NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
15576 |
1yka   |
cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 4098}
( segid " " and resid 20 and name HD% )
(( segid " " and resid 75 and name HD1 ))
2.700 0.900 0.900 peak 4098 spectrum 1 weight 0.10000E+01 volume 0.26105E-02 ppm1 6.935 ppm2 7.298 CV 1
OR { 4098}
( segid " " and resid 20 and name HD% )
( segid " " and resid 71 and name HD% )
ASSI { 3975}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 64 and name HN ))
2.800 2.800 3.200 peak 3975 spectrum 1 weight 0.10000E+01 volume 0.24742E-02 ppm1 2.858 ppm2 7.253 CV 1
OR { 3975}
(( segid " " and resid 68 and name HB2 ))
(( segid " " and resid 68 and name HH2 ))
ASSI { 4096}
(( segid " " and resid 71 and name HB3 ))
( segid " " and resid 71 and name HD% )
2.600 0.800 0.800 peak 4096 spectrum 1 weight 0.10000E+01 volume 0.26000E-02 ppm1 2.833 ppm2 7.284 CV 1
OR { 4096}
(( segid " " and resid 47 and name HB2 ))
( segid " " and resid 47 and name HD% )
ASSI { 2206}
( segid " " and resid 41 and name HB% )
(( segid " " and resid 42 and name HN ))
2.900 1.000 1.000 peak 2206 spectrum 1 weight 0.10000E+01 volume 0.25581E-02 ppm1 1.531 ppm2 7.530 CV 1
OR { 2206}
(( segid " " and resid 108 and name HG2 ))
(( segid " " and resid 108 and name HN ))
OR { 2206}
(( segid " " and resid 108 and name HG3 ))
(( segid " " and resid 108 and name HN ))
ASSI { 3262}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HN ))
2.700 0.900 0.900 peak 3262 spectrum 1 weight 0.10000E+01 volume 0.24428E-02 ppm1 4.112 ppm2 7.035 CV 1
OR { 3262}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 55 and name HN ))
ASSI { 3263}
( segid " " and resid 48 and name HB% )
( segid " " and resid 49 and name HD% )
3.100 1.200 1.200 peak 3263 spectrum 1 weight 0.10000E+01 volume 0.24428E-02 ppm1 1.300 ppm2 6.918 CV 1
OR { 3263}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 20 and name HD% )
ASSI { 3275}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 92 and name HN ))
2.900 1.100 1.100 peak 3275 spectrum 1 weight 0.10000E+01 volume 0.24428E-02 ppm1 0.980 ppm2 8.759 CV 1
OR { 3275}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 91 and name HN ))
ASSI { 3288}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HN ))
2.800 0.900 0.900 peak 3288 spectrum 1 weight 0.10000E+01 volume 0.24532E-02 ppm1 4.550 ppm2 7.036 CV 1
OR { 3288}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 54 and name HN ))
OR { 3288}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 55 and name HN ))
ASSI { 3293}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 73 and name HN ))
2.900 1.100 1.100 peak 3293 spectrum 1 weight 0.10000E+01 volume 0.24532E-02 ppm1 4.610 ppm2 9.094 CV 1
OR { 3293}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 78 and name HN ))
OR { 3293}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 53 and name HN ))
ASSI { 3311}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 29 and name HN ))
2.900 1.100 1.100 peak 3311 spectrum 1 weight 0.10000E+01 volume 0.24532E-02 ppm1 1.860 ppm2 8.706 CV 1
OR { 3311}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 29 and name HN ))
OR { 3311}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 15 and name HD22))
OR { 3311}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 15 and name HD22))
ASSI { 3320}
(( segid " " and resid 82 and name HA2 ))
(( segid " " and resid 86 and name HN ))
3.100 1.200 1.200 peak 3320 spectrum 1 weight 0.10000E+01 volume 0.24532E-02 ppm1 3.868 ppm2 7.827 CV 1
OR { 3320}
(( segid " " and resid 63 and name HD3 ))
(( segid " " and resid 61 and name HN ))
OR { 3320}
(( segid " " and resid 82 and name HA2 ))
(( segid " " and resid 87 and name HN ))
ASSI { 3326}
(( segid " " and resid 8 and name HB ))
( segid " " and resid 65 and name HE% )
2.900 1.100 1.100 peak 3326 spectrum 1 weight 0.10000E+01 volume 0.24532E-02 ppm1 1.464 ppm2 6.660 CV 1
OR { 3326}
(( segid " " and resid 12 and name HB ))
( segid " " and resid 65 and name HE% )
ASSI { 3372}
( segid " " and resid 37 and name HG1%)
(( segid " " and resid 38 and name HE22))
2.900 1.000 1.000 peak 3372 spectrum 1 weight 0.10000E+01 volume 0.24637E-02 ppm1 1.028 ppm2 7.395 CV 1
OR { 3372}
(( segid " " and resid 80 and name HB3 ))
(( segid " " and resid 75 and name HZ2 ))
ASSI { 3381}
( segid " " and resid 5 and name HD1%)
(( segid " " and resid 9 and name HE21))
3.100 1.200 1.200 peak 3381 spectrum 1 weight 0.10000E+01 volume 0.24637E-02 ppm1 0.794 ppm2 6.791 CV 1
OR { 3381}
(( segid " " and resid 106 and name HG2 ))
( segid " " and resid 107 and name HE% )
ASSI { 3436}
( segid " " and resid 62 and name HD2%)
( segid " " and resid 71 and name HD% )
2.900 1.100 1.100 peak 3436 spectrum 1 weight 0.10000E+01 volume 0.24637E-02 ppm1 0.755 ppm2 7.296 CV 1
OR { 3436}
( segid " " and resid 74 and name HD1%)
(( segid " " and resid 75 and name HD1 ))
OR { 3436}
( segid " " and resid 62 and name HD2%)
(( segid " " and resid 64 and name HN ))
OR { 3436}
( segid " " and resid 100 and name HD1%)
( segid " " and resid 107 and name HD% )
OR { 3436}
( segid " " and resid 62 and name HD2%)
(( segid " " and resid 75 and name HD1 ))
ASSI { 3407}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 75 and name HE3 ))
3.000 1.100 1.100 peak 3407 spectrum 1 weight 0.10000E+01 volume 0.24742E-02 ppm1 2.910 ppm2 7.036 CV 1
OR { 3407}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 54 and name HN ))
OR { 3407}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name HE3 ))
OR { 3407}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 55 and name HN ))
ASSI { 4084}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HN ))
2.700 0.900 0.900 peak 4084 spectrum 1 weight 0.10000E+01 volume 0.24742E-02 ppm1 4.546 ppm2 8.440 CV 1
OR { 4084}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HN ))
ASSI { 3440}
( segid " " and resid 39 and name HB% )
(( segid " " and resid 91 and name HN ))
3.300 1.300 1.300 peak 3440 spectrum 1 weight 0.10000E+01 volume 0.24847E-02 ppm1 0.885 ppm2 8.769 CV 1
OR { 3440}
( segid " " and resid 39 and name HB% )
(( segid " " and resid 92 and name HN ))
ASSI { 3497}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 49 and name HN ))
2.900 1.000 1.000 peak 3497 spectrum 1 weight 0.10000E+01 volume 0.24847E-02 ppm1 0.204 ppm2 8.307 CV 1
OR { 3497}
( segid " " and resid 18 and name HD1%)
(( segid " " and resid 48 and name HN ))
ASSI { 3448}
(( segid " " and resid 19 and name HG ))
( segid " " and resid 49 and name HD% )
3.000 1.100 1.100 peak 3448 spectrum 1 weight 0.10000E+01 volume 0.24847E-02 ppm1 1.411 ppm2 6.911 CV 1
OR { 3448}
(( segid " " and resid 19 and name HG ))
( segid " " and resid 20 and name HD% )
ASSI { 3872}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 78 and name HN ))
3.100 1.200 1.200 peak 3872 spectrum 1 weight 0.10000E+01 volume 0.23274E-02 ppm1 2.327 ppm2 9.107 CV 1
OR { 3872}
(( segid " " and resid 61 and name HG3 ))
(( segid " " and resid 62 and name HN ))
OR { 3872}
(( segid " " and resid 61 and name HG2 ))
(( segid " " and resid 62 and name HN ))
ASSI { 3477}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 78 and name HN ))
2.800 2.800 3.200 peak 3477 spectrum 1 weight 0.10000E+01 volume 0.24847E-02 ppm1 1.939 ppm2 9.111 CV 1
OR { 3477}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 78 and name HN ))
OR { 3477}
(( segid " " and resid 17 and name HB ))
(( segid " " and resid 78 and name HN ))
OR { 3477}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 76 and name HN ))
OR { 3477}
(( segid " " and resid 17 and name HB ))
(( segid " " and resid 76 and name HN ))
ASSI { 3494}
( segid " " and resid 96 and name HD2%)
(( segid " " and resid 91 and name HN ))
2.800 1.000 1.000 peak 3494 spectrum 1 weight 0.10000E+01 volume 0.24952E-02 ppm1 0.840 ppm2 8.769 CV 1
OR { 3494}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 91 and name HN ))
OR { 3494}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 91 and name HN ))
ASSI { 3509}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 38 and name HE22))
2.900 1.100 1.100 peak 3509 spectrum 1 weight 0.10000E+01 volume 0.24952E-02 ppm1 2.340 ppm2 7.386 CV 1
OR { 3509}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 15 and name HD21))
OR { 3509}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 15 and name HD21))
ASSI { 3558}
( segid " " and resid 20 and name HE% )
(( segid " " and resid 75 and name HD1 ))
2.900 1.100 1.100 peak 3558 spectrum 1 weight 0.10000E+01 volume 0.24952E-02 ppm1 6.331 ppm2 7.292 CV 1
OR { 3558}
(( segid " " and resid 70 and name HN ))
( segid " " and resid 71 and name HD% )
OR { 3558}
( segid " " and resid 20 and name HE% )
( segid " " and resid 71 and name HD% )
ASSI { 3515}
( segid " " and resid 76 and name HG1%)
(( segid " " and resid 103 and name HN ))
2.800 1.000 1.000 peak 3515 spectrum 1 weight 0.10000E+01 volume 0.24952E-02 ppm1 0.910 ppm2 8.182 CV 1
OR { 3515}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 37 and name HN ))
OR { 3515}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 50 and name HN ))
ASSI { 3580}
(( segid " " and resid 62 and name HG ))
(( segid " " and resid 75 and name HE1 ))
3.000 3.000 3.000 peak 3580 spectrum 1 weight 0.10000E+01 volume 0.23484E-02 ppm1 1.578 ppm2 9.998 CV 1
OR { 3580}
(( segid " " and resid 12 and name HG13))
(( segid " " and resid 75 and name HE1 ))
OR { 3580}
(( segid " " and resid 52 and name HG13))
(( segid " " and resid 75 and name HE1 ))
OR { 3580}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 75 and name HE1 ))
ASSI { 3732}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HD21))
2.900 2.900 3.100 peak 3732 spectrum 1 weight 0.10000E+01 volume 0.24218E-02 ppm1 8.034 ppm2 7.400 CV 1
OR { 3732}
(( segid " " and resid 80 and name HN ))
(( segid " " and resid 75 and name HZ2 ))
OR { 3732}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 15 and name HD21))
OR { 3732}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 10 and name HE ))
ASSI { 3534}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 71 and name HD% )
2.800 1.000 1.000 peak 3534 spectrum 1 weight 0.10000E+01 volume 0.25057E-02 ppm1 9.093 ppm2 7.285 CV 1
OR { 3534}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 47 and name HD% )
OR { 3534}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 64 and name HN ))
OR { 3534}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 71 and name HD% )
ASSI { 3539}
( segid " " and resid 71 and name HD% )
(( segid " " and resid 73 and name HN ))
2.700 0.900 0.900 peak 3539 spectrum 1 weight 0.10000E+01 volume 0.25057E-02 ppm1 7.295 ppm2 9.086 CV 1
OR { 3539}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 62 and name HN ))
ASSI { 3545}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 49 and name HE% )
3.000 1.100 1.100 peak 3545 spectrum 1 weight 0.10000E+01 volume 0.25057E-02 ppm1 4.652 ppm2 6.789 CV 1
OR { 3545}
(( segid " " and resid 107 and name HA ))
( segid " " and resid 107 and name HE% )
ASSI { 3546}
(( segid " " and resid 5 and name HG13))
( segid " " and resid 65 and name HD% )
3.200 1.300 1.300 peak 3546 spectrum 1 weight 0.10000E+01 volume 0.25057E-02 ppm1 1.469 ppm2 6.969 CV 1
OR { 3546}
(( segid " " and resid 8 and name HB ))
( segid " " and resid 65 and name HD% )
ASSI { 3552}
(( segid " " and resid 88 and name HG12))
(( segid " " and resid 36 and name HN ))
2.900 1.100 1.100 peak 3552 spectrum 1 weight 0.10000E+01 volume 0.25057E-02 ppm1 1.509 ppm2 8.044 CV 1
OR { 3552}
(( segid " " and resid 88 and name HG12))
(( segid " " and resid 89 and name HN ))
ASSI { 3582}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 15 and name HD22))
2.800 1.000 1.000 peak 3582 spectrum 1 weight 0.10000E+01 volume 0.25161E-02 ppm1 3.720 ppm2 8.704 CV 1
OR { 3582}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 29 and name HN ))
OR { 3582}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 29 and name HN ))
ASSI { 3586}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 58 and name HN ))
2.700 0.900 0.900 peak 3586 spectrum 1 weight 0.10000E+01 volume 0.25161E-02 ppm1 2.536 ppm2 7.772 CV 1
OR { 3586}
(( segid " " and resid 54 and name HG3 ))
(( segid " " and resid 54 and name HE22))
ASSI { 3591}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 55 and name HD22))
2.800 1.000 1.000 peak 3591 spectrum 1 weight 0.10000E+01 volume 0.25161E-02 ppm1 0.915 ppm2 7.530 CV 1
OR { 3591}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 68 and name HZ2 ))
ASSI { 2451}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HN ))
2.700 0.900 0.900 peak 2451 spectrum 1 weight 0.10000E+01 volume 0.25476E-02 ppm1 1.870 ppm2 6.973 CV 1
OR { 2451}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 15 and name HN ))
OR { 2451}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 15 and name HN ))
ASSI { 3622}
( segid " " and resid 96 and name HD2%)
( segid " " and resid 91 and name HE% )
2.500 2.500 3.500 peak 3622 spectrum 1 weight 0.10000E+01 volume 0.25266E-02 ppm1 0.840 ppm2 6.757 CV 1
OR { 3622}
( segid " " and resid 96 and name HD1%)
( segid " " and resid 91 and name HE% )
OR { 3622}
( segid " " and resid 27 and name HD1%)
(( segid " " and resid 38 and name HE21))
OR { 3622}
( segid " " and resid 87 and name HG2%)
( segid " " and resid 91 and name HE% )
OR { 3622}
( segid " " and resid 27 and name HD2%)
(( segid " " and resid 38 and name HE21))
OR { 3622}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 38 and name HE21))
ASSI { 3626}
(( segid " " and resid 54 and name HG3 ))
(( segid " " and resid 54 and name HE21))
2.900 1.100 1.100 peak 3626 spectrum 1 weight 0.10000E+01 volume 0.25266E-02 ppm1 2.480 ppm2 6.840 CV 1
OR { 3626}
(( segid " " and resid 98 and name HG3 ))
(( segid " " and resid 98 and name HN ))
ASSI { 3654}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 82 and name HN ))
2.800 1.000 1.000 peak 3654 spectrum 1 weight 0.10000E+01 volume 0.25266E-02 ppm1 0.837 ppm2 6.385 CV 1
OR { 3654}
( segid " " and resid 81 and name HG2%)
(( segid " " and resid 82 and name HN ))
ASSI { 3665}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 75 and name HE1 ))
3.100 3.100 2.900 peak 3665 spectrum 1 weight 0.10000E+01 volume 0.23799E-02 ppm1 4.283 ppm2 9.995 CV 1
OR { 3665}
(( segid " " and resid 78 and name HA2 ))
(( segid " " and resid 75 and name HN ))
OR { 3665}
(( segid " " and resid 78 and name HA2 ))
(( segid " " and resid 75 and name HE1 ))
ASSI { 3688}
( segid " " and resid 74 and name HD2%)
(( segid " " and resid 18 and name HN ))
2.900 1.000 1.000 peak 3688 spectrum 1 weight 0.10000E+01 volume 0.25371E-02 ppm1 0.886 ppm2 9.358 CV 1
OR { 3688}
(( segid " " and resid 18 and name HG ))
(( segid " " and resid 18 and name HN ))
ASSI { 3733}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 65 and name HN ))
2.800 1.000 1.000 peak 3733 spectrum 1 weight 0.10000E+01 volume 0.23799E-02 ppm1 4.554 ppm2 7.926 CV 1
OR { 3733}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 79 and name HN ))
ASSI { 3707}
(( segid " " and resid 92 and name HG3 ))
( segid " " and resid 91 and name HD% )
2.700 0.900 0.900 peak 3707 spectrum 1 weight 0.10000E+01 volume 0.25371E-02 ppm1 2.773 ppm2 6.912 CV 1
OR { 3707}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 49 and name HD% )
OR { 3707}
(( segid " " and resid 43 and name HB2 ))
( segid " " and resid 91 and name HD% )
ASSI { 3712}
(( segid " " and resid 75 and name HZ2 ))
(( segid " " and resid 80 and name HN ))
2.800 2.800 3.200 peak 3712 spectrum 1 weight 0.10000E+01 volume 0.23799E-02 ppm1 7.397 ppm2 8.034 CV 1
OR { 3712}
(( segid " " and resid 15 and name HD21))
(( segid " " and resid 12 and name HN ))
OR { 3712}
(( segid " " and resid 10 and name HE ))
(( segid " " and resid 14 and name HN ))
OR { 3712}
(( segid " " and resid 10 and name HE ))
(( segid " " and resid 12 and name HN ))
ASSI { 2939}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HN ))
2.800 1.000 1.000 peak 2939 spectrum 1 weight 0.10000E+01 volume 0.25476E-02 ppm1 1.894 ppm2 8.024 CV 1
OR { 2939}
(( segid " " and resid 79 and name HB3 ))
(( segid " " and resid 80 and name HN ))
OR { 2939}
(( segid " " and resid 14 and name HB3 ))
(( segid " " and resid 14 and name HN ))
ASSI { 3757}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 79 and name HN ))
2.800 1.000 1.000 peak 3757 spectrum 1 weight 0.10000E+01 volume 0.24008E-02 ppm1 3.518 ppm2 7.926 CV 1
OR { 3757}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 11 and name HN ))
ASSI { 3764}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 91 and name HN ))
2.900 2.900 3.100 peak 3764 spectrum 1 weight 0.10000E+01 volume 0.24008E-02 ppm1 1.398 ppm2 8.768 CV 1
OR { 3764}
(( segid " " and resid 74 and name HG ))
(( segid " " and resid 91 and name HN ))
OR { 3764}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 92 and name HN ))
ASSI { 3784}
( segid " " and resid 87 and name HG1%)
(( segid " " and resid 91 and name HN ))
3.000 1.100 1.100 peak 3784 spectrum 1 weight 0.10000E+01 volume 0.24008E-02 ppm1 0.723 ppm2 8.766 CV 1
OR { 3784}
( segid " " and resid 88 and name HD1%)
(( segid " " and resid 91 and name HN ))
OR { 3784}
( segid " " and resid 88 and name HD1%)
(( segid " " and resid 92 and name HN ))
ASSI { 3792}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 79 and name HN ))
2.700 2.700 3.300 peak 3792 spectrum 1 weight 0.10000E+01 volume 0.24008E-02 ppm1 -0.308 ppm2 7.933 CV 1
OR { 3792}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 65 and name HN ))
ASSI { 3802}
( segid " " and resid 53 and name HD1%)
( segid " " and resid 71 and name HD% )
2.900 1.000 1.000 peak 3802 spectrum 1 weight 0.10000E+01 volume 0.25581E-02 ppm1 0.876 ppm2 7.288 CV 1
OR { 3802}
(( segid " " and resid 52 and name HG12))
( segid " " and resid 71 and name HD% )
OR { 3802}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 68 and name HH2 ))
OR { 3802}
(( segid " " and resid 18 and name HG ))
(( segid " " and resid 75 and name HD1 ))
OR { 3802}
(( segid " " and resid 52 and name HG12))
(( segid " " and resid 75 and name HD1 ))
ASSI { 3814}
(( segid " " and resid 112 and name HD2 ))
(( segid " " and resid 113 and name HN ))
2.800 2.800 3.200 peak 3814 spectrum 1 weight 0.10000E+01 volume 0.24008E-02 ppm1 3.739 ppm2 8.444 CV 1
OR { 3814}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 74 and name HN ))
OR { 3814}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 74 and name HN ))
ASSI { 3828}
(( segid " " and resid 100 and name HG12))
(( segid " " and resid 99 and name HN ))
3.000 1.200 1.200 peak 3828 spectrum 1 weight 0.10000E+01 volume 0.24008E-02 ppm1 1.440 ppm2 7.812 CV 1
OR { 3828}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 87 and name HN ))
ASSI { 3842}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 12 and name HN ))
2.800 1.000 1.000 peak 3842 spectrum 1 weight 0.10000E+01 volume 0.24113E-02 ppm1 3.385 ppm2 8.045 CV 1
OR { 3842}
(( segid " " and resid 91 and name HB3 ))
(( segid " " and resid 89 and name HN ))
OR { 3842}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 89 and name HN ))
ASSI { 3845}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 92 and name HN ))
2.900 1.100 1.100 peak 3845 spectrum 1 weight 0.10000E+01 volume 0.24113E-02 ppm1 1.781 ppm2 8.771 CV 1
OR { 3845}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 91 and name HN ))
ASSI { 3850}
(( segid " " and resid 27 and name HG ))
(( segid " " and resid 29 and name HN ))
3.000 1.100 1.100 peak 3850 spectrum 1 weight 0.10000E+01 volume 0.24113E-02 ppm1 1.302 ppm2 8.701 CV 1
OR { 3850}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 29 and name HN ))
OR { 3850}
( segid " " and resid 48 and name HB% )
(( segid " " and resid 15 and name HD22))
ASSI { 3887}
(( segid " " and resid 12 and name HG13))
(( segid " " and resid 11 and name HN ))
3.000 1.100 1.100 peak 3887 spectrum 1 weight 0.10000E+01 volume 0.24113E-02 ppm1 1.552 ppm2 7.926 CV 1
OR { 3887}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 11 and name HN ))
OR { 3887}
(( segid " " and resid 64 and name HG3 ))
(( segid " " and resid 65 and name HN ))
ASSI { 3952}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 49 and name HN ))
2.900 1.100 1.100 peak 3952 spectrum 1 weight 0.10000E+01 volume 0.24113E-02 ppm1 8.947 ppm2 8.308 CV 1
OR { 3952}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 48 and name HN ))
ASSI { 3874}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 89 and name HN ))
2.800 1.000 1.000 peak 3874 spectrum 1 weight 0.10000E+01 volume 0.24113E-02 ppm1 4.320 ppm2 8.048 CV 1
OR { 3874}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 80 and name HN ))
ASSI { 3875}
(( segid " " and resid 62 and name HG ))
( segid " " and resid 71 and name HE% )
2.900 1.100 1.100 peak 3875 spectrum 1 weight 0.10000E+01 volume 0.24113E-02 ppm1 1.574 ppm2 7.351 CV 1
OR { 3875}
(( segid " " and resid 52 and name HB ))
( segid " " and resid 71 and name HE% )
ASSI { 3937}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 21 and name HN ))
3.100 3.100 2.900 peak 3937 spectrum 1 weight 0.10000E+01 volume 0.24113E-02 ppm1 0.827 ppm2 9.463 CV 1
OR { 3937}
( segid " " and resid 53 and name HD1%)
(( segid " " and resid 21 and name HN ))
ASSI { 3891}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 55 and name HN ))
3.200 1.200 1.200 peak 3891 spectrum 1 weight 0.10000E+01 volume 0.24113E-02 ppm1 0.688 ppm2 7.035 CV 1
OR { 3891}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 54 and name HN ))
ASSI { 3909}
(( segid " " and resid 75 and name HH2 ))
(( segid " " and resid 66 and name HN ))
3.000 1.100 1.100 peak 3909 spectrum 1 weight 0.10000E+01 volume 0.24218E-02 ppm1 7.193 ppm2 9.116 CV 1
OR { 3909}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 41 and name HN ))
OR { 3909}
(( segid " " and resid 75 and name HZ3 ))
(( segid " " and resid 76 and name HN ))
ASSI { 3911}
(( segid " " and resid 92 and name HN ))
(( segid " " and resid 94 and name HN ))
2.800 1.000 1.000 peak 3911 spectrum 1 weight 0.10000E+01 volume 0.24218E-02 ppm1 8.761 ppm2 7.664 CV 1
OR { 3911}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 94 and name HN ))
ASSI { 3915}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 64 and name HN ))
2.900 1.100 1.100 peak 3915 spectrum 1 weight 0.10000E+01 volume 0.24218E-02 ppm1 4.347 ppm2 7.283 CV 1
OR { 3915}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 64 and name HN ))
ASSI { 3835}
( segid " " and resid 58 and name HG2%)
( segid " " and resid 71 and name HE% )
3.000 1.100 1.100 peak 3835 spectrum 1 weight 0.10000E+01 volume 0.24218E-02 ppm1 0.830 ppm2 7.351 CV 1
OR { 3835}
( segid " " and resid 53 and name HD1%)
( segid " " and resid 71 and name HE% )
ASSI { 3920}
( segid " " and resid 53 and name HD1%)
(( segid " " and resid 53 and name HN ))
2.700 0.900 0.900 peak 3920 spectrum 1 weight 0.10000E+01 volume 0.25790E-02 ppm1 0.834 ppm2 9.099 CV 1
OR { 3920}
( segid " " and resid 81 and name HG2%)
(( segid " " and resid 76 and name HN ))
OR { 3920}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 78 and name HN ))
ASSI { 3924}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 49 and name HD% )
2.700 0.900 0.900 peak 3924 spectrum 1 weight 0.10000E+01 volume 0.25790E-02 ppm1 3.060 ppm2 6.908 CV 1
OR { 3924}
(( segid " " and resid 91 and name HB2 ))
( segid " " and resid 91 and name HD% )
ASSI { 3928}
( segid " " and resid 104 and name HB% )
(( segid " " and resid 103 and name HN ))
3.000 1.100 1.100 peak 3928 spectrum 1 weight 0.10000E+01 volume 0.24218E-02 ppm1 1.502 ppm2 8.178 CV 1
OR { 3928}
( segid " " and resid 105 and name HB% )
(( segid " " and resid 103 and name HN ))
OR { 3928}
( segid " " and resid 104 and name HB% )
(( segid " " and resid 114 and name HN ))
ASSI { 3934}
(( segid " " and resid 40 and name HB3 ))
(( segid " " and resid 39 and name HN ))
3.000 3.000 3.000 peak 3934 spectrum 1 weight 0.10000E+01 volume 0.24218E-02 ppm1 1.086 ppm2 7.185 CV 1
OR { 3934}
( segid " " and resid 37 and name HG2%)
(( segid " " and resid 39 and name HN ))
ASSI { 3309}
(( segid " " and resid 8 and name HB ))
( segid " " and resid 20 and name HE% )
3.000 3.000 3.000 peak 3309 spectrum 1 weight 0.10000E+01 volume 0.24532E-02 ppm1 1.497 ppm2 6.306 CV 1
OR { 3309}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 70 and name HN ))
ASSI { 3941}
(( segid " " and resid 19 and name HG ))
(( segid " " and resid 22 and name HN ))
2.800 2.800 3.200 peak 3941 spectrum 1 weight 0.10000E+01 volume 0.24323E-02 ppm1 1.395 ppm2 8.572 CV 1
OR { 3941}
( segid " " and resid 103 and name HG2%)
(( segid " " and resid 102 and name HN ))
OR { 3941}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 22 and name HN ))
ASSI { 3990}
( segid " " and resid 50 and name HG2%)
( segid " " and resid 20 and name HE% )
2.800 1.000 1.000 peak 3990 spectrum 1 weight 0.10000E+01 volume 0.25895E-02 ppm1 0.834 ppm2 6.322 CV 1
OR { 3990}
(( segid " " and resid 18 and name HG ))
( segid " " and resid 20 and name HE% )
OR { 3990}
( segid " " and resid 12 and name HG2%)
( segid " " and resid 20 and name HE% )
ASSI { 3954}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 75 and name HN ))
2.800 1.000 1.000 peak 3954 spectrum 1 weight 0.10000E+01 volume 0.24323E-02 ppm1 0.986 ppm2 9.976 CV 1
OR { 3954}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 75 and name HN ))
OR { 3954}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 75 and name HN ))
ASSI { 3963}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 13 and name HN ))
3.000 1.200 1.200 peak 3963 spectrum 1 weight 0.10000E+01 volume 0.24323E-02 ppm1 0.546 ppm2 7.749 CV 1
OR { 3963}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 17 and name HN ))
ASSI { 3967}
( segid " " and resid 39 and name HB% )
(( segid " " and resid 97 and name HN ))
3.000 3.000 3.000 peak 3967 spectrum 1 weight 0.10000E+01 volume 0.24323E-02 ppm1 0.904 ppm2 11.441 CV 1
OR { 3967}
( segid " " and resid 76 and name HG1%)
(( segid " " and resid 97 and name HN ))
ASSI { 3989}
(( segid " " and resid 28 and name HG3 ))
( segid " " and resid 49 and name HD% )
3.000 3.000 3.000 peak 3989 spectrum 1 weight 0.10000E+01 volume 0.24323E-02 ppm1 1.831 ppm2 6.911 CV 1
OR { 3989}
(( segid " " and resid 58 and name HB ))
( segid " " and resid 20 and name HD% )
OR { 3989}
( segid " " and resid 66 and name HB% )
( segid " " and resid 20 and name HD% )
OR { 3989}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 49 and name HD% )
OR { 3989}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 91 and name HD% )
OR { 3989}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 20 and name HD% )
ASSI { 3996}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 42 and name HN ))
3.000 1.100 1.100 peak 3996 spectrum 1 weight 0.10000E+01 volume 0.24323E-02 ppm1 0.995 ppm2 7.529 CV 1
OR { 3996}
(( segid " " and resid 80 and name HB3 ))
(( segid " " and resid 67 and name HD21))
OR { 3996}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 42 and name HN ))
OR { 3996}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 93 and name HN ))
ASSI { 3997}
( segid " " and resid 81 and name HG1%)
(( segid " " and resid 87 and name HN ))
3.000 1.200 1.200 peak 3997 spectrum 1 weight 0.10000E+01 volume 0.24323E-02 ppm1 0.681 ppm2 7.827 CV 1
OR { 3997}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 61 and name HN ))
OR { 3997}
( segid " " and resid 81 and name HG1%)
(( segid " " and resid 86 and name HN ))
ASSI { 4001}
(( segid " " and resid 47 and name HB3 ))
( segid " " and resid 47 and name HD% )
2.700 0.900 0.900 peak 4001 spectrum 1 weight 0.10000E+01 volume 0.26000E-02 ppm1 2.937 ppm2 7.284 CV 1
OR { 4001}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 71 and name HD% )
OR { 4001}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name HD1 ))
ASSI { 4015}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 97 and name HE21))
3.100 3.100 2.900 peak 4015 spectrum 1 weight 0.10000E+01 volume 0.24428E-02 ppm1 7.930 ppm2 6.658 CV 1
OR { 4015}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 65 and name HE% )
OR { 4015}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 65 and name HE% )
ASSI { 3335}
(( segid " " and resid 28 and name HG3 ))
( segid " " and resid 49 and name HD% )
2.800 2.800 3.200 peak 3335 spectrum 1 weight 0.10000E+01 volume 0.24428E-02 ppm1 1.808 ppm2 6.911 CV 1
OR { 3335}
(( segid " " and resid 28 and name HG2 ))
( segid " " and resid 49 and name HD% )
OR { 3335}
(( segid " " and resid 93 and name HG2 ))
( segid " " and resid 91 and name HD% )
OR { 3335}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 49 and name HD% )
OR { 3335}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 20 and name HD% )
OR { 3335}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 91 and name HD% )
OR { 3335}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 20 and name HD% )
ASSI { 4044}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 49 and name HD% )
2.800 1.000 1.000 peak 4044 spectrum 1 weight 0.10000E+01 volume 0.24428E-02 ppm1 8.930 ppm2 6.917 CV 1
OR { 4044}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 20 and name HD% )
OR { 4044}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 49 and name HD% )
ASSI { 4047}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 71 and name HD% )
2.900 2.900 3.100 peak 4047 spectrum 1 weight 0.10000E+01 volume 0.24428E-02 ppm1 4.124 ppm2 7.313 CV 1
OR { 4047}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 107 and name HD% )
ASSI { 4059}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 94 and name HN ))
3.200 1.200 1.200 peak 4059 spectrum 1 weight 0.10000E+01 volume 0.24428E-02 ppm1 1.999 ppm2 7.668 CV 1
OR { 4059}
(( segid " " and resid 93 and name HG3 ))
(( segid " " and resid 94 and name HN ))
OR { 4059}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 94 and name HN ))
ASSI { 857}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 73 and name HN ))
2.800 1.000 1.000 peak 857 spectrum 1 weight 0.10000E+01 volume 0.24847E-02 ppm1 3.220 ppm2 9.059 CV 1
OR { 857}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HN ))
OR { 857}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 46 and name HN ))
ASSI { 627}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 35 and name HN ))
2.800 1.000 1.000 peak 627 spectrum 1 weight 0.10000E+01 volume 0.25266E-02 ppm1 2.664 ppm2 8.025 CV 1
OR { 627}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 36 and name HN ))
ASSI { 1429}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 95 and name HN ))
2.800 1.000 1.000 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.25371E-02 ppm1 1.894 ppm2 7.931 CV 1
OR { 1429}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 79 and name HN ))
OR { 1429}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 11 and name HN ))
OR { 1429}
(( segid " " and resid 79 and name HB3 ))
(( segid " " and resid 79 and name HN ))
OR { 1429}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 11 and name HN ))
ASSI { 3643}
(( segid " " and resid 38 and name HG3 ))
(( segid " " and resid 35 and name HN ))
3.000 3.000 3.000 peak 3643 spectrum 1 weight 0.10000E+01 volume 0.25266E-02 ppm1 2.493 ppm2 8.031 CV 1
OR { 3643}
(( segid " " and resid 38 and name HG3 ))
(( segid " " and resid 36 and name HN ))
ASSI { 824}
(( segid " " and resid 45 and name HG3 ))
(( segid " " and resid 45 and name HN ))
2.800 1.000 1.000 peak 824 spectrum 1 weight 0.10000E+01 volume 0.25686E-02 ppm1 2.119 ppm2 7.870 CV 1
OR { 824}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 10 and name HN ))
OR { 824}
(( segid " " and resid 45 and name HG2 ))
(( segid " " and resid 45 and name HN ))
ASSI { 2114}
(( segid " " and resid 106 and name HB3 ))
(( segid " " and resid 106 and name HN ))
2.800 0.900 0.900 peak 2114 spectrum 1 weight 0.10000E+01 volume 0.25686E-02 ppm1 1.759 ppm2 7.565 CV 1
OR { 2114}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 6 and name HN ))
OR { 2114}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 106 and name HN ))
ASSI { 3387}
( segid " " and resid 19 and name HD2%)
(( segid " " and resid 74 and name HA ))
2.800 2.800 3.200 peak 3387 spectrum 2 weight 0.10000E+01 volume 0.31091E-02 ppm1 1.044 ppm2 5.348 CV 1
OR { 3387}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 74 and name HA ))
OR { 3387}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 74 and name HA ))
ASSI { 3147}
(( segid " " and resid 97 and name HB3 ))
(( segid " " and resid 43 and name HB2 ))
2.400 0.700 0.700 peak 3147 spectrum 2 weight 0.10000E+01 volume 0.31371E-02 ppm1 2.159 ppm2 2.817 CV 1
OR { 3147}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 49 and name HB2 ))
ASSI { 2459}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 51 and name HB2 ))
2.800 1.000 1.000 peak 2459 spectrum 2 weight 0.10000E+01 volume 0.31652E-02 ppm1 1.818 ppm2 2.903 CV 1
OR { 2459}
( segid " " and resid 66 and name HB% )
(( segid " " and resid 80 and name HA ))
OR { 2459}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 51 and name HB3 ))
ASSI { 3339}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 93 and name HB3 ))
2.700 0.900 0.900 peak 3339 spectrum 2 weight 0.10000E+01 volume 0.32491E-02 ppm1 1.737 ppm2 1.914 CV 1
OR { 3339}
(( segid " " and resid 108 and name HD2 ))
(( segid " " and resid 108 and name HB2 ))
OR { 3339}
(( segid " " and resid 108 and name HD3 ))
(( segid " " and resid 108 and name HB2 ))
OR { 3339}
(( segid " " and resid 108 and name HD3 ))
(( segid " " and resid 108 and name HB3 ))
OR { 3339}
(( segid " " and resid 108 and name HD2 ))
(( segid " " and resid 108 and name HB3 ))
ASSI { 2017}
(( segid " " and resid 108 and name HG2 ))
(( segid " " and resid 108 and name HA ))
2.600 0.800 0.800 peak 2017 spectrum 2 weight 0.10000E+01 volume 0.32772E-02 ppm1 1.530 ppm2 4.357 CV 1
OR { 2017}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HA ))
OR { 2017}
(( segid " " and resid 108 and name HG3 ))
(( segid " " and resid 108 and name HA ))
ASSI { 723}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HD2 ))
2.500 0.800 0.800 peak 723 spectrum 2 weight 0.10000E+01 volume 0.32912E-02 ppm1 1.717 ppm2 3.202 CV 1
OR { 723}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HD3 ))
OR { 723}
(( segid " " and resid 69 and name HG3 ))
(( segid " " and resid 69 and name HD2 ))
OR { 723}
(( segid " " and resid 46 and name HG3 ))
(( segid " " and resid 46 and name HD2 ))
OR { 723}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HD3 ))
ASSI { 92}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 7 and name HE3 ))
2.600 0.800 0.800 peak 92 spectrum 2 weight 0.10000E+01 volume 0.31091E-02 ppm1 1.494 ppm2 2.858 CV 1
OR { 92}
(( segid " " and resid 7 and name HG3 ))
(( segid " " and resid 7 and name HE2 ))
OR { 92}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 180}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HA ))
2.400 0.700 0.700 peak 180 spectrum 2 weight 0.10000E+01 volume 0.33333E-02 ppm1 1.835 ppm2 3.994 CV 1
OR { 180}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 90 and name HA ))
ASSI { 486}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 20 and name HB2 ))
2.700 2.700 3.300 peak 486 spectrum 2 weight 0.10000E+01 volume 0.33333E-02 ppm1 1.632 ppm2 2.951 CV 1
OR { 486}
(( segid " " and resid 74 and name HB3 ))
(( segid " " and resid 20 and name HB2 ))
OR { 486}
(( segid " " and resid 53 and name HG ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 2015}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HE2 ))
2.500 0.800 0.800 peak 2015 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 1.907 ppm2 2.990 CV 1
OR { 2015}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HE3 ))
OR { 2015}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 108 and name HE2 ))
OR { 2015}
(( segid " " and resid 108 and name HB3 ))
(( segid " " and resid 108 and name HE3 ))
ASSI { 1880}
(( segid " " and resid 99 and name HG ))
(( segid " " and resid 98 and name HB2 ))
2.700 0.900 0.900 peak 1880 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 1.739 ppm2 2.111 CV 1
OR { 1880}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 89 and name HB2 ))
ASSI { 301}
(( segid " " and resid 5 and name HG12))
(( segid " " and resid 62 and name HA ))
2.400 0.700 0.700 peak 301 spectrum 2 weight 0.10000E+01 volume 0.31930E-02 ppm1 1.229 ppm2 4.352 CV 1
OR { 301}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HA ))
ASSI { 1869}
(( segid " " and resid 101 and name HG2 ))
(( segid " " and resid 101 and name HE2 ))
2.600 0.800 0.800 peak 1869 spectrum 2 weight 0.10000E+01 volume 0.31930E-02 ppm1 1.544 ppm2 3.038 CV 1
OR { 1869}
(( segid " " and resid 101 and name HG2 ))
(( segid " " and resid 101 and name HE3 ))
OR { 1869}
(( segid " " and resid 64 and name HG3 ))
(( segid " " and resid 64 and name HE3 ))
OR { 1869}
(( segid " " and resid 64 and name HG3 ))
(( segid " " and resid 64 and name HE2 ))
ASSI { 60}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HA ))
2.500 0.800 0.800 peak 60 spectrum 2 weight 0.10000E+01 volume 0.32631E-02 ppm1 2.302 ppm2 3.986 CV 1
OR { 60}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 96 and name HA ))
OR { 60}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 35 and name HA ))
OR { 60}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 96 and name HA ))
OR { 60}
(( segid " " and resid 6 and name HG2 ))
(( segid " " and resid 6 and name HA ))
ASSI { 3130}
( segid " " and resid 81 and name HG1%)
(( segid " " and resid 90 and name HB3 ))
2.700 0.900 0.900 peak 3130 spectrum 2 weight 0.10000E+01 volume 0.30670E-02 ppm1 0.671 ppm2 2.889 CV 1
OR { 3130}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 51 and name HB2 ))
OR { 3130}
( segid " " and resid 81 and name HG1%)
(( segid " " and resid 80 and name HA ))
ASSI { 2970}
(( segid " " and resid 73 and name HB2 ))
( segid " " and resid 20 and name HD% )
2.800 1.000 1.000 peak 2970 spectrum 2 weight 0.10000E+01 volume 0.30810E-02 ppm1 2.140 ppm2 6.926 CV 1
OR { 2970}
(( segid " " and resid 19 and name HB3 ))
( segid " " and resid 49 and name HD% )
OR { 2970}
(( segid " " and resid 97 and name HB3 ))
( segid " " and resid 91 and name HD% )
OR { 2970}
(( segid " " and resid 88 and name HB ))
( segid " " and resid 91 and name HD% )
ASSI { 3213}
( segid " " and resid 17 and name HG2%)
( segid " " and resid 103 and name HG2%)
3.000 1.100 1.100 peak 3213 spectrum 2 weight 0.10000E+01 volume 0.32772E-02 ppm1 0.963 ppm2 1.384 CV 1
OR { 3213}
( segid " " and resid 100 and name HG2%)
( segid " " and resid 103 and name HG2%)
OR { 3213}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 74 and name HG ))
OR { 3213}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 74 and name HG ))
ASSI { 2325}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 68 and name HA ))
2.600 2.600 3.400 peak 2325 spectrum 2 weight 0.10000E+01 volume 0.31091E-02 ppm1 4.269 ppm2 4.879 CV 1
OR { 2325}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 68 and name HA ))
ASSI { 2750}
(( segid " " and resid 81 and name HB ))
(( segid " " and resid 80 and name HA ))
2.800 1.000 1.000 peak 2750 spectrum 2 weight 0.10000E+01 volume 0.30810E-02 ppm1 1.569 ppm2 2.898 CV 1
OR { 2750}
(( segid " " and resid 52 and name HG13))
(( segid " " and resid 51 and name HB2 ))
OR { 2750}
(( segid " " and resid 52 and name HG13))
(( segid " " and resid 51 and name HB3 ))
OR { 2750}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 15 and name HB3 ))
ASSI { 2552}
( segid " " and resid 39 and name HB% )
( segid " " and resid 91 and name HD% )
2.600 0.800 0.800 peak 2552 spectrum 2 weight 0.10000E+01 volume 0.32912E-02 ppm1 0.825 ppm2 6.913 CV 1
OR { 2552}
( segid " " and resid 50 and name HG2%)
( segid " " and resid 20 and name HD% )
OR { 2552}
( segid " " and resid 58 and name HG2%)
( segid " " and resid 20 and name HD% )
ASSI { 2723}
( segid " " and resid 39 and name HB% )
(( segid " " and resid 38 and name HA ))
2.700 2.700 3.300 peak 2723 spectrum 2 weight 0.10000E+01 volume 0.33052E-02 ppm1 0.892 ppm2 3.977 CV 1
OR { 2723}
( segid " " and resid 39 and name HB% )
(( segid " " and resid 35 and name HA ))
OR { 2723}
( segid " " and resid 76 and name HG1%)
(( segid " " and resid 96 and name HA ))
OR { 2723}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 29 and name HB3 ))
OR { 2723}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 90 and name HA ))
OR { 2723}
( segid " " and resid 74 and name HD2%)
(( segid " " and resid 96 and name HA ))
ASSI { 2700}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 107 and name HB2 ))
2.900 1.000 1.000 peak 2700 spectrum 2 weight 0.10000E+01 volume 0.31091E-02 ppm1 1.512 ppm2 2.654 CV 1
OR { 2700}
( segid " " and resid 104 and name HB% )
(( segid " " and resid 107 and name HB2 ))
OR { 2700}
(( segid " " and resid 108 and name HG3 ))
(( segid " " and resid 107 and name HB2 ))
ASSI { 2439}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 72 and name HB3 ))
2.700 0.900 0.900 peak 2439 spectrum 2 weight 0.10000E+01 volume 0.31231E-02 ppm1 0.861 ppm2 2.654 CV 1
OR { 2439}
( segid " " and resid 53 and name HD1%)
(( segid " " and resid 72 and name HB3 ))
ASSI { 3187}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 19 and name HG ))
2.800 2.800 3.200 peak 3187 spectrum 2 weight 0.10000E+01 volume 0.31231E-02 ppm1 0.328 ppm2 1.426 CV 1
OR { 3187}
( segid " " and resid 40 and name HD1%)
( segid " " and resid 36 and name HB% )
OR { 3187}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 100 and name HG12))
ASSI { 3375}
(( segid " " and resid 93 and name HG2 ))
( segid " " and resid 91 and name HD% )
2.700 2.700 3.300 peak 3375 spectrum 2 weight 0.10000E+01 volume 0.31231E-02 ppm1 1.759 ppm2 6.905 CV 1
OR { 3375}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 49 and name HD% )
OR { 3375}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 20 and name HD% )
OR { 3375}
(( segid " " and resid 22 and name HB2 ))
( segid " " and resid 20 and name HD% )
OR { 3375}
(( segid " " and resid 22 and name HB3 ))
( segid " " and resid 20 and name HD% )
ASSI { 3334}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 91 and name HB2 ))
2.600 2.600 3.400 peak 3334 spectrum 2 weight 0.10000E+01 volume 0.33473E-02 ppm1 1.740 ppm2 3.057 CV 1
OR { 3334}
(( segid " " and resid 99 and name HG ))
(( segid " " and resid 101 and name HE3 ))
OR { 3334}
(( segid " " and resid 99 and name HG ))
(( segid " " and resid 101 and name HE2 ))
OR { 3334}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 101 and name HE3 ))
OR { 3334}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 101 and name HE2 ))
OR { 3334}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 49 and name HB3 ))
OR { 3334}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 3083}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 110 and name HA ))
2.700 0.900 0.900 peak 3083 spectrum 2 weight 0.10000E+01 volume 0.31231E-02 ppm1 4.116 ppm2 4.356 CV 1
OR { 3083}
(( segid " " and resid 115 and name HA ))
(( segid " " and resid 114 and name HA ))
OR { 3083}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 70 and name HB ))
OR { 3083}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 114 and name HA ))
OR { 3083}
(( segid " " and resid 44 and name HA2 ))
(( segid " " and resid 114 and name HA ))
ASSI { 2928}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 47 and name HD% )
2.700 0.900 0.900 peak 2928 spectrum 2 weight 0.10000E+01 volume 0.31371E-02 ppm1 1.073 ppm2 7.274 CV 1
OR { 2928}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 47 and name HD% )
OR { 2928}
( segid " " and resid 53 and name HD2%)
( segid " " and resid 71 and name HD% )
ASSI { 3067}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 107 and name HA ))
2.700 2.700 3.300 peak 3067 spectrum 2 weight 0.10000E+01 volume 0.31371E-02 ppm1 3.956 ppm2 4.636 CV 1
OR { 3067}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 91 and name HA ))
OR { 3067}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 91 and name HA ))
OR { 3067}
(( segid " " and resid 103 and name HB ))
(( segid " " and resid 17 and name HA ))
OR { 3067}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 91 and name HA ))
ASSI { 3123}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 11 and name HB3 ))
2.500 2.500 3.500 peak 3123 spectrum 2 weight 0.10000E+01 volume 0.31371E-02 ppm1 0.551 ppm2 3.374 CV 1
OR { 3123}
( segid " " and resid 18 and name HD2%)
(( segid " " and resid 8 and name HA ))
OR { 3123}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 87 and name HA ))
OR { 3123}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 91 and name HB3 ))
ASSI { 2692}
(( segid " " and resid 53 and name HG ))
(( segid " " and resid 31 and name HA2 ))
2.600 0.800 0.800 peak 2692 spectrum 2 weight 0.10000E+01 volume 0.31371E-02 ppm1 1.628 ppm2 3.894 CV 1
OR { 2692}
(( segid " " and resid 10 and name HG3 ))
(( segid " " and resid 7 and name HA ))
OR { 2692}
(( segid " " and resid 100 and name HG13))
(( segid " " and resid 40 and name HA ))
OR { 2692}
( segid " " and resid 42 and name HB% )
(( segid " " and resid 40 and name HA ))
ASSI { 3210}
( segid " " and resid 50 and name HG1%)
( segid " " and resid 48 and name HB% )
2.000 2.000 4.000 peak 3210 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 0.480 ppm2 1.283 CV 1
OR { 3210}
( segid " " and resid 50 and name HG1%)
(( segid " " and resid 18 and name HB2 ))
ASSI { 2966}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 71 and name HD% )
2.900 2.900 3.100 peak 2966 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 2.080 ppm2 7.296 CV 1
OR { 2966}
(( segid " " and resid 37 and name HB ))
( segid " " and resid 47 and name HD% )
OR { 2966}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 71 and name HD% )
ASSI { 2679}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 70 and name HA ))
2.600 0.900 0.900 peak 2679 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 4.328 ppm2 4.556 CV 1
OR { 2679}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 113 and name HA ))
OR { 2679}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 61 and name HA ))
OR { 2679}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 61 and name HA ))
ASSI { 2486}
(( segid " " and resid 17 and name HG12))
( segid " " and resid 48 and name HB% )
2.700 2.700 3.300 peak 2486 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 1.075 ppm2 1.279 CV 1
OR { 2486}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 48 and name HB% )
OR { 2486}
(( segid " " and resid 17 and name HG12))
(( segid " " and resid 18 and name HB2 ))
OR { 2486}
( segid " " and resid 19 and name HD2%)
(( segid " " and resid 18 and name HB2 ))
ASSI { 2448}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 84 and name HB2 ))
2.800 1.000 1.000 peak 2448 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 1.420 ppm2 2.665 CV 1
OR { 2448}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 35 and name HB3 ))
OR { 2448}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 72 and name HB3 ))
ASSI { 3139}
(( segid " " and resid 90 and name HG3 ))
(( segid " " and resid 87 and name HA ))
2.800 1.000 1.000 peak 3139 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 2.191 ppm2 3.368 CV 1
OR { 3139}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 87 and name HA ))
OR { 3139}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 11 and name HB3 ))
OR { 3139}
(( segid " " and resid 14 and name HG3 ))
(( segid " " and resid 11 and name HB2 ))
OR { 3139}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 91 and name HB3 ))
OR { 3139}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 87 and name HA ))
OR { 3139}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 91 and name HB3 ))
ASSI { 2741}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 33 and name HB2 ))
2.600 0.900 0.900 peak 2741 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 1.411 ppm2 3.872 CV 1
OR { 2741}
(( segid " " and resid 19 and name HG ))
(( segid " " and resid 33 and name HB2 ))
OR { 2741}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 88 and name HA ))
ASSI { 3081}
(( segid " " and resid 112 and name HD3 ))
(( segid " " and resid 112 and name HA ))
2.600 0.900 0.900 peak 3081 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 3.834 ppm2 4.456 CV 1
OR { 3081}
(( segid " " and resid 44 and name HA1 ))
(( segid " " and resid 43 and name HA ))
OR { 3081}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 43 and name HA ))
ASSI { 3195}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 99 and name HB2 ))
2.500 0.800 0.800 peak 3195 spectrum 2 weight 0.10000E+01 volume 0.31652E-02 ppm1 1.008 ppm2 2.038 CV 1
OR { 3195}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 69 and name HB2 ))
OR { 3195}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 99 and name HB3 ))
ASSI { 2661}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 69 and name HA ))
2.700 0.900 0.900 peak 2661 spectrum 2 weight 0.10000E+01 volume 0.31652E-02 ppm1 1.008 ppm2 4.284 CV 1
OR { 2661}
(( segid " " and resid 80 and name HB3 ))
(( segid " " and resid 66 and name HA ))
ASSI { 2747}
(( segid " " and resid 18 and name HG ))
(( segid " " and resid 75 and name HB2 ))
2.700 0.900 0.900 peak 2747 spectrum 2 weight 0.10000E+01 volume 0.31652E-02 ppm1 0.866 ppm2 2.902 CV 1
OR { 2747}
( segid " " and resid 81 and name HG2%)
(( segid " " and resid 80 and name HA ))
OR { 2747}
( segid " " and resid 74 and name HD2%)
(( segid " " and resid 75 and name HB2 ))
ASSI { 3261}
( segid " " and resid 41 and name HB% )
( segid " " and resid 47 and name HD% )
2.800 1.000 1.000 peak 3261 spectrum 2 weight 0.10000E+01 volume 0.31652E-02 ppm1 1.553 ppm2 7.278 CV 1
OR { 3261}
(( segid " " and resid 52 and name HG13))
( segid " " and resid 71 and name HD% )
ASSI { 2752}
(( segid " " and resid 88 and name HG12))
(( segid " " and resid 90 and name HB2 ))
2.500 2.500 3.500 peak 2752 spectrum 2 weight 0.10000E+01 volume 0.31792E-02 ppm1 1.453 ppm2 2.472 CV 1
OR { 2752}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 90 and name HB2 ))
ASSI { 2761}
( segid " " and resid 76 and name HG1%)
( segid " " and resid 17 and name HD1%)
2.700 0.900 0.900 peak 2761 spectrum 2 weight 0.10000E+01 volume 0.31792E-02 ppm1 0.870 ppm2 1.738 CV 1
OR { 2761}
( segid " " and resid 53 and name HD1%)
(( segid " " and resid 22 and name HB2 ))
OR { 2761}
( segid " " and resid 53 and name HD1%)
(( segid " " and resid 59 and name HB2 ))
ASSI { 3388}
( segid " " and resid 81 and name HG2%)
(( segid " " and resid 75 and name HA ))
2.700 0.900 0.900 peak 3388 spectrum 2 weight 0.10000E+01 volume 0.31792E-02 ppm1 0.826 ppm2 5.073 CV 1
OR { 3388}
( segid " " and resid 53 and name HD1%)
(( segid " " and resid 21 and name HA ))
ASSI { 3159}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 72 and name HB2 ))
2.700 0.900 0.900 peak 3159 spectrum 2 weight 0.10000E+01 volume 0.31930E-02 ppm1 1.451 ppm2 2.202 CV 1
OR { 3159}
(( segid " " and resid 12 and name HB ))
(( segid " " and resid 9 and name HG2 ))
OR { 3159}
( segid " " and resid 13 and name HB% )
(( segid " " and resid 14 and name HG3 ))
OR { 3159}
(( segid " " and resid 8 and name HB ))
(( segid " " and resid 9 and name HG2 ))
OR { 3159}
( segid " " and resid 36 and name HB% )
(( segid " " and resid 21 and name HB3 ))
OR { 3159}
( segid " " and resid 13 and name HB% )
(( segid " " and resid 9 and name HG2 ))
OR { 3159}
(( segid " " and resid 5 and name HG13))
(( segid " " and resid 9 and name HG2 ))
ASSI { 3265}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 107 and name HE% )
2.600 0.900 0.900 peak 3265 spectrum 2 weight 0.10000E+01 volume 0.31930E-02 ppm1 1.912 ppm2 6.790 CV 1
OR { 3265}
(( segid " " and resid 28 and name HB2 ))
( segid " " and resid 49 and name HE% )
ASSI { 2743}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 75 and name HB2 ))
2.600 0.900 0.900 peak 2743 spectrum 2 weight 0.10000E+01 volume 0.32070E-02 ppm1 0.823 ppm2 2.893 CV 1
OR { 2743}
( segid " " and resid 81 and name HG2%)
(( segid " " and resid 80 and name HA ))
OR { 2743}
( segid " " and resid 86 and name HG2%)
(( segid " " and resid 90 and name HB3 ))
ASSI { 2667}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 61 and name HA ))
2.700 2.700 3.300 peak 2667 spectrum 2 weight 0.10000E+01 volume 0.32070E-02 ppm1 1.512 ppm2 4.555 CV 1
OR { 2667}
( segid " " and resid 104 and name HB% )
(( segid " " and resid 113 and name HA ))
OR { 2667}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 63 and name HA ))
OR { 2667}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 70 and name HA ))
OR { 2667}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 70 and name HA ))
ASSI { 2697}
( segid " " and resid 48 and name HB% )
(( segid " " and resid 15 and name HB3 ))
2.900 1.000 1.000 peak 2697 spectrum 2 weight 0.10000E+01 volume 0.32070E-02 ppm1 1.280 ppm2 2.914 CV 1
OR { 2697}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 75 and name HB2 ))
ASSI { 3089}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 78 and name HA2 ))
2.900 2.900 3.100 peak 3089 spectrum 2 weight 0.10000E+01 volume 0.30112E-02 ppm1 3.492 ppm2 4.278 CV 1
OR { 3089}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 103 and name HA ))
OR { 3089}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 78 and name HA2 ))
ASSI { 3012}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 49 and name HA ))
2.700 2.700 3.300 peak 3012 spectrum 2 weight 0.10000E+01 volume 0.30249E-02 ppm1 0.983 ppm2 5.833 CV 1
OR { 3012}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 49 and name HA ))
ASSI { 3100}
( segid " " and resid 76 and name HG1%)
(( segid " " and resid 79 and name HA ))
2.700 2.700 3.300 peak 3100 spectrum 2 weight 0.10000E+01 volume 0.30249E-02 ppm1 0.890 ppm2 4.792 CV 1
OR { 3100}
( segid " " and resid 74 and name HD2%)
(( segid " " and resid 79 and name HA ))
OR { 3100}
(( segid " " and resid 18 and name HG ))
(( segid " " and resid 79 and name HA ))
ASSI { 3037}
( segid " " and resid 50 and name HG2%)
(( segid " " and resid 18 and name HA ))
2.400 2.400 3.600 peak 3037 spectrum 2 weight 0.10000E+01 volume 0.30249E-02 ppm1 0.786 ppm2 4.986 CV 1
OR { 3037}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 18 and name HA ))
ASSI { 2305}
(( segid " " and resid 88 and name HB ))
(( segid " " and resid 85 and name HA ))
2.500 0.800 0.800 peak 2305 spectrum 2 weight 0.10000E+01 volume 0.32351E-02 ppm1 2.150 ppm2 4.307 CV 1
OR { 2305}
(( segid " " and resid 98 and name HB3 ))
(( segid " " and resid 99 and name HA ))
ASSI { 2465}
(( segid " " and resid 22 and name HB3 ))
(( segid " " and resid 21 and name HB3 ))
2.800 2.800 3.200 peak 2465 spectrum 2 weight 0.10000E+01 volume 0.32351E-02 ppm1 1.723 ppm2 2.218 CV 1
OR { 2465}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 21 and name HB3 ))
OR { 2465}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 102 and name HB3 ))
OR { 2465}
(( segid " " and resid 99 and name HG ))
(( segid " " and resid 102 and name HB3 ))
OR { 2465}
(( segid " " and resid 88 and name HG13))
(( segid " " and resid 89 and name HB3 ))
OR { 2465}
(( segid " " and resid 22 and name HB2 ))
(( segid " " and resid 72 and name HB2 ))
ASSI { 2955}
(( segid " " and resid 79 and name HB2 ))
(( segid " " and resid 75 and name HE3 ))
2.900 1.100 1.100 peak 2955 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 1.879 ppm2 7.033 CV 1
OR { 2955}
(( segid " " and resid 79 and name HB3 ))
(( segid " " and resid 75 and name HE3 ))
OR { 2955}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 75 and name HE3 ))
ASSI { 3072}
(( segid " " and resid 94 and name HA2 ))
(( segid " " and resid 91 and name HA ))
2.800 2.800 3.200 peak 3072 spectrum 2 weight 0.10000E+01 volume 0.30389E-02 ppm1 4.196 ppm2 4.636 CV 1
OR { 3072}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 107 and name HA ))
ASSI { 3108}
( segid " " and resid 53 and name HD1%)
(( segid " " and resid 22 and name HA ))
2.900 1.000 1.000 peak 3108 spectrum 2 weight 0.10000E+01 volume 0.30389E-02 ppm1 0.872 ppm2 4.504 CV 1
OR { 3108}
( segid " " and resid 76 and name HG1%)
(( segid " " and resid 77 and name HA ))
ASSI { 3107}
( segid " " and resid 58 and name HD1%)
(( segid " " and resid 57 and name HA ))
2.500 2.500 3.500 peak 3107 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 0.964 ppm2 4.452 CV 1
OR { 3107}
( segid " " and resid 100 and name HG2%)
(( segid " " and resid 112 and name HA ))
OR { 3107}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 43 and name HA ))
OR { 3107}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 43 and name HA ))
OR { 3107}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 43 and name HA ))
ASSI { 2926}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 49 and name HE% )
2.800 2.800 3.200 peak 2926 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 1.012 ppm2 6.788 CV 1
OR { 2926}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 107 and name HE% )
ASSI { 3039}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 51 and name HA ))
2.800 2.800 3.200 peak 3039 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 1.508 ppm2 5.513 CV 1
OR { 3039}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 51 and name HA ))
ASSI { 3008}
( segid " " and resid 20 and name HD% )
(( segid " " and resid 71 and name HZ ))
2.500 0.800 0.800 peak 3008 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 6.933 ppm2 7.394 CV 1
OR { 3008}
( segid " " and resid 65 and name HD% )
(( segid " " and resid 75 and name HZ2 ))
ASSI { 3141}
(( segid " " and resid 89 and name HG2 ))
(( segid " " and resid 93 and name HD2 ))
2.800 1.000 1.000 peak 3141 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 2.279 ppm2 3.185 CV 1
OR { 3141}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 69 and name HD2 ))
ASSI { 3075}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 22 and name HA ))
2.700 2.700 3.300 peak 3075 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 4.170 ppm2 4.513 CV 1
OR { 3075}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 77 and name HA ))
OR { 3075}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 109 and name HA ))
ASSI { 2927}
( segid " " and resid 17 and name HG2%)
( segid " " and resid 107 and name HE% )
3.200 3.200 2.800 peak 2927 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 0.996 ppm2 6.789 CV 1
OR { 2927}
( segid " " and resid 100 and name HG2%)
( segid " " and resid 107 and name HE% )
OR { 2927}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 107 and name HE% )
ASSI { 2957}
(( segid " " and resid 28 and name HG3 ))
( segid " " and resid 49 and name HD% )
2.500 2.500 3.500 peak 2957 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 1.812 ppm2 6.911 CV 1
OR { 2957}
(( segid " " and resid 28 and name HG2 ))
( segid " " and resid 49 and name HD% )
OR { 2957}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 20 and name HD% )
OR { 2957}
(( segid " " and resid 93 and name HB2 ))
( segid " " and resid 91 and name HD% )
ASSI { 3071}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HA ))
2.600 2.600 3.400 peak 3071 spectrum 2 weight 0.10000E+01 volume 0.30530E-02 ppm1 4.131 ppm2 4.577 CV 1
OR { 3071}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 70 and name HA ))
OR { 3071}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 71 and name HA ))
ASSI { 2792}
(( segid " " and resid 18 and name HG ))
( segid " " and resid 20 and name HD% )
2.500 0.800 0.800 peak 2792 spectrum 2 weight 0.10000E+01 volume 0.32631E-02 ppm1 0.866 ppm2 6.910 CV 1
OR { 2792}
( segid " " and resid 39 and name HB% )
( segid " " and resid 91 and name HD% )
ASSI { 3082}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 99 and name HA ))
2.700 2.700 3.300 peak 3082 spectrum 2 weight 0.10000E+01 volume 0.30670E-02 ppm1 4.078 ppm2 4.316 CV 1
OR { 3082}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 99 and name HA ))
ASSI { 729}
(( segid " " and resid 93 and name HG2 ))
(( segid " " and resid 93 and name HD2 ))
2.500 0.800 0.800 peak 729 spectrum 2 weight 0.10000E+01 volume 0.32772E-02 ppm1 1.799 ppm2 3.200 CV 1
OR { 729}
(( segid " " and resid 46 and name HB3 ))
(( segid " " and resid 46 and name HD2 ))
ASSI { 925}
(( segid " " and resid 99 and name HB3 ))
(( segid " " and resid 99 and name HA ))
2.500 0.800 0.800 peak 925 spectrum 2 weight 0.10000E+01 volume 0.33052E-02 ppm1 2.058 ppm2 4.300 CV 1
OR { 925}
(( segid " " and resid 99 and name HB2 ))
(( segid " " and resid 99 and name HA ))
OR { 925}
(( segid " " and resid 56 and name HG3 ))
(( segid " " and resid 56 and name HA ))
ASSI { 1136}
(( segid " " and resid 69 and name HD3 ))
(( segid " " and resid 69 and name HA ))
2.800 0.900 0.900 peak 1136 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 3.183 ppm2 4.269 CV 1
OR { 1136}
(( segid " " and resid 69 and name HD2 ))
(( segid " " and resid 69 and name HA ))
OR { 1136}
(( segid " " and resid 75 and name HB3 ))
(( segid " " and resid 78 and name HA2 ))
ASSI { 1029}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 64 and name HE2 ))
2.800 1.000 1.000 peak 1029 spectrum 2 weight 0.10000E+01 volume 0.31930E-02 ppm1 1.486 ppm2 3.038 CV 1
OR { 1029}
(( segid " " and resid 64 and name HG2 ))
(( segid " " and resid 64 and name HE3 ))
OR { 1029}
(( segid " " and resid 5 and name HG13))
(( segid " " and resid 65 and name HB2 ))
ASSI { 3393}
(( segid " " and resid 101 and name HE3 ))
(( segid " " and resid 99 and name HA ))
2.500 2.500 3.500 peak 3393 spectrum 2 weight 0.10000E+01 volume 0.30810E-02 ppm1 3.023 ppm2 4.298 CV 1
OR { 3393}
(( segid " " and resid 101 and name HE2 ))
(( segid " " and resid 99 and name HA ))
OR { 3393}
(( segid " " and resid 65 and name HB2 ))
(( segid " " and resid 67 and name HA ))
OR { 3393}
(( segid " " and resid 101 and name HE3 ))
(( segid " " and resid 103 and name HA ))
ASSI { 2783}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 64 and name HD3 ))
2.100 2.100 3.900 peak 2783 spectrum 2 weight 0.10000E+01 volume 0.31930E-02 ppm1 1.017 ppm2 1.795 CV 1
OR { 2783}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 64 and name HD2 ))
OR { 2783}
( segid " " and resid 19 and name HD2%)
(( segid " " and resid 46 and name HB3 ))
OR { 2783}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 46 and name HB3 ))
OR { 2783}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 46 and name HB3 ))
ASSI { 2781}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 12 and name HG13))
2.500 0.800 0.800 peak 2781 spectrum 2 weight 0.10000E+01 volume 0.32070E-02 ppm1 0.272 ppm2 1.581 CV 1
OR { 2781}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 62 and name HB3 ))
OR { 2781}
( segid " " and resid 8 and name HG2%)
(( segid " " and resid 8 and name HG12))
ASSI { 2022}
(( segid " " and resid 108 and name HD3 ))
(( segid " " and resid 108 and name HA ))
2.600 0.900 0.900 peak 2022 spectrum 2 weight 0.10000E+01 volume 0.32210E-02 ppm1 1.725 ppm2 4.358 CV 1
OR { 2022}
(( segid " " and resid 108 and name HD2 ))
(( segid " " and resid 108 and name HA ))
OR { 2022}
( segid " " and resid 17 and name HD1%)
(( segid " " and resid 16 and name HA ))
ASSI { 3437}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 49 and name HD% )
2.800 2.800 3.200 peak 3437 spectrum 2 weight 0.10000E+01 volume 0.30951E-02 ppm1 2.084 ppm2 6.924 CV 1
OR { 3437}
(( segid " " and resid 89 and name HB2 ))
( segid " " and resid 91 and name HD% )
OR { 3437}
(( segid " " and resid 37 and name HB ))
( segid " " and resid 49 and name HD% )
OR { 3437}
(( segid " " and resid 21 and name HB2 ))
( segid " " and resid 20 and name HD% )
OR { 3437}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 20 and name HD% )
ASSI { 3455}
( segid " " and resid 100 and name HG2%)
(( segid " " and resid 104 and name HA ))
2.900 1.000 1.000 peak 3455 spectrum 2 weight 0.10000E+01 volume 0.30670E-02 ppm1 0.992 ppm2 4.205 CV 1
OR { 3455}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 41 and name HA ))
OR { 3455}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 104 and name HA ))
ASSI { 3459}
( segid " " and resid 39 and name HB% )
(( segid " " and resid 88 and name HA ))
2.600 0.800 0.800 peak 3459 spectrum 2 weight 0.10000E+01 volume 0.32351E-02 ppm1 0.871 ppm2 3.871 CV 1
OR { 3459}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 82 and name HA2 ))
OR { 3459}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 33 and name HB2 ))
ASSI { 3460}
( segid " " and resid 86 and name HD1%)
(( segid " " and resid 86 and name HA ))
2.500 0.800 0.800 peak 3460 spectrum 2 weight 0.10000E+01 volume 0.32912E-02 ppm1 0.872 ppm2 3.950 CV 1
OR { 3460}
( segid " " and resid 39 and name HB% )
(( segid " " and resid 36 and name HA ))
OR { 3460}
( segid " " and resid 76 and name HG1%)
(( segid " " and resid 103 and name HB ))
ASSI { 3465}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 52 and name HA ))
2.800 1.000 1.000 peak 3465 spectrum 2 weight 0.10000E+01 volume 0.31792E-02 ppm1 1.697 ppm2 3.927 CV 1
OR { 3465}
(( segid " " and resid 88 and name HG13))
(( segid " " and resid 36 and name HA ))
ASSI { 3466}
(( segid " " and resid 101 and name HB2 ))
(( segid " " and resid 98 and name HA ))
2.700 0.900 0.900 peak 3466 spectrum 2 weight 0.10000E+01 volume 0.31930E-02 ppm1 1.940 ppm2 4.078 CV 1
OR { 3466}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 44 and name HA2 ))
OR { 3466}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 98 and name HA ))
ASSI { 3470}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 56 and name HD3 ))
3.100 1.200 1.200 peak 3470 spectrum 2 weight 0.10000E+01 volume 0.31652E-02 ppm1 2.512 ppm2 3.902 CV 1
OR { 3470}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 52 and name HA ))
ASSI { 3471}
(( segid " " and resid 43 and name HB2 ))
(( segid " " and resid 92 and name HA ))
2.600 2.600 3.400 peak 3471 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 2.837 ppm2 3.924 CV 1
OR { 3471}
(( segid " " and resid 106 and name HE3 ))
(( segid " " and resid 103 and name HB ))
OR { 3471}
(( segid " " and resid 106 and name HE2 ))
(( segid " " and resid 103 and name HB ))
OR { 3471}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 52 and name HA ))
OR { 3471}
(( segid " " and resid 43 and name HB2 ))
(( segid " " and resid 36 and name HA ))
ASSI { 3480}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 91 and name HB2 ))
2.800 2.800 3.200 peak 3480 spectrum 2 weight 0.10000E+01 volume 0.31231E-02 ppm1 0.971 ppm2 3.058 CV 1
OR { 3480}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 91 and name HB2 ))
OR { 3480}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 49 and name HB3 ))
OR { 3480}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 49 and name HB3 ))
ASSI { 3484}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 90 and name HB3 ))
2.500 0.800 0.800 peak 3484 spectrum 2 weight 0.10000E+01 volume 0.31512E-02 ppm1 2.006 ppm2 2.861 CV 1
OR { 3484}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HE3 ))
OR { 3484}
(( segid " " and resid 7 and name HB3 ))
(( segid " " and resid 7 and name HE2 ))
OR { 3484}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 90 and name HB3 ))
ASSI { 3486}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 55 and name HB2 ))
2.500 0.800 0.800 peak 3486 spectrum 2 weight 0.10000E+01 volume 0.32210E-02 ppm1 0.716 ppm2 2.314 CV 1
OR { 3486}
( segid " " and resid 88 and name HD1%)
(( segid " " and resid 35 and name HB2 ))
ASSI { 3488}
( segid " " and resid 17 and name HG2%)
(( segid " " and resid 16 and name HB2 ))
2.900 2.900 3.100 peak 3488 spectrum 2 weight 0.10000E+01 volume 0.32210E-02 ppm1 0.993 ppm2 1.516 CV 1
OR { 3488}
( segid " " and resid 100 and name HG2%)
(( segid " " and resid 16 and name HB2 ))
OR { 3488}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 52 and name HB ))
ASSI { 360}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 106 and name HD3 ))
2.700 0.900 0.900 peak 360 spectrum 3 weight 0.10000E+01 volume 0.44156E-02 ppm1 7.239 ppm2 1.715 CV 1
OR { 360}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HD3 ))
OR { 360}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HD2 ))
ASSI { 1999}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 91 and name HN ))
3.600 1.600 1.600 peak 1999 spectrum 3 weight 0.10000E+01 volume 0.76258E-03 ppm1 8.017 ppm2 8.731 CV 1
OR { 1999}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 92 and name HN ))
ASSI { 1991}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 75 and name HD1 ))
3.500 1.500 1.500 peak 1991 spectrum 3 weight 0.10000E+01 volume 0.96947E-03 ppm1 9.265 ppm2 7.258 CV 1
OR { 1991}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 71 and name HD% )
ASSI { 52}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HB2 ))
2.200 0.600 0.600 peak 52 spectrum 3 weight 0.10000E+01 volume 0.11246E-01 ppm1 7.853 ppm2 1.804 CV 1
OR { 52}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HB2 ))
OR { 52}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 10 and name HB3 ))
ASSI { 500}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 89 and name HB3 ))
2.500 0.800 0.800 peak 500 spectrum 3 weight 0.10000E+01 volume 0.39436E-02 ppm1 8.845 ppm2 2.167 CV 1
OR { 500}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 90 and name HG2 ))
ASSI { 1174}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 86 and name HN ))
4.000 2.000 2.000 peak 1174 spectrum 3 weight 0.10000E+01 volume 0.42566E-03 ppm1 8.788 ppm2 7.785 CV 1
OR { 1174}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 87 and name HN ))
ASSI { 1203}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 96 and name HD2%)
4.200 2.300 1.800 peak 1203 spectrum 3 weight 0.10000E+01 volume 0.45191E-03 ppm1 7.608 ppm2 0.952 CV 1
OR { 1203}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 100 and name HG2%)
OR { 1203}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 1223}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 52 and name HB ))
4.600 2.600 1.400 peak 1223 spectrum 3 weight 0.10000E+01 volume 0.47497E-03 ppm1 9.435 ppm2 1.489 CV 1
OR { 1223}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 53 and name HB2 ))
ASSI { 1243}
(( segid " " and resid 102 and name HN ))
( segid " " and resid 114 and name HB% )
4.800 2.900 1.200 peak 1243 spectrum 3 weight 0.10000E+01 volume 0.50402E-03 ppm1 8.539 ppm2 1.383 CV 1
OR { 1243}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 19 and name HG ))
ASSI { 1254}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 87 and name HG2%)
4.300 2.300 1.700 peak 1254 spectrum 3 weight 0.10000E+01 volume 0.51358E-03 ppm1 8.263 ppm2 0.794 CV 1
OR { 1254}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 86 and name HG2%)
OR { 1254}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 87 and name HG1%)
ASSI { 1272}
(( segid " " and resid 98 and name HN ))
( segid " " and resid 76 and name HG1%)
4.100 2.100 1.900 peak 1272 spectrum 3 weight 0.10000E+01 volume 0.54220E-03 ppm1 6.792 ppm2 0.844 CV 1
OR { 1272}
(( segid " " and resid 98 and name HN ))
( segid " " and resid 81 and name HG2%)
ASSI { 1290}
(( segid " " and resid 55 and name HN ))
( segid " " and resid 58 and name HG2%)
4.500 2.500 1.500 peak 1290 spectrum 3 weight 0.10000E+01 volume 0.56368E-03 ppm1 6.985 ppm2 0.813 CV 1
OR { 1290}
(( segid " " and resid 55 and name HN ))
( segid " " and resid 53 and name HD1%)
ASSI { 1333}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 47 and name HB2 ))
4.300 2.300 1.700 peak 1333 spectrum 3 weight 0.10000E+01 volume 0.62693E-03 ppm1 7.837 ppm2 2.797 CV 1
OR { 1333}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 43 and name HB2 ))
ASSI { 1398}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 95 and name HB2 ))
4.100 2.100 1.900 peak 1398 spectrum 3 weight 0.10000E+01 volume 0.73555E-03 ppm1 8.745 ppm2 1.999 CV 1
OR { 1398}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 93 and name HG3 ))
ASSI { 1412}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 39 and name HB% )
4.000 2.000 2.000 peak 1412 spectrum 3 weight 0.10000E+01 volume 0.78290E-03 ppm1 8.022 ppm2 0.836 CV 1
OR { 1412}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 19 and name HD1%)
ASSI { 1425}
(( segid " " and resid 89 and name HN ))
( segid " " and resid 88 and name HD1%)
4.000 2.000 2.000 peak 1425 spectrum 3 weight 0.10000E+01 volume 0.82467E-03 ppm1 8.016 ppm2 0.791 CV 1
OR { 1425}
(( segid " " and resid 89 and name HN ))
( segid " " and resid 86 and name HG2%)
OR { 1425}
(( segid " " and resid 89 and name HN ))
( segid " " and resid 87 and name HG1%)
ASSI { 1494}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 87 and name HA ))
3.700 1.700 1.700 peak 1494 spectrum 3 weight 0.10000E+01 volume 0.96269E-03 ppm1 8.845 ppm2 3.331 CV 1
OR { 1494}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 91 and name HB3 ))
ASSI { 1972}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 96 and name HD1%)
3.800 1.800 1.800 peak 1972 spectrum 3 weight 0.10000E+01 volume 0.11469E-02 ppm1 8.431 ppm2 0.960 CV 1
OR { 1972}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 76 and name HG2%)
OR { 1972}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 96 and name HD2%)
OR { 1972}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 99 and name HD1%)
ASSI { 1526}
(( segid " " and resid 97 and name HN ))
( segid " " and resid 39 and name HB% )
2.900 2.900 3.100 peak 1526 spectrum 3 weight 0.10000E+01 volume 0.11552E-02 ppm1 11.408 ppm2 0.828 CV 1
OR { 1526}
(( segid " " and resid 97 and name HN ))
( segid " " and resid 81 and name HG2%)
ASSI { 1020}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HG2 ))
3.700 1.700 1.700 peak 1020 spectrum 3 weight 0.10000E+01 volume 0.11680E-02 ppm1 8.745 ppm2 2.167 CV 1
OR { 1020}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 89 and name HB3 ))
OR { 1020}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 92 and name HB2 ))
OR { 1020}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HG3 ))
ASSI { 1532}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 100 and name HG12))
3.800 1.800 1.800 peak 1532 spectrum 3 weight 0.10000E+01 volume 0.11791E-02 ppm1 8.202 ppm2 1.426 CV 1
OR { 1532}
(( segid " " and resid 101 and name HN ))
( segid " " and resid 104 and name HB% )
ASSI { 1558}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 103 and name HB ))
3.800 1.800 1.800 peak 1558 spectrum 3 weight 0.10000E+01 volume 0.13227E-02 ppm1 7.727 ppm2 3.918 CV 1
OR { 1558}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 106 and name HA ))
ASSI { 1568}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 62 and name HA ))
3.600 1.600 1.600 peak 1568 spectrum 3 weight 0.10000E+01 volume 0.13756E-02 ppm1 7.235 ppm2 4.328 CV 1
OR { 1568}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 60 and name HA ))
OR { 1568}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 108 and name HA ))
ASSI { 1597}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 37 and name HG2%)
3.600 1.600 1.600 peak 1597 spectrum 3 weight 0.10000E+01 volume 0.15817E-02 ppm1 7.150 ppm2 1.037 CV 1
OR { 1597}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 40 and name HG ))
ASSI { 1600}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 95 and name HB2 ))
3.900 1.900 1.900 peak 1600 spectrum 3 weight 0.10000E+01 volume 0.15884E-02 ppm1 7.634 ppm2 1.990 CV 1
OR { 1600}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 93 and name HG3 ))
ASSI { 1692}
(( segid " " and resid 103 and name HN ))
( segid " " and resid 17 and name HD1%)
5.000 3.200 1.000 peak 1692 spectrum 3 weight 0.10000E+01 volume 0.24147E-03 ppm1 8.141 ppm2 1.684 CV 1
OR { 1692}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 101 and name HG3 ))
ASSI { 1720}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 53 and name HN ))
4.700 2.700 1.300 peak 1720 spectrum 3 weight 0.10000E+01 volume 0.26374E-03 ppm1 9.435 ppm2 9.057 CV 1
OR { 1720}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 73 and name HN ))
ASSI { 1737}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 54 and name HG2 ))
5.400 3.600 0.600 peak 1737 spectrum 3 weight 0.10000E+01 volume 0.27449E-03 ppm1 8.876 ppm2 2.430 CV 1
OR { 1737}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 53 and name HB3 ))
ASSI { 1926}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 36 and name HB% )
4.400 2.400 1.600 peak 1926 spectrum 3 weight 0.10000E+01 volume 0.37194E-03 ppm1 7.678 ppm2 1.402 CV 1
OR { 1926}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 114 and name HB% )
ASSI { 2032}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 76 and name HG1%)
4.000 2.000 2.000 peak 2032 spectrum 3 weight 0.10000E+01 volume 0.82902E-03 ppm1 7.728 ppm2 0.854 CV 1
OR { 2032}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HG ))
OR { 2032}
(( segid " " and resid 54 and name HE22))
( segid " " and resid 53 and name HD1%)
Contact the webmaster for help, if required. Friday, May 10, 2024 1:31:14 PM GMT (wattos1)