume .14513E-02 ppm1 8.109 ppm2 1.339 CV 1
ASSI { 998}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HA ))
2.600 .800 .800 peak 998 spectrum 1 weight .10000E+01 volume .37978E-02 ppm1 7.754 ppm2 4.259 CV 1
ASSI { 1000}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HA ))
2.700 .900 .900 peak 1000 spectrum 1 weight .10000E+01 volume .30917E-02 ppm1 7.755 ppm2 3.977 CV 1
ASSI { 1004}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HB ))
2.500 .800 .800 peak 1004 spectrum 1 weight .10000E+01 volume .39521E-02 ppm1 7.758 ppm2 2.212 CV 1
ASSI { 1005}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HG12))
3.000 1.100 1.100 peak 1005 spectrum 1 weight .10000E+01 volume .29852E-02 ppm1 7.754 ppm2 1.593 CV 1
ASSI { 1010}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HN ))
3.000 1.100 1.100 peak 1010 spectrum 1 weight .10000E+01 volume .28266E-02 ppm1 7.946 ppm2 7.746 CV 1
ASSI { 1012}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HN ))
3.300 1.300 1.300 peak 1012 spectrum 1 weight .10000E+01 volume .30526E-02 ppm1 7.947 ppm2 7.556 CV 1
ASSI { 1013}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HA ))
2.300 .700 .700 peak 1013 spectrum 1 weight .10000E+01 volume .76045E-02 ppm1 7.949 ppm2 4.260 CV 1
ASSI { 1014}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HA ))
3.000 1.100 1.100 peak 1014 spectrum 1 weight .10000E+01 volume .12428E-02 ppm1 7.948 ppm2 4.720 CV 1
ASSI { 1016}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HB2 ))
3.000 1.200 1.200 peak 1016 spectrum 1 weight .10000E+01 volume .11623E-02 ppm1 7.946 ppm2 3.056 CV 1
ASSI { 1020}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HB1 ))
3.400 1.400 1.400 peak 1020 spectrum 1 weight .10000E+01 volume .16317E-02 ppm1 7.945 ppm2 2.485 CV 1
ASSI { 1027}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HA ))
3.000 1.100 1.100 peak 1027 spectrum 1 weight .10000E+01 volume .16382E-02 ppm1 7.571 ppm2 4.722 CV 1
ASSI { 1031}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB1 ))
3.400 1.400 1.400 peak 1031 spectrum 1 weight .10000E+01 volume .24855E-02 ppm1 7.573 ppm2 2.533 CV 1
ASSI { 1039}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HN ))
3.000 1.100 1.100 peak 1039 spectrum 1 weight .10000E+01 volume .13188E-02 ppm1 8.623 ppm2 7.555 CV 1
ASSI { 1043}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB2 ))
2.600 .800 .800 peak 1043 spectrum 1 weight .10000E+01 volume .22379E-02 ppm1 8.623 ppm2 2.162 CV 1
ASSI { 1050}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HB2 ))
2.300 .700 .700 peak 1050 spectrum 1 weight .10000E+01 volume .33850E-02 ppm1 8.628 ppm2 2.033 CV 1
ASSI { 1051}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HB1 ))
3.800 1.800 1.800 peak 1051 spectrum 1 weight .10000E+01 volume .11254E-02 ppm1 8.611 ppm2 1.372 CV 1
ASSI { 1057}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 59 and name HB2 ))
2.500 .800 .800 peak 1057 spectrum 1 weight .10000E+01 volume .23226E-02 ppm1 8.574 ppm2 2.321 CV 1
ASSI { 1058}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 58 and name HB1 ))
2.600 .900 .900 peak 1058 spectrum 1 weight .10000E+01 volume .29809E-02 ppm1 8.588 ppm2 2.168 CV 1
OR { 1058}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 58 and name HB2 ))
ASSI { 1062}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HN ))
2.800 1.000 1.000 peak 1062 spectrum 1 weight .10000E+01 volume .19923E-02 ppm1 7.584 ppm2 7.101 CV 1
ASSI { 1065}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HB2 ))
3.100 1.200 1.200 peak 1065 spectrum 1 weight .10000E+01 volume .12015E-02 ppm1 7.579 ppm2 3.230 CV 1
ASSI { 1066}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HB2 ))
2.400 .700 .700 peak 1066 spectrum 1 weight .10000E+01 volume .41650E-02 ppm1 7.582 ppm2 2.168 CV 1
OR { 1066}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HB1 ))
ASSI { 1068}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HA ))
3.600 1.600 1.600 peak 1068 spectrum 1 weight .10000E+01 volume .56488E-03 ppm1 7.587 ppm2 3.798 CV 1
ASSI { 1071}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HB1 ))
3.500 1.500 1.500 peak 1071 spectrum 1 weight .10000E+01 volume .98206E-03 ppm1 7.570 ppm2 3.002 CV 1
ASSI { 1079}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HB2 ))
3.500 1.500 1.500 peak 1079 spectrum 1 weight .10000E+01 volume .13862E-02 ppm1 7.130 ppm2 3.223 CV 1
ASSI { 1081}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 54 and name HB1 ))
3.500 1.600 1.600 peak 1081 spectrum 1 weight .10000E+01 volume .77347E-03 ppm1 7.129 ppm2 2.724 CV 1
ASSI { 1088}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 57 and name HN ))
3.000 1.100 1.100 peak 1088 spectrum 1 weight .10000E+01 volume .14817E-02 ppm1 8.956 ppm2 7.101 CV 1
ASSI { 1094}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HA ))
3.600 1.600 1.600 peak 1094 spectrum 1 weight .10000E+01 volume .54535E-03 ppm1 8.967 ppm2 4.215 CV 1
ASSI { 1096}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HB2 ))
2.800 1.000 1.000 peak 1096 spectrum 1 weight .10000E+01 volume .26811E-02 ppm1 8.952 ppm2 1.710 CV 1
ASSI { 1098}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HB1 ))
2.800 1.000 1.000 peak 1098 spectrum 1 weight .10000E+01 volume .15882E-02 ppm1 8.955 ppm2 1.326 CV 1
ASSI { 1100}
(( segid " " and resid 56 and name HN ))
( segid " " and resid 56 and name HD1%)
4.100 2.100 1.900 peak 1100 spectrum 1 weight .10000E+01 volume .72785E-03 ppm1 8.956 ppm2 .257 CV 1
ASSI { 1104}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HN ))
2.600 .900 .900 peak 1104 spectrum 1 weight .10000E+01 volume .17294E-02 ppm1 7.786 ppm2 7.000 CV 1
ASSI { 1105}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HA ))
2.800 1.000 1.000 peak 1105 spectrum 1 weight .10000E+01 volume .19554E-02 ppm1 7.784 ppm2 4.636 CV 1
ASSI { 1108}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HB2 ))
2.300 .700 .700 peak 1108 spectrum 1 weight .10000E+01 volume .33242E-02 ppm1 7.784 ppm2 3.098 CV 1
ASSI { 1110}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HB1 ))
2.900 1.100 1.100 peak 1110 spectrum 1 weight .10000E+01 volume .31764E-02 ppm1 7.784 ppm2 2.727 CV 1
ASSI { 1127}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 53 and name HN ))
3.200 1.300 1.300 peak 1127 spectrum 1 weight .10000E+01 volume .13188E-02 ppm1 9.140 ppm2 7.002 CV 1
ASSI { 1128}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HA ))
2.500 .800 .800 peak 1128 spectrum 1 weight .10000E+01 volume .48515E-02 ppm1 9.147 ppm2 4.483 CV 1
ASSI { 1131}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HB1 ))
2.600 .800 .800 peak 1131 spectrum 1 weight .10000E+01 volume .32155E-02 ppm1 9.147 ppm2 2.066 CV 1
OR { 1131}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HB2 ))
ASSI { 1141}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HA ))
2.600 .800 .800 peak 1141 spectrum 1 weight .10000E+01 volume .43649E-02 ppm1 8.445 ppm2 4.599 CV 1
ASSI { 1142}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HA ))
2.900 1.100 1.100 peak 1142 spectrum 1 weight .10000E+01 volume .12623E-02 ppm1 8.439 ppm2 4.477 CV 1
ASSI { 1144}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 54 and name HB2 ))
3.400 1.500 1.500 peak 1144 spectrum 1 weight .10000E+01 volume .10581E-02 ppm1 8.443 ppm2 3.103 CV 1
ASSI { 1149}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 50 and name HG1%)
3.500 1.500 1.500 peak 1149 spectrum 1 weight .10000E+01 volume .15404E-02 ppm1 8.444 ppm2 .532 CV 1
ASSI { 1152}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HN ))
2.900 1.100 1.100 peak 1152 spectrum 1 weight .10000E+01 volume .17251E-02 ppm1 7.236 ppm2 8.313 CV 1
ASSI { 1154}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HN ))
3.100 1.200 1.200 peak 1154 spectrum 1 weight .10000E+01 volume .12710E-02 ppm1 7.229 ppm2 6.716 CV 1
ASSI { 1163}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HG1 ))
3.700 1.700 1.700 peak 1163 spectrum 1 weight .10000E+01 volume .13318E-02 ppm1 7.225 ppm2 1.933 CV 1
ASSI { 1169}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 47 and name HB ))
3.600 1.600 1.600 peak 1169 spectrum 1 weight .10000E+01 volume .79738E-03 ppm1 8.348 ppm2 3.284 CV 1
ASSI { 1176}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HN ))
2.800 1.000 1.000 peak 1176 spectrum 1 weight .10000E+01 volume .19467E-02 ppm1 8.063 ppm2 8.315 CV 1
ASSI { 1178}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HN ))
2.900 1.000 1.000 peak 1178 spectrum 1 weight .10000E+01 volume .17511E-02 ppm1 8.064 ppm2 7.568 CV 1
ASSI { 1181}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HA ))
3.000 1.100 1.100 peak 1181 spectrum 1 weight .10000E+01 volume .17772E-02 ppm1 8.066 ppm2 4.071 CV 1
ASSI { 1183}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 47 and name HB ))
3.100 1.200 1.200 peak 1183 spectrum 1 weight .10000E+01 volume .16686E-02 ppm1 8.068 ppm2 3.282 CV 1
ASSI { 1185}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HB1 ))
4.200 2.200 1.800 peak 1185 spectrum 1 weight .10000E+01 volume .75606E-03 ppm1 8.064 ppm2 1.553 CV 1
OR { 1185}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HB2 ))
ASSI { 1187}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HN ))
2.900 1.100 1.100 peak 1187 spectrum 1 weight .10000E+01 volume .14709E-02 ppm1 7.593 ppm2 8.573 CV 1
ASSI { 1192}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HA ))
3.400 1.400 1.400 peak 1192 spectrum 1 weight .10000E+01 volume .85168E-03 ppm1 7.596 ppm2 3.635 CV 1
ASSI { 1194}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HB2 ))
2.600 .800 .800 peak 1194 spectrum 1 weight .10000E+01 volume .35132E-02 ppm1 7.595 ppm2 3.926 CV 1
OR { 1194}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HB1 ))
ASSI { 1197}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HB ))
2.700 .900 .900 peak 1197 spectrum 1 weight .10000E+01 volume .20053E-02 ppm1 7.599 ppm2 1.807 CV 1
ASSI { 1210}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB1 ))
3.000 1.100 1.100 peak 1210 spectrum 1 weight .10000E+01 volume .14470E-02 ppm1 8.586 ppm2 2.631 CV 1
ASSI { 1213}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HB ))
2.300 .700 .700 peak 1213 spectrum 1 weight .10000E+01 volume .50057E-02 ppm1 8.587 ppm2 1.827 CV 1
ASSI { 1214}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HG12))
3.300 1.300 1.300 peak 1214 spectrum 1 weight .10000E+01 volume .35328E-02 ppm1 8.585 ppm2 1.650 CV 1
ASSI { 1218}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 45 and name HN ))
2.800 1.000 1.000 peak 1218 spectrum 1 weight .10000E+01 volume .21010E-02 ppm1 9.022 ppm2 8.555 CV 1
ASSI { 1219}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
2.600 .900 .900 peak 1219 spectrum 1 weight .10000E+01 volume .27701E-02 ppm1 9.023 ppm2 8.111 CV 1
ASSI { 1224}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HB2 ))
3.300 1.300 1.300 peak 1224 spectrum 1 weight .10000E+01 volume .34611E-02 ppm1 9.022 ppm2 3.568 CV 1
ASSI { 1226}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HA ))
2.700 .900 .900 peak 1226 spectrum 1 weight .10000E+01 volume .27636E-02 ppm1 9.021 ppm2 3.418 CV 1
ASSI { 1227}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB2 ))
2.400 .700 .700 peak 1227 spectrum 1 weight .10000E+01 volume .42389E-02 ppm1 9.022 ppm2 3.092 CV 1
ASSI { 1229}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB1 ))
3.100 1.200 1.200 peak 1229 spectrum 1 weight .10000E+01 volume .31134E-02 ppm1 9.021 ppm2 2.628 CV 1
ASSI { 1239}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB2 ))
2.500 .800 .800 peak 1239 spectrum 1 weight .10000E+01 volume .40520E-02 ppm1 8.132 ppm2 3.552 CV 1
ASSI { 1244}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HN ))
2.600 .900 .900 peak 1244 spectrum 1 weight .10000E+01 volume .28809E-02 ppm1 8.319 ppm2 8.527 CV 1
ASSI { 1245}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HN ))
2.500 .800 .800 peak 1245 spectrum 1 weight .10000E+01 volume .37848E-02 ppm1 8.318 ppm2 8.121 CV 1
ASSI { 1248}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HA ))
2.500 .800 .800 peak 1248 spectrum 1 weight .10000E+01 volume .42236E-02 ppm1 8.320 ppm2 3.793 CV 1
ASSI { 1249}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HA ))
3.100 1.200 1.200 peak 1249 spectrum 1 weight .10000E+01 volume .14731E-02 ppm1 8.318 ppm2 3.607 CV 1
ASSI { 1250}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HB ))
2.400 .700 .700 peak 1250 spectrum 1 weight .10000E+01 volume .45778E-02 ppm1 8.318 ppm2 2.067 CV 1
ASSI { 1255}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HG12))
4.100 2.200 1.900 peak 1255 spectrum 1 weight .10000E+01 volume .10929E-02 ppm1 8.316 ppm2 1.831 CV 1
ASSI { 1259}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 41 and name HG2%)
3.100 1.200 1.200 peak 1259 spectrum 1 weight .10000E+01 volume .22943E-02 ppm1 8.317 ppm2 1.068 CV 1
ASSI { 1266}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HN ))
2.600 .800 .800 peak 1266 spectrum 1 weight .10000E+01 volume .28766E-02 ppm1 8.529 ppm2 8.256 CV 1
ASSI { 1272}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HA ))
2.700 .900 .900 peak 1272 spectrum 1 weight .10000E+01 volume .24681E-02 ppm1 8.528 ppm2 3.607 CV 1
ASSI { 1273}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB ))
2.600 .800 .800 peak 1273 spectrum 1 weight .10000E+01 volume .26094E-02 ppm1 8.530 ppm2 2.728 CV 1
ASSI { 1276}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB ))
2.200 .600 .600 peak 1276 spectrum 1 weight .10000E+01 volume .58292E-02 ppm1 8.530 ppm2 2.064 CV 1
ASSI { 1277}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HG12))
3.300 1.300 1.300 peak 1277 spectrum 1 weight .10000E+01 volume .36110E-02 ppm1 8.530 ppm2 1.838 CV 1
ASSI { 1279}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 40 and name HG2%)
3.500 1.600 1.600 peak 1279 spectrum 1 weight .10000E+01 volume .17946E-02 ppm1 8.530 ppm2 1.327 CV 1
ASSI { 1285}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 43 and name HN ))
3.200 3.200 2.800 peak 1285 spectrum 1 weight .10000E+01 volume .14513E-02 ppm1 8.259 ppm2 8.111 CV 1
ASSI { 1287}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HN ))
2.600 .800 .800 peak 1287 spectrum 1 weight .10000E+01 volume .31808E-02 ppm1 8.255 ppm2 7.555 CV 1
ASSI { 1288}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 82 and name HN ))
2.800 1.000 1.000 peak 1288 spectrum 1 weight .10000E+01 volume .19163E-02 ppm1 8.281 ppm2 7.275 CV 1
ASSI { 1291}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HA ))
3.000 1.100 1.100 peak 1291 spectrum 1 weight .10000E+01 volume .15556E-02 ppm1 8.278 ppm2 3.997 CV 1
ASSI { 1305}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 40 and name HG1%)
3.300 1.400 1.400 peak 1305 spectrum 1 weight .10000E+01 volume .34980E-02 ppm1 8.255 ppm2 1.245 CV 1
ASSI { 1308}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HN ))
2.600 .800 .800 peak 1308 spectrum 1 weight .10000E+01 volume .32438E-02 ppm1 7.574 ppm2 7.739 CV 1
ASSI { 1312}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 36 and name HN ))
3.700 1.700 1.700 peak 1312 spectrum 1 weight .10000E+01 volume .87993E-03 ppm1 7.573 ppm2 9.625 CV 1
ASSI { 1313}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HA ))
3.400 1.500 1.500 peak 1313 spectrum 1 weight .10000E+01 volume .87342E-03 ppm1 7.573 ppm2 4.343 CV 1
ASSI { 1317}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB2 ))
2.500 .800 .800 peak 1317 spectrum 1 weight .10000E+01 volume .27049E-02 ppm1 7.573 ppm2 2.963 CV 1
ASSI { 1320}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HB1 ))
3.000 1.100 1.100 peak 1320 spectrum 1 weight .10000E+01 volume .18359E-02 ppm1 7.574 ppm2 2.443 CV 1
ASSI { 1322}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB1 ))
3.600 1.600 1.600 peak 1322 spectrum 1 weight .10000E+01 volume .18641E-02 ppm1 7.574 ppm2 1.848 CV 1
ASSI { 1324}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HN ))
2.900 1.000 1.000 peak 1324 spectrum 1 weight .10000E+01 volume .18402E-02 ppm1 7.757 ppm2 9.037 CV 1
ASSI { 1328}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HA ))
2.900 1.100 1.100 peak 1328 spectrum 1 weight .10000E+01 volume .17555E-02 ppm1 7.764 ppm2 4.340 CV 1
ASSI { 1329}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB1 ))
3.200 1.300 1.300 peak 1329 spectrum 1 weight .10000E+01 volume .33002E-02 ppm1 7.759 ppm2 2.438 CV 1
ASSI { 1341}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HA ))
2.500 .800 .800 peak 1341 spectrum 1 weight .10000E+01 volume .45843E-02 ppm1 9.057 ppm2 4.809 CV 1
ASSI { 1342}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HB2 ))
2.700 .900 .900 peak 1342 spectrum 1 weight .10000E+01 volume .39195E-02 ppm1 9.052 ppm2 4.500 CV 1
ASSI { 1346}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB ))
2.400 .700 .700 peak 1346 spectrum 1 weight .10000E+01 volume .41954E-02 ppm1 9.055 ppm2 2.027 CV 1
ASSI { 1354}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HD1 ))
3.000 1.100 1.100 peak 1354 spectrum 1 weight .10000E+01 volume .18228E-02 ppm1 7.742 ppm2 6.903 CV 1
ASSI { 1355}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HA ))
2.800 1.000 1.000 peak 1355 spectrum 1 weight .10000E+01 volume .23704E-02 ppm1 7.746 ppm2 5.188 CV 1
ASSI { 1357}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HA ))
2.900 1.000 1.000 peak 1357 spectrum 1 weight .10000E+01 volume .20032E-02 ppm1 7.746 ppm2 4.406 CV 1
ASSI { 1358}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HB1 ))
2.300 .700 .700 peak 1358 spectrum 1 weight .10000E+01 volume .74955E-02 ppm1 7.745 ppm2 3.379 CV 1
OR { 1358}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HB2 ))
ASSI { 1362}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HB1 ))
3.500 1.600 1.600 peak 1362 spectrum 1 weight .10000E+01 volume .10385E-02 ppm1 7.747 ppm2 1.965 CV 1
ASSI { 1366}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HA ))
3.000 1.200 1.200 peak 1366 spectrum 1 weight .10000E+01 volume .16642E-02 ppm1 7.703 ppm2 4.406 CV 1
ASSI { 1367}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HN ))
3.000 1.100 1.100 peak 1367 spectrum 1 weight .10000E+01 volume .16034E-02 ppm1 7.700 ppm2 7.384 CV 1
ASSI { 1380}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HB2 ))
2.900 1.000 1.000 peak 1380 spectrum 1 weight .10000E+01 volume .19532E-02 ppm1 7.429 ppm2 2.035 CV 1
ASSI { 1384}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB1 ))
3.500 1.500 1.500 peak 1384 spectrum 1 weight .10000E+01 volume .77781E-03 ppm1 7.399 ppm2 3.486 CV 1
ASSI { 1388}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HG2 ))
4.000 2.000 2.000 peak 1388 spectrum 1 weight .10000E+01 volume .93423E-03 ppm1 7.434 ppm2 1.748 CV 1
ASSI { 1390}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HB1 ))
3.100 1.200 1.200 peak 1390 spectrum 1 weight .10000E+01 volume .99074E-03 ppm1 7.429 ppm2 1.380 CV 1
ASSI { 1399}
(( segid " " and resid 32 and name HN ))
( segid " " and resid 32 and name HD% )
3.100 1.200 1.200 peak 1399 spectrum 1 weight .10000E+01 volume .11515E-02 ppm1 7.051 ppm2 6.580 CV 1
ASSI { 1407}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 32 and name HB1 ))
3.400 1.400 1.400 peak 1407 spectrum 1 weight .10000E+01 volume .70611E-03 ppm1 7.041 ppm2 1.605 CV 1
ASSI { 1408}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HN ))
2.500 .800 .800 peak 1408 spectrum 1 weight .10000E+01 volume .32894E-02 ppm1 8.093 ppm2 8.441 CV 1
ASSI { 1414}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HB1 ))
3.100 1.200 1.200 peak 1414 spectrum 1 weight .10000E+01 volume .23638E-02 ppm1 8.095 ppm2 2.457 CV 1
ASSI { 1417}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HG1 ))
4.100 2.100 1.900 peak 1417 spectrum 1 weight .10000E+01 volume .82776E-03 ppm1 8.103 ppm2 2.290 CV 1
OR { 1417}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HG2 ))
ASSI { 1421}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HA ))
2.200 .600 .600 peak 1421 spectrum 1 weight .10000E+01 volume .72307E-02 ppm1 8.454 ppm2 4.683 CV 1
ASSI { 1423}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
2.900 1.100 1.100 peak 1423 spectrum 1 weight .10000E+01 volume .18381E-02 ppm1 8.457 ppm2 4.295 CV 1
ASSI { 1424}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB1 ))
3.300 1.400 1.400 peak 1424 spectrum 1 weight .10000E+01 volume .12340E-02 ppm1 8.451 ppm2 2.810 CV 1
OR { 1424}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HB2 ))
ASSI { 1425}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB2 ))
2.900 1.100 1.100 peak 1425 spectrum 1 weight .10000E+01 volume .12819E-02 ppm1 8.453 ppm2 2.071 CV 1
ASSI { 1427}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HG1 ))
3.300 1.400 1.400 peak 1427 spectrum 1 weight .10000E+01 volume .17468E-02 ppm1 8.457 ppm2 2.295 CV 1
OR { 1427}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HG2 ))
ASSI { 1428}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB1 ))
3.100 1.200 1.200 peak 1428 spectrum 1 weight .10000E+01 volume .26267E-02 ppm1 8.453 ppm2 1.923 CV 1
ASSI { 1434}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HA ))
2.900 1.100 1.100 peak 1434 spectrum 1 weight .10000E+01 volume .22639E-02 ppm1 8.562 ppm2 4.675 CV 1
ASSI { 1435}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
3.200 1.300 1.300 peak 1435 spectrum 1 weight .10000E+01 volume .11623E-02 ppm1 8.555 ppm2 4.400 CV 1
ASSI { 1451}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HN ))
3.200 1.200 1.200 peak 1451 spectrum 1 weight .10000E+01 volume .84083E-03 ppm1 8.623 ppm2 7.417 CV 1
ASSI { 1454}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HA ))
2.600 .800 .800 peak 1454 spectrum 1 weight .10000E+01 volume .33568E-02 ppm1 9.652 ppm2 5.188 CV 1
ASSI { 1455}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HB2 ))
3.300 1.300 1.300 peak 1455 spectrum 1 weight .10000E+01 volume .86470E-03 ppm1 9.649 ppm2 4.507 CV 1
ASSI { 1456}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HB2 ))
3.300 1.300 1.300 peak 1456 spectrum 1 weight .10000E+01 volume .97116E-03 ppm1 9.652 ppm2 3.384 CV 1
OR { 1456}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HB1 ))
ASSI { 1457}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HA ))
3.100 1.200 1.200 peak 1457 spectrum 1 weight .10000E+01 volume .11124E-02 ppm1 9.651 ppm2 4.809 CV 1
ASSI { 1458}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HB1 ))
3.300 1.300 1.300 peak 1458 spectrum 1 weight .10000E+01 volume .11081E-02 ppm1 9.647 ppm2 4.184 CV 1
ASSI { 1459}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 39 and name HB2 ))
2.800 1.000 1.000 peak 1459 spectrum 1 weight .10000E+01 volume .13145E-02 ppm1 9.649 ppm2 2.957 CV 1
ASSI { 1460}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 35 and name HZ2 ))
2.600 .800 .800 peak 1460 spectrum 1 weight .10000E+01 volume .50841E-02 ppm1 9.797 ppm2 7.316 CV 1
ASSI { 1461}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 35 and name HD1 ))
2.200 .600 .600 peak 1461 spectrum 1 weight .10000E+01 volume .10753E-01 ppm1 9.797 ppm2 6.902 CV 1
ASSI { 1462}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 35 and name HA ))
4.200 2.200 1.800 peak 1462 spectrum 1 weight .10000E+01 volume .91904E-03 ppm1 9.804 ppm2 5.189 CV 1
ASSI { 1469}
(( segid " " and resid 106 and name HE1 ))
(( segid " " and resid 106 and name HD1 ))
2.400 .700 .700 peak 1469 spectrum 1 weight .10000E+01 volume .79344E-02 ppm1 10.083 ppm2 7.187 CV 1
ASSI { 1470}
(( segid " " and resid 106 and name HE1 ))
(( segid " " and resid 106 and name HZ2 ))
2.900 1.100 1.100 peak 1470 spectrum 1 weight .10000E+01 volume .23660E-02 ppm1 10.084 ppm2 7.465 CV 1
ASSI { 1731}
(( segid " " and resid 34 and name HE21))
(( segid " " and resid 34 and name HG2 ))
3.300 1.300 1.300 peak 1731 spectrum 1 weight .10000E+01 volume .85602E-03 ppm1 6.737 ppm2 2.218 CV 1
OR { 1731}
(( segid " " and resid 34 and name HE21))
(( segid " " and resid 34 and name HG1 ))
ASSI { 2515}
(( segid " " and resid 32 and name HN ))
(( segid " " and resid 32 and name HB2 ))
3.800 1.800 1.800 peak 2515 spectrum 1 weight .10000E+01 volume .50407E-03 ppm1 7.058 ppm2 1.747 CV 1
ASSI { 2594}
(( segid " " and resid 87 and name HD22))
(( segid " " and resid 87 and name HB2 ))
3.600 1.700 1.700 peak 2594 spectrum 1 weight .10000E+01 volume .16056E-02 ppm1 7.827 ppm2 2.951 CV 1
ASSI { 2595}
(( segid " " and resid 87 and name HD22))
(( segid " " and resid 87 and name HB1 ))
4.100 2.100 1.900 peak 2595 spectrum 1 weight .10000E+01 volume .78866E-03 ppm1 7.824 ppm2 2.772 CV 1
ASSI { 2596}
(( segid " " and resid 87 and name HD21))
(( segid " " and resid 87 and name HB2 ))
3.000 1.100 1.100 peak 2596 spectrum 1 weight .10000E+01 volume .12884E-02 ppm1 6.959 ppm2 2.955 CV 1
ASSI { 2597}
(( segid " " and resid 87 and name HD21))
(( segid " " and resid 87 and name HB1 ))
3.400 1.500 1.500 peak 2597 spectrum 1 weight .10000E+01 volume .61488E-03 ppm1 6.961 ppm2 2.771 CV 1
ASSI { 2600}
(( segid " " and resid 63 and name HD22))
(( segid " " and resid 63 and name HB1 ))
3.700 1.700 1.700 peak 2600 spectrum 1 weight .10000E+01 volume .14361E-02 ppm1 7.650 ppm2 2.536 CV 1
ASSI { 2601}
(( segid " " and resid 63 and name HD22))
(( segid " " and resid 63 and name HB2 ))
3.900 1.900 1.900 peak 2601 spectrum 1 weight .10000E+01 volume .10342E-02 ppm1 7.645 ppm2 2.912 CV 1
ASSI { 2604}
(( segid " " and resid 76 and name HE22))
(( segid " " and resid 76 and name HG1 ))
3.200 1.300 1.300 peak 2604 spectrum 1 weight .10000E+01 volume .32568E-02 ppm1 7.683 ppm2 2.358 CV 1
ASSI { 2608}
(( segid " " and resid 76 and name HE21))
(( segid " " and resid 76 and name HG1 ))
2.800 1.000 1.000 peak 2608 spectrum 1 weight .10000E+01 volume .21727E-02 ppm1 6.705 ppm2 2.352 CV 1
ASSI { 2622}
(( segid " " and resid 28 and name HD22))
(( segid " " and resid 28 and name HB1 ))
3.700 1.700 1.700 peak 2622 spectrum 1 weight .10000E+01 volume .15426E-02 ppm1 7.488 ppm2 2.770 CV 1
OR { 2622}
(( segid " " and resid 28 and name HD22))
(( segid " " and resid 28 and name HB2 ))
ASSI { 2624}
(( segid " " and resid 28 and name HD21))
(( segid " " and resid 28 and name HB1 ))
3.100 1.200 1.200 peak 2624 spectrum 1 weight .10000E+01 volume .11537E-02 ppm1 6.882 ppm2 2.794 CV 1
OR { 2624}
(( segid " " and resid 28 and name HD21))
(( segid " " and resid 28 and name HB2 ))
ASSI { 2666}
(( segid " " and resid 29 and name HD21))
(( segid " " and resid 29 and name HB1 ))
3.000 1.100 1.100 peak 2666 spectrum 1 weight .10000E+01 volume .14513E-02 ppm1 6.863 ppm2 2.814 CV 1
OR { 2666}
(( segid " " and resid 29 and name HD21))
(( segid " " and resid 29 and name HB2 ))
ASSI { 2667}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 29 and name HB1 ))
3.500 1.600 1.600 peak 2667 spectrum 1 weight .10000E+01 volume .19554E-02 ppm1 7.578 ppm2 2.815 CV 1
OR { 2667}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 29 and name HB2 ))
ASSI { 4181}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HA ))
2.700 .900 .900 peak 4181 spectrum 1 weight .10000E+01 volume .29852E-02 ppm1 8.094 ppm2 4.375 CV 1
ASSI { 432}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 106 and name HB2 ))
2.900 1.000 1.000 peak 432 spectrum 1 weight .10000E+01 volume .12536E-02 ppm1 7.903 ppm2 3.238 CV 1
OR { 432}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 106 and name HB1 ))
ASSI { 435}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 107 and name HB1 ))
3.500 1.600 1.600 peak 435 spectrum 1 weight .10000E+01 volume .11646E-02 ppm1 7.905 ppm2 1.606 CV 1
OR { 435}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 107 and name HD2 ))
ASSI { 437}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 107 and name HN ))
2.500 .800 .800 peak 437 spectrum 1 weight .10000E+01 volume .40650E-02 ppm1 8.053 ppm2 7.906 CV 1
ASSI { 440}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 105 and name HB1 ))
2.600 .800 .800 peak 440 spectrum 1 weight .10000E+01 volume .52533E-02 ppm1 8.089 ppm2 1.888 CV 1
ASSI { 450}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 108 and name HN ))
3.000 1.100 1.100 peak 450 spectrum 1 weight .10000E+01 volume .20727E-02 ppm1 8.059 ppm2 7.792 CV 1
ASSI { 456}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 106 and name HB2 ))
2.800 1.000 1.000 peak 456 spectrum 1 weight .10000E+01 volume .44822E-02 ppm1 8.052 ppm2 3.239 CV 1
OR { 456}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 106 and name HB1 ))
ASSI { 460}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 105 and name HB2 ))
4.100 2.100 1.900 peak 460 spectrum 1 weight .10000E+01 volume .77781E-03 ppm1 8.052 ppm2 1.937 CV 1
OR { 460}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 105 and name HB1 ))
ASSI { 469}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 102 and name HA ))
4.100 2.100 1.900 peak 469 spectrum 1 weight .10000E+01 volume .41498E-03 ppm1 7.874 ppm2 4.395 CV 1
ASSI { 479}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 104 and name HB2 ))
2.300 .700 .700 peak 479 spectrum 1 weight .10000E+01 volume .60314E-02 ppm1 7.871 ppm2 1.640 CV 1
OR { 479}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 104 and name HG ))
ASSI { 518}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 101 and name HB1 ))
2.400 .700 .700 peak 518 spectrum 1 weight .10000E+01 volume .50057E-02 ppm1 8.159 ppm2 2.728 CV 1
OR { 518}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 101 and name HB2 ))
ASSI { 534}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 100 and name HD1 ))
4.300 2.300 1.700 peak 534 spectrum 1 weight .10000E+01 volume .70828E-03 ppm1 8.058 ppm2 3.053 CV 1
OR { 534}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 100 and name HD2 ))
ASSI { 582}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 96 and name HG12))
3.800 1.800 1.800 peak 582 spectrum 1 weight .10000E+01 volume .11711E-02 ppm1 8.375 ppm2 1.610 CV 1
ASSI { 592}
(( segid " " and resid 96 and name HN ))
(( segid " " and resid 98 and name HN ))
3.400 1.400 1.400 peak 592 spectrum 1 weight .10000E+01 volume .11276E-02 ppm1 8.295 ppm2 8.120 CV 1
ASSI { 612}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 91 and name HA ))
4.000 2.000 2.000 peak 612 spectrum 1 weight .10000E+01 volume .40629E-03 ppm1 7.833 ppm2 3.934 CV 1
ASSI { 623}
(( segid " " and resid 95 and name HN ))
( segid " " and resid 95 and name HD1%)
3.300 1.300 1.300 peak 623 spectrum 1 weight .10000E+01 volume .16838E-02 ppm1 7.828 ppm2 .813 CV 1
ASSI { 649}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HG1 ))
4.000 2.000 2.000 peak 649 spectrum 1 weight .10000E+01 volume .94074E-03 ppm1 8.711 ppm2 1.453 CV 1
OR { 649}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HG2 ))
ASSI { 663}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HG2 ))
3.600 1.600 1.600 peak 663 spectrum 1 weight .10000E+01 volume .94729E-03 ppm1 8.468 ppm2 1.655 CV 1
OR { 663}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HD1 ))
OR { 663}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 91 and name HD2 ))
ASSI { 667}
(( segid " " and resid 92 and name HN ))
( segid " " and resid 48 and name HD1%)
3.400 1.400 1.400 peak 667 spectrum 1 weight .10000E+01 volume .12797E-02 ppm1 8.469 ppm2 .674 CV 1
OR { 667}
(( segid " " and resid 92 and name HN ))
( segid " " and resid 48 and name HD2%)
ASSI { 679}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HG2 ))
3.200 1.300 1.300 peak 679 spectrum 1 weight .10000E+01 volume .28744E-02 ppm1 7.309 ppm2 1.646 CV 1
OR { 679}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HD1 ))
OR { 679}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HD2 ))
ASSI { 682}
(( segid " " and resid 91 and name HN ))
( segid " " and resid 90 and name HG2%)
3.300 1.400 1.400 peak 682 spectrum 1 weight .10000E+01 volume .20401E-02 ppm1 7.315 ppm2 .922 CV 1
OR { 682}
(( segid " " and resid 91 and name HN ))
( segid " " and resid 90 and name HD1%)
ASSI { 689}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 89 and name HN ))
2.600 .900 .900 peak 689 spectrum 1 weight .10000E+01 volume .24877E-02 ppm1 8.397 ppm2 8.074 CV 1
ASSI { 695}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 90 and name HB ))
2.300 .700 .700 peak 695 spectrum 1 weight .10000E+01 volume .87362E-02 ppm1 8.396 ppm2 1.886 CV 1
OR { 695}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 90 and name HG12))
ASSI { 699}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 90 and name HG11))
2.500 .800 .800 peak 699 spectrum 1 weight .10000E+01 volume .17034E-02 ppm1 8.396 ppm2 1.099 CV 1
ASSI { 703}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 91 and name HN ))
3.300 1.400 1.400 peak 703 spectrum 1 weight .10000E+01 volume .11841E-02 ppm1 8.095 ppm2 7.279 CV 1
ASSI { 707}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 92 and name HB2 ))
3.400 1.400 1.400 peak 707 spectrum 1 weight .10000E+01 volume .95380E-03 ppm1 8.095 ppm2 3.231 CV 1
ASSI { 708}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 92 and name HB1 ))
3.600 1.600 1.600 peak 708 spectrum 1 weight .10000E+01 volume .80606E-03 ppm1 8.094 ppm2 3.094 CV 1
ASSI { 717}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 58 and name HN ))
2.600 .800 .800 peak 717 spectrum 1 weight .10000E+01 volume .29396E-02 ppm1 8.585 ppm2 7.558 CV 1
ASSI { 719}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HA ))
3.200 1.300 1.300 peak 719 spectrum 1 weight .10000E+01 volume .10364E-02 ppm1 7.876 ppm2 4.394 CV 1
ASSI { 722}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 85 and name HB2 ))
4.400 2.400 1.600 peak 722 spectrum 1 weight .10000E+01 volume .74955E-03 ppm1 7.881 ppm2 3.094 CV 1
ASSI { 779}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 86 and name HD1%)
3.700 1.700 1.700 peak 779 spectrum 1 weight .10000E+01 volume .15969E-02 ppm1 8.361 ppm2 .867 CV 1
OR { 779}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 86 and name HD2%)
ASSI { 789}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 82 and name HB1 ))
3.200 1.300 1.300 peak 789 spectrum 1 weight .10000E+01 volume .55186E-03 ppm1 8.537 ppm2 2.949 CV 1
ASSI { 811}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 79 and name HA ))
3.600 1.600 1.600 peak 811 spectrum 1 weight .10000E+01 volume .56921E-03 ppm1 7.278 ppm2 3.560 CV 1
ASSI { 813}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HB2 ))
3.500 1.500 1.500 peak 813 spectrum 1 weight .10000E+01 volume .11841E-02 ppm1 7.291 ppm2 1.937 CV 1
OR { 813}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HG ))
ASSI { 816}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 81 and name HB1 ))
3.300 1.300 1.300 peak 816 spectrum 1 weight .10000E+01 volume .96465E-03 ppm1 7.279 ppm2 1.377 CV 1
ASSI { 845}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HB1 ))
2.900 1.000 1.000 peak 845 spectrum 1 weight .10000E+01 volume .50491E-02 ppm1 8.920 ppm2 1.894 CV 1
OR { 845}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 79 and name HG1 ))
ASSI { 890}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 75 and name HD2%)
4.300 2.300 1.700 peak 890 spectrum 1 weight .10000E+01 volume .49751E-03 ppm1 8.820 ppm2 .910 CV 1
OR { 890}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 75 and name HD1%)
ASSI { 907}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 73 and name HD1%)
4.000 2.000 2.000 peak 907 spectrum 1 weight .10000E+01 volume .77564E-03 ppm1 9.283 ppm2 .818 CV 1
OR { 907}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 73 and name HD2%)
ASSI { 922}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 73 and name HD2%)
3.600 1.600 1.600 peak 922 spectrum 1 weight .10000E+01 volume .14275E-02 ppm1 7.197 ppm2 .822 CV 1
OR { 922}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 73 and name HD1%)
ASSI { 928}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HB2 ))
3.200 1.300 1.300 peak 928 spectrum 1 weight .10000E+01 volume .98857E-03 ppm1 7.351 ppm2 2.303 CV 1
OR { 928}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HG2 ))
ASSI { 943}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HG ))
2.400 .700 .700 peak 943 spectrum 1 weight .10000E+01 volume .45017E-02 ppm1 7.484 ppm2 1.758 CV 1
OR { 943}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HB2 ))
ASSI { 947}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 70 and name HD1%)
3.300 1.400 1.400 peak 947 spectrum 1 weight .10000E+01 volume .20293E-02 ppm1 7.484 ppm2 .759 CV 1
OR { 947}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 70 and name HD2%)
ASSI { 952}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 70 and name HN ))
2.100 .500 .500 peak 952 spectrum 1 weight .10000E+01 volume .83688E-02 ppm1 7.556 ppm2 7.434 CV 1
ASSI { 961}
(( segid " " and resid 69 and name HN ))
( segid " " and resid 70 and name HD1%)
4.400 2.400 1.600 peak 961 spectrum 1 weight .10000E+01 volume .54969E-03 ppm1 7.547 ppm2 .731 CV 1
OR { 961}
(( segid " " and resid 69 and name HN ))
( segid " " and resid 70 and name HD2%)
ASSI { 970}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 70 and name HN ))
3.700 1.800 1.800 peak 970 spectrum 1 weight .10000E+01 volume .11102E-02 ppm1 8.291 ppm2 7.421 CV 1
ASSI { 979}
(( segid " " and resid 68 and name HN ))
( segid " " and resid 66 and name HG2%)
3.000 1.200 1.200 peak 979 spectrum 1 weight .10000E+01 volume .11320E-02 ppm1 8.291 ppm2 1.094 CV 1
ASSI { 997}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 63 and name HN ))
3.200 3.200 2.800 peak 997 spectrum 1 weight .10000E+01 volume .15165E-02 ppm1 7.751 ppm2 7.567 CV 1
ASSI { 1009}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 37 and name HG2%)
2.800 1.000 1.000 peak 1009 spectrum 1 weight .10000E+01 volume .23117E-02 ppm1 7.761 ppm2 1.056 CV 1
OR { 1009}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 37 and name HG1%)
ASSI { 1026}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HD21))
3.400 1.500 1.500 peak 1026 spectrum 1 weight .10000E+01 volume .11558E-02 ppm1 7.577 ppm2 7.370 CV 1
ASSI { 1042}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HG1 ))
3.900 1.900 1.900 peak 1042 spectrum 1 weight .10000E+01 volume .98640E-03 ppm1 8.621 ppm2 2.307 CV 1
ASSI { 1059}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 59 and name HB1 ))
3.100 1.200 1.200 peak 1059 spectrum 1 weight .10000E+01 volume .39998E-02 ppm1 8.586 ppm2 1.895 CV 1
OR { 1059}
(( segid " " and resid 59 and name HN ))
(( segid " " and resid 59 and name HG2 ))
ASSI { 1084}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HB2 ))
4.000 2.000 2.000 peak 1084 spectrum 1 weight .10000E+01 volume .68875E-03 ppm1 7.123 ppm2 1.739 CV 1
ASSI { 1097}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HB1 ))
3.600 1.700 1.700 peak 1097 spectrum 1 weight .10000E+01 volume .12536E-02 ppm1 8.959 ppm2 2.012 CV 1
OR { 1097}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 55 and name HG1 ))
ASSI { 1099}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HG ))
3.500 1.600 1.600 peak 1099 spectrum 1 weight .10000E+01 volume .14557E-02 ppm1 8.948 ppm2 1.239 CV 1
ASSI { 1132}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB2 ))
2.500 .800 .800 peak 1132 spectrum 1 weight .10000E+01 volume .25355E-02 ppm1 9.143 ppm2 2.226 CV 1
OR { 1132}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HG1 ))
ASSI { 1157}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HB1 ))
3.200 1.300 1.300 peak 1157 spectrum 1 weight .10000E+01 volume .14231E-02 ppm1 7.232 ppm2 2.027 CV 1
OR { 1157}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HG2 ))
ASSI { 1160}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HB2 ))
3.100 1.200 1.200 peak 1160 spectrum 1 weight .10000E+01 volume .12080E-02 ppm1 7.234 ppm2 1.557 CV 1
OR { 1160}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HB1 ))
ASSI { 1174}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 48 and name HD1%)
4.000 2.000 2.000 peak 1174 spectrum 1 weight .10000E+01 volume .73870E-03 ppm1 8.337 ppm2 .673 CV 1
OR { 1174}
(( segid " " and resid 48 and name HN ))
( segid " " and resid 48 and name HD2%)
ASSI { 1193}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 46 and name HA ))
2.900 1.000 1.000 peak 1193 spectrum 1 weight .10000E+01 volume .23704E-02 ppm1 7.597 ppm2 4.207 CV 1
ASSI { 1198}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HG11))
3.500 1.500 1.500 peak 1198 spectrum 1 weight .10000E+01 volume .10559E-02 ppm1 7.593 ppm2 .820 CV 1
ASSI { 1199}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HG12))
3.100 3.100 2.900 peak 1199 spectrum 1 weight .10000E+01 volume .66483E-03 ppm1 7.591 ppm2 1.658 CV 1
ASSI { 1206}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HA ))
2.800 1.000 1.000 peak 1206 spectrum 1 weight .10000E+01 volume .21553E-02 ppm1 8.586 ppm2 3.642 CV 1
ASSI { 1215}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HG11))
2.300 .700 .700 peak 1215 spectrum 1 weight .10000E+01 volume .45648E-02 ppm1 8.587 ppm2 .812 CV 1
OR { 1215}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 45 and name HD1%)
ASSI { 1216}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 45 and name HG2%)
3.300 1.400 1.400 peak 1216 spectrum 1 weight .10000E+01 volume .29787E-02 ppm1 8.586 ppm2 .912 CV 1
ASSI { 1220}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HE3 ))
2.900 1.000 1.000 peak 1220 spectrum 1 weight .10000E+01 volume .22748E-02 ppm1 9.022 ppm2 7.936 CV 1
ASSI { 1247}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 38 and name HA ))
4.000 2.000 2.000 peak 1247 spectrum 1 weight .10000E+01 volume .41498E-03 ppm1 8.318 ppm2 4.339 CV 1
ASSI { 1252}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 45 and name HA ))
3.600 1.600 1.600 peak 1252 spectrum 1 weight .10000E+01 volume .54752E-03 ppm1 7.242 ppm2 3.654 CV 1
ASSI { 1294}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HB2 ))
2.800 1.000 1.000 peak 1294 spectrum 1 weight .10000E+01 volume .17186E-02 ppm1 8.257 ppm2 2.986 CV 1
ASSI { 1300}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HB2 ))
2.400 .700 .700 peak 1300 spectrum 1 weight .10000E+01 volume .54101E-02 ppm1 8.275 ppm2 1.946 CV 1
OR { 1300}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 81 and name HG ))
ASSI { 1316}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 35 and name HB2 ))
4.000 2.000 2.000 peak 1316 spectrum 1 weight .10000E+01 volume .93423E-03 ppm1 7.568 ppm2 3.403 CV 1
OR { 1316}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 35 and name HB1 ))
ASSI { 1323}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 40 and name HG2%)
4.300 2.300 1.700 peak 1323 spectrum 1 weight .10000E+01 volume .59530E-03 ppm1 7.578 ppm2 1.338 CV 1
ASSI { 1326}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 36 and name HB2 ))
3.300 1.300 1.300 peak 1326 spectrum 1 weight .10000E+01 volume .11102E-02 ppm1 7.762 ppm2 4.493 CV 1
ASSI { 1332}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB ))
2.600 .800 .800 peak 1332 spectrum 1 weight .10000E+01 volume .30374E-02 ppm1 7.758 ppm2 2.027 CV 1
ASSI { 1340}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HN ))
4.300 2.300 1.700 peak 1340 spectrum 1 weight .10000E+01 volume .41063E-03 ppm1 9.048 ppm2 9.653 CV 1
ASSI { 1347}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 37 and name HG2%)
2.500 .800 .800 peak 1347 spectrum 1 weight .10000E+01 volume .51364E-02 ppm1 9.054 ppm2 1.059 CV 1
OR { 1347}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 37 and name HG1%)
ASSI { 1356}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 67 and name HA2 ))
4.000 2.000 2.000 peak 1356 spectrum 1 weight .10000E+01 volume .10450E-02 ppm1 7.747 ppm2 4.590 CV 1
ASSI { 1370}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HB2 ))
3.400 1.400 1.400 peak 1370 spectrum 1 weight .10000E+01 volume .11124E-02 ppm1 7.701 ppm2 3.663 CV 1
OR { 1370}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HA ))
ASSI { 1371}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HG1 ))
3.600 1.600 1.600 peak 1371 spectrum 1 weight .10000E+01 volume .12167E-02 ppm1 7.703 ppm2 2.251 CV 1
OR { 1371}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HG2 ))
ASSI { 1377}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 57 and name HN ))
3.100 3.100 2.900 peak 1377 spectrum 1 weight .10000E+01 volume .53884E-03 ppm1 7.426 ppm2 7.098 CV 1
ASSI { 1382}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HA ))
3.200 1.300 1.300 peak 1382 spectrum 1 weight .10000E+01 volume .12037E-02 ppm1 7.407 ppm2 3.685 CV 1
OR { 1382}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 33 and name HB2 ))
ASSI { 1396}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 37 and name HG1%)
3.700 1.700 1.700 peak 1396 spectrum 1 weight .10000E+01 volume .75389E-03 ppm1 7.432 ppm2 1.049 CV 1
OR { 1396}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 37 and name HG2%)
ASSI { 1409}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 32 and name HN ))
3.700 1.700 1.700 peak 1409 spectrum 1 weight .10000E+01 volume .82342E-03 ppm1 8.100 ppm2 7.039 CV 1
ASSI { 1415}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB2 ))
2.700 .900 .900 peak 1415 spectrum 1 weight .10000E+01 volume .37413E-02 ppm1 8.094 ppm2 2.070 CV 1
ASSI { 1466}
(( segid " " and resid 35 and name HE1 ))
(( segid " " and resid 32 and name HA ))
3.200 1.200 1.200 peak 1466 spectrum 1 weight .10000E+01 volume .14861E-02 ppm1 9.803 ppm2 2.073 CV 1
ASSI { 1472}
(( segid " " and resid 106 and name HE1 ))
(( segid " " and resid 104 and name HB2 ))
3.600 1.600 1.600 peak 1472 spectrum 1 weight .10000E+01 volume .65832E-03 ppm1 10.084 ppm2 1.652 CV 1
OR { 1472}
(( segid " " and resid 106 and name HE1 ))
(( segid " " and resid 104 and name HG ))
ASSI { 1473}
(( segid " " and resid 43 and name HE1 ))
(( segid " " and resid 43 and name HD1 ))
2.100 .600 .600 peak 1473 spectrum 1 weight .10000E+01 volume .14290E-01 ppm1 10.162 ppm2 7.284 CV 1
OR { 1473}
(( segid " " and resid 43 and name HE1 ))
(( segid " " and resid 43 and name HZ2 ))
ASSI { 2611}
(( segid " " and resid 34 and name HE22))
(( segid " " and resid 34 and name HG2 ))
3.800 1.800 1.800 peak 2611 spectrum 1 weight .10000E+01 volume .12884E-02 ppm1 7.483 ppm2 2.238 CV 1
OR { 2611}
(( segid " " and resid 34 and name HE22))
(( segid " " and resid 34 and name HG1 ))
ASSI { 2617}
(( segid " " and resid 58 and name HE22))
(( segid " " and resid 58 and name HG2 ))
3.900 1.900 1.900 peak 2617 spectrum 1 weight .10000E+01 volume .11558E-02 ppm1 7.524 ppm2 2.335 CV 1
OR { 2617}
(( segid " " and resid 58 and name HE22))
(( segid " " and resid 58 and name HG1 ))
ASSI { 2618}
(( segid " " and resid 58 and name HE21))
(( segid " " and resid 58 and name HG2 ))
3.100 1.200 1.200 peak 2618 spectrum 1 weight .10000E+01 volume .11254E-02 ppm1 6.823 ppm2 2.310 CV 1
OR { 2618}
(( segid " " and resid 58 and name HE21))
(( segid " " and resid 58 and name HG1 ))
ASSI { 2627}
(( segid " " and resid 79 and name HE22))
(( segid " " and resid 79 and name HG1 ))
3.500 1.500 1.500 peak 2627 spectrum 1 weight .10000E+01 volume .21401E-02 ppm1 7.089 ppm2 1.886 CV 1
ASSI { 2628}
(( segid " " and resid 79 and name HE22))
(( segid " " and resid 86 and name HB1 ))
4.300 2.300 1.700 peak 2628 spectrum 1 weight .10000E+01 volume .71913E-03 ppm1 7.083 ppm2 1.607 CV 1
ASSI { 2630}
(( segid " " and resid 79 and name HE22))
( segid " " and resid 86 and name HD1%)
3.700 1.700 1.700 peak 2630 spectrum 1 weight .10000E+01 volume .77130E-03 ppm1 7.082 ppm2 .864 CV 1
OR { 2630}
(( segid " " and resid 79 and name HE22))
( segid " " and resid 86 and name HD2%)
ASSI { 2634}
(( segid " " and resid 79 and name HE21))
(( segid " " and resid 79 and name HG1 ))
2.800 1.000 1.000 peak 2634 spectrum 1 weight .10000E+01 volume .17729E-02 ppm1 6.749 ppm2 1.890 CV 1
ASSI { 2636}
(( segid " " and resid 79 and name HE21))
( segid " " and resid 86 and name HD1%)
3.100 1.200 1.200 peak 2636 spectrum 1 weight .10000E+01 volume .13514E-02 ppm1 6.752 ppm2 .889 CV 1
OR { 2636}
(( segid " " and resid 79 and name HE21))
( segid " " and resid 86 and name HD2%)
ASSI { 2965}
(( segid " " and resid 104 and name HN ))
( segid " " and resid 104 and name HD2%)
4.200 2.200 1.800 peak 2965 spectrum 1 weight .10000E+01 volume .90380E-03 ppm1 7.863 ppm2 .865 CV 1
OR { 2965}
(( segid " " and resid 104 and name HN ))
( segid " " and resid 104 and name HD1%)
ASSI { 3389}
(( segid " " and resid 59 and name HE ))
(( segid " " and resid 59 and name HD2 ))
3.300 1.400 1.400 peak 3389 spectrum 1 weight .10000E+01 volume .72785E-03 ppm1 7.965 ppm2 3.185 CV 1
OR { 3389}
(( segid " " and resid 59 and name HE ))
(( segid " " and resid 59 and name HD1 ))
ASSI { 3518}
(( segid " " and resid 94 and name HN ))
( segid " " and resid 94 and name HD1%)
3.500 1.500 1.500 peak 3518 spectrum 1 weight .10000E+01 volume .19250E-02 ppm1 8.458 ppm2 .879 CV 1
OR { 3518}
(( segid " " and resid 94 and name HN ))
( segid " " and resid 94 and name HG2%)
ASSI { 3863}
(( segid " " and resid 63 and name HD21))
( segid " " and resid 65 and name HD1%)
3.500 1.500 1.500 peak 3863 spectrum 1 weight .10000E+01 volume .87342E-03 ppm1 7.343 ppm2 .777 CV 1
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