Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
6442 | 1j2o RC | 5100 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 2}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HN ))
2.600 0.800 0.800 peak 2 spectrum 1 weight 0.10000E+01 volume 0.21363E-02 ppm1 3.554 ppm2 10.054 CV 1
ASSI { 3}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 22 and name HD1%)
2.400 2.400 3.600 peak 3 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 3.550 ppm2 0.598 CV 1
ASSI { 4}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 22 and name HG2%)
2.600 0.800 0.800 peak 4 spectrum 1 weight 0.10000E+01 volume 0.20781E-02 ppm1 3.554 ppm2 0.493 CV 1
ASSI { 9}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HN ))
2.500 0.800 0.800 peak 9 spectrum 1 weight 0.10000E+01 volume 0.25053E-02 ppm1 4.591 ppm2 9.666 CV 1
ASSI { 10}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HN ))
2.600 0.800 0.800 peak 10 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 3.882 ppm2 9.466 CV 1
ASSI { 12}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB2 ))
2.500 0.800 0.800 peak 12 spectrum 1 weight 0.10000E+01 volume 0.25345E-02 ppm1 3.887 ppm2 1.798 CV 1
ASSI { 13}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HN ))
2.400 2.400 3.600 peak 13 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 1.789 ppm2 9.463 CV 1
ASSI { 14}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HN ))
2.600 0.800 0.800 peak 14 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 4.506 ppm2 8.542 CV 1
ASSI { 15}
(( segid " " and resid 70 and name HG2 ))
(( segid " " and resid 70 and name HN ))
2.400 0.700 0.700 peak 15 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 2.567 ppm2 8.536 CV 1
ASSI { 16}
(( segid " " and resid 70 and name HG3 ))
(( segid " " and resid 70 and name HN ))
2.400 0.700 0.700 peak 16 spectrum 1 weight 0.10000E+01 volume 0.34278E-02 ppm1 2.492 ppm2 8.535 CV 1
ASSI { 17}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HN ))
2.400 0.700 0.700 peak 17 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 2.093 ppm2 8.539 CV 1
ASSI { 18}
(( segid " " and resid 70 and name HB3 ))
(( segid " " and resid 70 and name HN ))
2.500 2.500 3.500 peak 18 spectrum 1 weight 0.10000E+01 volume 0.24471E-02 ppm1 2.003 ppm2 8.542 CV 1
ASSI { 19}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HN ))
2.400 0.700 0.700 peak 19 spectrum 1 weight 0.10000E+01 volume 0.34570E-02 ppm1 5.874 ppm2 9.353 CV 1
ASSI { 20}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HN ))
2.300 0.700 0.700 peak 20 spectrum 1 weight 0.10000E+01 volume 0.40785E-02 ppm1 6.094 ppm2 9.346 CV 1
ASSI { 21}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HN ))
2.400 0.700 0.700 peak 21 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 5.568 ppm2 9.302 CV 1
ASSI { 23}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HN ))
2.400 0.700 0.700 peak 23 spectrum 1 weight 0.10000E+01 volume 0.34570E-02 ppm1 5.667 ppm2 9.140 CV 1
ASSI { 24}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HN ))
2.400 0.700 0.700 peak 24 spectrum 1 weight 0.10000E+01 volume 0.30297E-02 ppm1 5.120 ppm2 9.162 CV 1
ASSI { 25}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HN ))
2.400 0.700 0.700 peak 25 spectrum 1 weight 0.10000E+01 volume 0.28841E-02 ppm1 4.673 ppm2 9.132 CV 1
ASSI { 26}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HN ))
2.500 0.800 0.800 peak 26 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 4.673 ppm2 9.067 CV 1
ASSI { 28}
( segid " " and resid 21 and name HB% )
(( segid " " and resid 21 and name HN ))
2.400 0.700 0.700 peak 28 spectrum 1 weight 0.10000E+01 volume 0.35735E-02 ppm1 1.137 ppm2 9.131 CV 1
ASSI { 29}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HN ))
2.500 0.800 0.800 peak 29 spectrum 1 weight 0.10000E+01 volume 0.23305E-02 ppm1 4.253 ppm2 8.995 CV 1
ASSI { 31}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HN ))
2.500 0.800 0.800 peak 31 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 4.669 ppm2 8.860 CV 1
ASSI { 32}
(( segid " " and resid 98 and name HB ))
(( segid " " and resid 98 and name HN ))
2.400 2.400 3.600 peak 32 spectrum 1 weight 0.10000E+01 volume 0.29229E-02 ppm1 3.961 ppm2 8.893 CV 1
ASSI { 33}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HN ))
2.500 0.800 0.800 peak 33 spectrum 1 weight 0.10000E+01 volume 0.26219E-02 ppm1 4.581 ppm2 8.888 CV 1
ASSI { 34}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HN ))
2.400 0.700 0.700 peak 34 spectrum 1 weight 0.10000E+01 volume 0.29035E-02 ppm1 4.566 ppm2 8.873 CV 1
ASSI { 36}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HN ))
2.500 0.800 0.800 peak 36 spectrum 1 weight 0.10000E+01 volume 0.26510E-02 ppm1 4.017 ppm2 8.831 CV 1
ASSI { 39}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 95 and name HN ))
2.500 0.800 0.800 peak 39 spectrum 1 weight 0.10000E+01 volume 0.25345E-02 ppm1 4.693 ppm2 8.737 CV 1
ASSI { 40}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 99 and name HN ))
2.500 0.800 0.800 peak 40 spectrum 1 weight 0.10000E+01 volume 0.23111E-02 ppm1 4.834 ppm2 8.837 CV 1
ASSI { 41}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HN ))
2.300 0.700 0.700 peak 41 spectrum 1 weight 0.10000E+01 volume 0.36221E-02 ppm1 5.056 ppm2 8.818 CV 1
ASSI { 43}
( segid " " and resid 98 and name HG2%)
(( segid " " and resid 98 and name HN ))
2.400 0.700 0.700 peak 43 spectrum 1 weight 0.10000E+01 volume 0.30588E-02 ppm1 1.202 ppm2 8.892 CV 1
ASSI { 44}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HB ))
2.400 0.700 0.700 peak 44 spectrum 1 weight 0.10000E+01 volume 0.30491E-02 ppm1 4.579 ppm2 3.963 CV 1
ASSI { 45}
(( segid " " and resid 98 and name HB ))
( segid " " and resid 98 and name HG2%)
2.600 0.800 0.800 peak 45 spectrum 1 weight 0.10000E+01 volume 0.21072E-02 ppm1 3.963 ppm2 1.203 CV 1
ASSI { 46}
(( segid " " and resid 98 and name HA ))
( segid " " and resid 98 and name HG2%)
2.600 0.800 0.800 peak 46 spectrum 1 weight 0.10000E+01 volume 0.21363E-02 ppm1 4.585 ppm2 1.207 CV 1
ASSI { 50}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 35 and name HN ))
2.500 0.800 0.800 peak 50 spectrum 1 weight 0.10000E+01 volume 0.23111E-02 ppm1 1.410 ppm2 9.066 CV 1
ASSI { 53}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HN ))
2.500 0.800 0.800 peak 53 spectrum 1 weight 0.10000E+01 volume 0.26704E-02 ppm1 4.802 ppm2 9.328 CV 1
ASSI { 54}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HN ))
2.400 0.700 0.700 peak 54 spectrum 1 weight 0.10000E+01 volume 0.33987E-02 ppm1 4.600 ppm2 8.838 CV 1
ASSI { 55}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HN ))
2.500 0.800 0.800 peak 55 spectrum 1 weight 0.10000E+01 volume 0.26219E-02 ppm1 4.653 ppm2 8.861 CV 1
ASSI { 58}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HN ))
2.400 0.700 0.700 peak 58 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 4.169 ppm2 8.781 CV 1
ASSI { 59}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HN ))
2.400 0.700 0.700 peak 59 spectrum 1 weight 0.10000E+01 volume 0.34570E-02 ppm1 4.925 ppm2 8.730 CV 1
ASSI { 60}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HN ))
2.500 0.800 0.800 peak 60 spectrum 1 weight 0.10000E+01 volume 0.26510E-02 ppm1 4.932 ppm2 8.699 CV 1
ASSI { 62}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HN ))
2.500 0.800 0.800 peak 62 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 4.515 ppm2 8.645 CV 1
ASSI { 63}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 59 and name HN ))
2.400 2.400 3.600 peak 63 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 2.547 ppm2 8.861 CV 1
ASSI { 64}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HN ))
2.600 0.800 0.800 peak 64 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 3.982 ppm2 8.685 CV 1
ASSI { 65}
(( segid " " and resid 23 and name HB3 ))
(( segid " " and resid 23 and name HN ))
2.400 2.400 3.600 peak 65 spectrum 1 weight 0.10000E+01 volume 0.33210E-02 ppm1 2.868 ppm2 8.676 CV 1
ASSI { 66}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB3 ))
2.500 0.800 0.800 peak 66 spectrum 1 weight 0.10000E+01 volume 0.27869E-02 ppm1 3.985 ppm2 2.863 CV 1
ASSI { 67}
(( segid " " and resid 29 and name HB3 ))
(( segid " " and resid 29 and name HN ))
2.400 2.400 3.600 peak 67 spectrum 1 weight 0.10000E+01 volume 0.28841E-02 ppm1 2.696 ppm2 8.640 CV 1
ASSI { 68}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HN ))
2.500 0.800 0.800 peak 68 spectrum 1 weight 0.10000E+01 volume 0.26801E-02 ppm1 2.774 ppm2 8.640 CV 1
ASSI { 69}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB3 ))
2.500 0.800 0.800 peak 69 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 4.524 ppm2 2.704 CV 1
ASSI { 70}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HB2 ))
2.500 0.800 0.800 peak 70 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 4.524 ppm2 2.777 CV 1
ASSI { 71}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HN ))
2.500 0.800 0.800 peak 71 spectrum 1 weight 0.10000E+01 volume 0.25927E-02 ppm1 4.980 ppm2 8.490 CV 1
ASSI { 72}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HN ))
2.400 0.700 0.700 peak 72 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 5.017 ppm2 8.241 CV 1
ASSI { 73}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 101 and name HN ))
2.300 0.700 0.700 peak 73 spectrum 1 weight 0.10000E+01 volume 0.39911E-02 ppm1 4.918 ppm2 8.018 CV 1
ASSI { 74}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HN ))
2.400 0.700 0.700 peak 74 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 5.015 ppm2 7.990 CV 1
ASSI { 78}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HN ))
2.200 2.200 3.800 peak 78 spectrum 1 weight 0.10000E+01 volume 0.50010E-02 ppm1 4.464 ppm2 8.594 CV 1
ASSI { 79}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 112 and name HN ))
2.500 0.800 0.800 peak 79 spectrum 1 weight 0.10000E+01 volume 0.23500E-02 ppm1 4.686 ppm2 8.438 CV 1
ASSI { 81}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HN ))
6.000 4.500 0.000 peak 81 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.698 ppm2 8.174 CV 1
ASSI { 82}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HN ))
2.500 0.800 0.800 peak 82 spectrum 1 weight 0.10000E+01 volume 0.24665E-02 ppm1 4.669 ppm2 8.270 CV 1
ASSI { 83}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HN ))
2.500 0.800 0.800 peak 83 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 4.627 ppm2 8.293 CV 1
ASSI { 84}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HN ))
2.600 0.800 0.800 peak 84 spectrum 1 weight 0.10000E+01 volume 0.19810E-02 ppm1 4.690 ppm2 8.335 CV 1
ASSI { 85}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HN ))
6.000 4.500 0.000 peak 85 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.502 ppm2 8.361 CV 1
ASSI { 86}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HN ))
6.000 4.500 0.000 peak 86 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.494 ppm2 8.399 CV 1
ASSI { 88}
(( segid " " and resid 109 and name HB2 ))
(( segid " " and resid 109 and name HN ))
2.400 0.700 0.700 peak 88 spectrum 1 weight 0.10000E+01 volume 0.32336E-02 ppm1 2.837 ppm2 8.177 CV 1
ASSI { 89}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 109 and name HN ))
2.500 0.800 0.800 peak 89 spectrum 1 weight 0.10000E+01 volume 0.27093E-02 ppm1 2.724 ppm2 8.176 CV 1
ASSI { 90}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HB2 ))
2.400 0.700 0.700 peak 90 spectrum 1 weight 0.10000E+01 volume 0.30977E-02 ppm1 4.644 ppm2 2.697 CV 1
ASSI { 91}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HB3 ))
2.400 0.700 0.700 peak 91 spectrum 1 weight 0.10000E+01 volume 0.30588E-02 ppm1 4.630 ppm2 2.604 CV 1
ASSI { 92}
(( segid " " and resid 75 and name HB3 ))
(( segid " " and resid 75 and name HN ))
2.500 0.800 0.800 peak 92 spectrum 1 weight 0.10000E+01 volume 0.24762E-02 ppm1 2.617 ppm2 8.297 CV 1
ASSI { 93}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 75 and name HN ))
2.500 0.800 0.800 peak 93 spectrum 1 weight 0.10000E+01 volume 0.26607E-02 ppm1 2.709 ppm2 8.296 CV 1
ASSI { 94}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HB2 ))
2.500 0.800 0.800 peak 94 spectrum 1 weight 0.10000E+01 volume 0.27481E-02 ppm1 4.701 ppm2 2.827 CV 1
ASSI { 95}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HB3 ))
2.400 0.700 0.700 peak 95 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 4.699 ppm2 2.713 CV 1
ASSI { 97}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name HN ))
2.600 0.800 0.800 peak 97 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 4.490 ppm2 8.161 CV 1
ASSI { 99}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 104 and name HN ))
2.500 0.800 0.800 peak 99 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 4.350 ppm2 8.111 CV 1
ASSI { 100}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HN ))
2.500 0.800 0.800 peak 100 spectrum 1 weight 0.10000E+01 volume 0.26704E-02 ppm1 4.385 ppm2 8.212 CV 1
ASSI { 101}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HN ))
2.400 0.700 0.700 peak 101 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 4.410 ppm2 8.332 CV 1
ASSI { 102}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HN ))
2.400 0.700 0.700 peak 102 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 4.451 ppm2 8.422 CV 1
ASSI { 104}
(( segid " " and resid 2 and name HB3 ))
(( segid " " and resid 2 and name HN ))
2.400 0.700 0.700 peak 104 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 3.764 ppm2 8.591 CV 1
OR { 104}
(( segid " " and resid 2 and name HB2 ))
(( segid " " and resid 2 and name HN ))
ASSI { 105}
(( segid " " and resid 74 and name HA2 ))
(( segid " " and resid 74 and name HN ))
2.600 0.800 0.800 peak 105 spectrum 1 weight 0.10000E+01 volume 0.20392E-02 ppm1 3.912 ppm2 8.167 CV 1
OR { 105}
(( segid " " and resid 74 and name HA1 ))
(( segid " " and resid 74 and name HN ))
ASSI { 106}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HN ))
6.000 4.500 0.000 peak 106 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.111 ppm2 8.235 CV 1
ASSI { 107}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 78 and name HN ))
2.500 0.800 0.800 peak 107 spectrum 1 weight 0.10000E+01 volume 0.25636E-02 ppm1 4.130 ppm2 8.167 CV 1
ASSI { 108}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HN ))
6.000 4.500 0.000 peak 108 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.071 ppm2 8.233 CV 1
ASSI { 109}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HN ))
2.500 0.800 0.800 peak 109 spectrum 1 weight 0.10000E+01 volume 0.26122E-02 ppm1 4.210 ppm2 8.346 CV 1
ASSI { 110}
(( segid " " and resid 103 and name HB ))
(( segid " " and resid 103 and name HN ))
2.600 0.800 0.800 peak 110 spectrum 1 weight 0.10000E+01 volume 0.21460E-02 ppm1 4.266 ppm2 8.401 CV 1
ASSI { 111}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HN ))
2.500 0.800 0.800 peak 111 spectrum 1 weight 0.10000E+01 volume 0.25830E-02 ppm1 4.270 ppm2 8.425 CV 1
ASSI { 113}
(( segid " " and resid 86 and name HA1 ))
(( segid " " and resid 86 and name HN ))
2.400 0.700 0.700 peak 113 spectrum 1 weight 0.10000E+01 volume 0.33016E-02 ppm1 4.248 ppm2 8.465 CV 1
ASSI { 114}
(( segid " " and resid 90 and name HA1 ))
(( segid " " and resid 90 and name HN ))
2.500 0.800 0.800 peak 114 spectrum 1 weight 0.10000E+01 volume 0.27093E-02 ppm1 4.074 ppm2 8.514 CV 1
OR { 114}
(( segid " " and resid 90 and name HA2 ))
(( segid " " and resid 90 and name HN ))
ASSI { 116}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HN ))
2.500 0.800 0.800 peak 116 spectrum 1 weight 0.10000E+01 volume 0.25927E-02 ppm1 4.108 ppm2 8.029 CV 1
ASSI { 117}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 111 and name HN ))
2.500 0.800 0.800 peak 117 spectrum 1 weight 0.10000E+01 volume 0.26122E-02 ppm1 4.218 ppm2 7.989 CV 1
ASSI { 119}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 107 and name HN ))
2.500 0.800 0.800 peak 119 spectrum 1 weight 0.10000E+01 volume 0.25539E-02 ppm1 4.211 ppm2 8.026 CV 1
ASSI { 120}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HN ))
2.500 0.800 0.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.25830E-02 ppm1 4.351 ppm2 8.130 CV 1
ASSI { 121}
(( segid " " and resid 83 and name HB ))
(( segid " " and resid 83 and name HN ))
6.000 4.500 0.000 peak 121 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.219 ppm2 8.204 CV 1
ASSI { 122}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HN ))
6.000 4.500 0.000 peak 122 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.296 ppm2 8.207 CV 1
ASSI { 123}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HN ))
2.400 0.700 0.700 peak 123 spectrum 1 weight 0.10000E+01 volume 0.35929E-02 ppm1 4.356 ppm2 8.237 CV 1
ASSI { 124}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HN ))
2.500 0.800 0.800 peak 124 spectrum 1 weight 0.10000E+01 volume 0.27190E-02 ppm1 4.293 ppm2 7.951 CV 1
ASSI { 125}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
2.600 0.800 0.800 peak 125 spectrum 1 weight 0.10000E+01 volume 0.21849E-02 ppm1 4.244 ppm2 8.141 CV 1
ASSI { 126}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 5 and name HN ))
2.500 2.500 3.500 peak 126 spectrum 1 weight 0.10000E+01 volume 0.24179E-02 ppm1 3.639 ppm2 8.148 CV 1
ASSI { 128}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HB ))
2.500 0.800 0.800 peak 128 spectrum 1 weight 0.10000E+01 volume 0.24471E-02 ppm1 4.231 ppm2 3.641 CV 1
ASSI { 129}
(( segid " " and resid 112 and name HB2 ))
(( segid " " and resid 112 and name HN ))
2.400 2.400 3.600 peak 129 spectrum 1 weight 0.10000E+01 volume 0.31754E-02 ppm1 2.775 ppm2 8.434 CV 1
ASSI { 131}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 112 and name HB2 ))
6.000 4.500 0.000 peak 131 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.665 ppm2 2.762 CV 1
ASSI { 132}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 112 and name HB3 ))
2.500 0.800 0.800 peak 132 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 4.647 ppm2 2.626 CV 1
ASSI { 133}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HN ))
2.400 0.700 0.700 peak 133 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 4.723 ppm2 8.399 CV 1
ASSI { 135}
(( segid " " and resid 69 and name HB3 ))
(( segid " " and resid 69 and name HN ))
2.500 2.500 3.500 peak 135 spectrum 1 weight 0.10000E+01 volume 0.26607E-02 ppm1 3.168 ppm2 8.404 CV 1
ASSI { 136}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB3 ))
2.500 0.800 0.800 peak 136 spectrum 1 weight 0.10000E+01 volume 0.26704E-02 ppm1 4.723 ppm2 3.142 CV 1
ASSI { 137}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB2 ))
2.400 0.800 0.800 peak 137 spectrum 1 weight 0.10000E+01 volume 0.28064E-02 ppm1 4.717 ppm2 3.249 CV 1
ASSI { 138}
(( segid " " and resid 71 and name HA2 ))
(( segid " " and resid 71 and name HN ))
2.500 0.800 0.800 peak 138 spectrum 1 weight 0.10000E+01 volume 0.22237E-02 ppm1 4.041 ppm2 8.515 CV 1
OR { 138}
(( segid " " and resid 71 and name HA1 ))
(( segid " " and resid 71 and name HN ))
ASSI { 139}
(( segid " " and resid 73 and name HA2 ))
(( segid " " and resid 73 and name HN ))
2.600 0.800 0.800 peak 139 spectrum 1 weight 0.10000E+01 volume 0.20295E-02 ppm1 4.004 ppm2 8.582 CV 1
OR { 139}
(( segid " " and resid 73 and name HA1 ))
(( segid " " and resid 73 and name HN ))
ASSI { 140}
(( segid " " and resid 80 and name HA1 ))
(( segid " " and resid 80 and name HN ))
2.600 0.800 0.800 peak 140 spectrum 1 weight 0.10000E+01 volume 0.19907E-02 ppm1 3.965 ppm2 8.405 CV 1
OR { 140}
(( segid " " and resid 80 and name HA2 ))
(( segid " " and resid 80 and name HN ))
OR { 140}
(( segid " " and resid 68 and name HA1 ))
(( segid " " and resid 69 and name HN ))
ASSI { 141}
(( segid " " and resid 67 and name HA2 ))
(( segid " " and resid 67 and name HN ))
2.600 0.800 0.800 peak 141 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 3.996 ppm2 8.425 CV 1
OR { 141}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 67 and name HN ))
ASSI { 142}
(( segid " " and resid 65 and name HA2 ))
(( segid " " and resid 65 and name HN ))
2.500 0.800 0.800 peak 142 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 3.178 ppm2 7.933 CV 1
ASSI { 143}
(( segid " " and resid 65 and name HA1 ))
(( segid " " and resid 65 and name HN ))
2.500 0.800 0.800 peak 143 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 3.454 ppm2 7.933 CV 1
ASSI { 144}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HB2 ))
2.500 0.800 0.800 peak 144 spectrum 1 weight 0.10000E+01 volume 0.24568E-02 ppm1 4.468 ppm2 3.771 CV 1
OR { 144}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 2 and name HB3 ))
ASSI { 146}
(( segid " " and resid 88 and name HG2 ))
(( segid " " and resid 88 and name HN ))
2.400 2.400 3.600 peak 146 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 2.163 ppm2 8.424 CV 1
ASSI { 147}
(( segid " " and resid 88 and name HG3 ))
(( segid " " and resid 88 and name HN ))
2.500 0.800 0.800 peak 147 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 2.092 ppm2 8.422 CV 1
ASSI { 148}
(( segid " " and resid 88 and name HB2 ))
(( segid " " and resid 88 and name HN ))
2.400 0.700 0.700 peak 148 spectrum 1 weight 0.10000E+01 volume 0.30977E-02 ppm1 1.918 ppm2 8.425 CV 1
ASSI { 149}
(( segid " " and resid 88 and name HB3 ))
(( segid " " and resid 88 and name HN ))
2.400 2.400 3.600 peak 149 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 1.847 ppm2 8.424 CV 1
ASSI { 154}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HB3 ))
2.500 0.800 0.800 peak 154 spectrum 1 weight 0.10000E+01 volume 0.27481E-02 ppm1 4.270 ppm2 1.845 CV 1
ASSI { 155}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HB2 ))
2.500 0.800 0.800 peak 155 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 4.270 ppm2 1.912 CV 1
ASSI { 156}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HG3 ))
2.500 0.800 0.800 peak 156 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 4.269 ppm2 2.091 CV 1
ASSI { 157}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HG2 ))
2.500 0.800 0.800 peak 157 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 4.267 ppm2 2.166 CV 1
ASSI { 158}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HG2 ))
6.000 4.500 0.000 peak 158 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.495 ppm2 2.578 CV 1
OR { 158}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HG2 ))
ASSI { 159}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HG3 ))
2.500 0.800 0.800 peak 159 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 4.495 ppm2 2.511 CV 1
ASSI { 160}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HB3 ))
2.500 0.800 0.800 peak 160 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 4.495 ppm2 2.008 CV 1
ASSI { 165}
(( segid " " and resid 77 and name HG3 ))
(( segid " " and resid 77 and name HN ))
2.300 0.700 0.700 peak 165 spectrum 1 weight 0.10000E+01 volume 0.36124E-02 ppm1 2.483 ppm2 8.402 CV 1
ASSI { 166}
(( segid " " and resid 77 and name HG2 ))
(( segid " " and resid 77 and name HN ))
2.400 0.700 0.700 peak 166 spectrum 1 weight 0.10000E+01 volume 0.34473E-02 ppm1 2.568 ppm2 8.402 CV 1
ASSI { 167}
(( segid " " and resid 77 and name HB2 ))
(( segid " " and resid 77 and name HN ))
2.500 0.800 0.800 peak 167 spectrum 1 weight 0.10000E+01 volume 0.26607E-02 ppm1 2.030 ppm2 8.402 CV 1
ASSI { 168}
(( segid " " and resid 77 and name HB3 ))
(( segid " " and resid 77 and name HN ))
2.500 2.500 3.500 peak 168 spectrum 1 weight 0.10000E+01 volume 0.27481E-02 ppm1 1.988 ppm2 8.404 CV 1
ASSI { 173}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 106 and name HN ))
2.500 0.800 0.800 peak 173 spectrum 1 weight 0.10000E+01 volume 0.26801E-02 ppm1 2.632 ppm2 8.149 CV 1
ASSI { 174}
(( segid " " and resid 106 and name HB3 ))
(( segid " " and resid 106 and name HN ))
2.500 0.800 0.800 peak 174 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 2.527 ppm2 8.149 CV 1
ASSI { 175}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name HB2 ))
2.400 0.700 0.700 peak 175 spectrum 1 weight 0.10000E+01 volume 0.28743E-02 ppm1 4.495 ppm2 2.618 CV 1
ASSI { 176}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name HB3 ))
2.500 0.800 0.800 peak 176 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 4.494 ppm2 2.531 CV 1
ASSI { 177}
(( segid " " and resid 113 and name HB2 ))
(( segid " " and resid 113 and name HN ))
2.400 0.700 0.700 peak 177 spectrum 1 weight 0.10000E+01 volume 0.31268E-02 ppm1 2.748 ppm2 8.261 CV 1
ASSI { 178}
(( segid " " and resid 113 and name HB3 ))
(( segid " " and resid 113 and name HN ))
2.400 0.700 0.700 peak 178 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 2.649 ppm2 8.263 CV 1
ASSI { 180}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 113 and name HB2 ))
2.400 0.700 0.700 peak 180 spectrum 1 weight 0.10000E+01 volume 0.33696E-02 ppm1 4.644 ppm2 2.723 CV 1
ASSI { 183}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HN ))
2.400 2.400 3.600 peak 183 spectrum 1 weight 0.10000E+01 volume 0.35055E-02 ppm1 2.607 ppm2 8.367 CV 1
ASSI { 184}
(( segid " " and resid 85 and name HG3 ))
(( segid " " and resid 85 and name HN ))
2.400 2.400 3.600 peak 184 spectrum 1 weight 0.10000E+01 volume 0.30297E-02 ppm1 2.520 ppm2 8.367 CV 1
ASSI { 185}
(( segid " " and resid 85 and name HB2 ))
(( segid " " and resid 85 and name HN ))
2.400 0.700 0.700 peak 185 spectrum 1 weight 0.10000E+01 volume 0.29715E-02 ppm1 2.130 ppm2 8.371 CV 1
ASSI { 186}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 85 and name HN ))
2.400 0.700 0.700 peak 186 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 2.014 ppm2 8.367 CV 1
ASSI { 187}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HB2 ))
2.500 0.800 0.800 peak 187 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 4.507 ppm2 2.112 CV 1
ASSI { 188}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HG2 ))
2.400 0.700 0.700 peak 188 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 4.498 ppm2 2.603 CV 1
ASSI { 189}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 91 and name HN ))
2.400 2.400 3.600 peak 189 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 2.819 ppm2 8.325 CV 1
ASSI { 190}
(( segid " " and resid 91 and name HB3 ))
(( segid " " and resid 91 and name HN ))
2.400 2.400 3.600 peak 190 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 2.771 ppm2 8.326 CV 1
ASSI { 191}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HB3 ))
2.500 0.800 0.800 peak 191 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 4.677 ppm2 2.765 CV 1
ASSI { 192}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HB2 ))
6.000 4.500 0.000 peak 192 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.678 ppm2 2.809 CV 1
ASSI { 194}
(( segid " " and resid 110 and name HA1 ))
(( segid " " and resid 110 and name HN ))
6.000 4.500 0.000 peak 194 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.964 ppm2 8.323 CV 1
OR { 194}
(( segid " " and resid 110 and name HA2 ))
(( segid " " and resid 110 and name HN ))
OR { 194}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HN ))
ASSI { 195}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 68 and name HN ))
2.600 0.800 0.800 peak 195 spectrum 1 weight 0.10000E+01 volume 0.20489E-02 ppm1 3.963 ppm2 8.287 CV 1
OR { 195}
(( segid " " and resid 68 and name HA1 ))
(( segid " " and resid 68 and name HN ))
ASSI { 196}
(( segid " " and resid 87 and name HA2 ))
(( segid " " and resid 87 and name HN ))
2.700 0.900 0.900 peak 196 spectrum 1 weight 0.10000E+01 volume 0.16799E-02 ppm1 3.966 ppm2 8.266 CV 1
OR { 196}
(( segid " " and resid 87 and name HA1 ))
(( segid " " and resid 87 and name HN ))
OR { 196}
(( segid " " and resid 86 and name HA2 ))
(( segid " " and resid 87 and name HN ))
ASSI { 197}
(( segid " " and resid 64 and name HA2 ))
(( segid " " and resid 64 and name HN ))
2.600 0.800 0.800 peak 197 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 3.692 ppm2 7.657 CV 1
ASSI { 198}
(( segid " " and resid 64 and name HA1 ))
(( segid " " and resid 64 and name HN ))
2.600 0.800 0.800 peak 198 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 3.920 ppm2 7.655 CV 1
ASSI { 204}
(( segid " " and resid 82 and name HD3 ))
(( segid " " and resid 82 and name HB3 ))
2.400 2.400 3.600 peak 204 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 3.729 ppm2 1.935 CV 1
ASSI { 205}
(( segid " " and resid 82 and name HD2 ))
(( segid " " and resid 82 and name HB3 ))
2.400 2.400 3.600 peak 205 spectrum 1 weight 0.10000E+01 volume 0.31365E-02 ppm1 3.812 ppm2 1.935 CV 1
ASSI { 206}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HB3 ))
2.400 0.700 0.700 peak 206 spectrum 1 weight 0.10000E+01 volume 0.28938E-02 ppm1 4.467 ppm2 1.935 CV 1
ASSI { 207}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HB2 ))
2.500 0.800 0.800 peak 207 spectrum 1 weight 0.10000E+01 volume 0.22432E-02 ppm1 4.468 ppm2 2.277 CV 1
ASSI { 208}
(( segid " " and resid 82 and name HD2 ))
(( segid " " and resid 82 and name HG3 ))
2.500 0.800 0.800 peak 208 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 3.812 ppm2 2.025 CV 1
OR { 208}
(( segid " " and resid 82 and name HD2 ))
(( segid " " and resid 82 and name HG2 ))
ASSI { 209}
(( segid " " and resid 82 and name HD3 ))
(( segid " " and resid 82 and name HG2 ))
2.500 0.800 0.800 peak 209 spectrum 1 weight 0.10000E+01 volume 0.23500E-02 ppm1 3.733 ppm2 2.025 CV 1
ASSI { 210}
(( segid " " and resid 82 and name HD2 ))
(( segid " " and resid 82 and name HB2 ))
2.400 2.400 3.600 peak 210 spectrum 1 weight 0.10000E+01 volume 0.33987E-02 ppm1 3.812 ppm2 2.273 CV 1
ASSI { 211}
(( segid " " and resid 82 and name HD3 ))
(( segid " " and resid 82 and name HB2 ))
2.100 2.100 3.900 peak 211 spectrum 1 weight 0.10000E+01 volume 0.69625E-02 ppm1 3.735 ppm2 2.273 CV 1
ASSI { 212}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HG3 ))
6.000 4.500 0.000 peak 212 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.467 ppm2 2.010 CV 1
OR { 212}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HG2 ))
ASSI { 215}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HN ))
2.600 0.800 0.800 peak 215 spectrum 1 weight 0.10000E+01 volume 0.20781E-02 ppm1 4.361 ppm2 7.634 CV 1
ASSI { 216}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HN ))
2.400 0.700 0.700 peak 216 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 4.499 ppm2 7.648 CV 1
ASSI { 217}
(( segid " " and resid 105 and name HB2 ))
(( segid " " and resid 105 and name HN ))
2.500 0.800 0.800 peak 217 spectrum 1 weight 0.10000E+01 volume 0.24277E-02 ppm1 3.078 ppm2 7.634 CV 1
ASSI { 218}
(( segid " " and resid 105 and name HB3 ))
(( segid " " and resid 105 and name HN ))
2.500 0.800 0.800 peak 218 spectrum 1 weight 0.10000E+01 volume 0.23305E-02 ppm1 3.011 ppm2 7.633 CV 1
ASSI { 219}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HB2 ))
2.500 0.800 0.800 peak 219 spectrum 1 weight 0.10000E+01 volume 0.24568E-02 ppm1 4.363 ppm2 3.079 CV 1
ASSI { 220}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HB3 ))
2.500 0.800 0.800 peak 220 spectrum 1 weight 0.10000E+01 volume 0.23111E-02 ppm1 4.361 ppm2 3.008 CV 1
ASSI { 222}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HN ))
2.400 0.700 0.700 peak 222 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 4.037 ppm2 7.570 CV 1
ASSI { 223}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HN ))
2.500 0.800 0.800 peak 223 spectrum 1 weight 0.10000E+01 volume 0.24179E-02 ppm1 4.194 ppm2 7.480 CV 1
ASSI { 224}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 63 and name HN ))
2.600 2.600 3.400 peak 224 spectrum 1 weight 0.10000E+01 volume 0.21169E-02 ppm1 1.613 ppm2 7.479 CV 1
ASSI { 226}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HN ))
2.500 0.800 0.800 peak 226 spectrum 1 weight 0.10000E+01 volume 0.24665E-02 ppm1 4.043 ppm2 7.822 CV 1
ASSI { 227}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HN ))
2.400 0.700 0.700 peak 227 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 4.142 ppm2 7.881 CV 1
ASSI { 228}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HB2 ))
2.400 0.700 0.700 peak 228 spectrum 1 weight 0.10000E+01 volume 0.33113E-02 ppm1 4.142 ppm2 2.292 CV 1
ASSI { 229}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HG2 ))
2.400 0.700 0.700 peak 229 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 4.128 ppm2 2.097 CV 1
OR { 229}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HG3 ))
ASSI { 230}
(( segid " " and resid 114 and name HA ))
(( segid " " and resid 114 and name HB3 ))
2.300 2.300 3.700 peak 230 spectrum 1 weight 0.10000E+01 volume 0.44475E-02 ppm1 4.143 ppm2 1.920 CV 1
ASSI { 231}
(( segid " " and resid 114 and name HB2 ))
(( segid " " and resid 114 and name HB3 ))
2.500 0.800 0.800 peak 231 spectrum 1 weight 0.10000E+01 volume 0.25345E-02 ppm1 2.284 ppm2 1.920 CV 1
ASSI { 233}
(( segid " " and resid 114 and name HB2 ))
(( segid " " and resid 114 and name HN ))
2.400 0.700 0.700 peak 233 spectrum 1 weight 0.10000E+01 volume 0.35152E-02 ppm1 2.292 ppm2 7.881 CV 1
ASSI { 235}
(( segid " " and resid 114 and name HB3 ))
(( segid " " and resid 114 and name HN ))
2.400 0.700 0.700 peak 235 spectrum 1 weight 0.10000E+01 volume 0.30977E-02 ppm1 1.926 ppm2 7.884 CV 1
ASSI { 236}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 66 and name HN ))
2.400 2.400 3.600 peak 236 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 3.972 ppm2 8.330 CV 1
ASSI { 237}
(( segid " " and resid 66 and name HB3 ))
(( segid " " and resid 66 and name HN ))
2.500 2.500 3.500 peak 237 spectrum 1 weight 0.10000E+01 volume 0.27578E-02 ppm1 3.903 ppm2 8.331 CV 1
ASSI { 238}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB2 ))
2.500 0.800 0.800 peak 238 spectrum 1 weight 0.10000E+01 volume 0.26704E-02 ppm1 4.414 ppm2 3.970 CV 1
ASSI { 239}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 66 and name HB3 ))
2.500 0.800 0.800 peak 239 spectrum 1 weight 0.10000E+01 volume 0.24082E-02 ppm1 4.414 ppm2 3.892 CV 1
ASSI { 240}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 58 and name HE ))
2.500 0.800 0.800 peak 240 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 3.198 ppm2 7.124 CV 1
OR { 240}
(( segid " " and resid 58 and name HD3 ))
(( segid " " and resid 58 and name HE ))
ASSI { 244}
(( segid " " and resid 99 and name HD2 ))
(( segid " " and resid 99 and name HE ))
2.500 0.800 0.800 peak 244 spectrum 1 weight 0.10000E+01 volume 0.22334E-02 ppm1 2.942 ppm2 7.366 CV 1
OR { 244}
(( segid " " and resid 99 and name HD3 ))
(( segid " " and resid 99 and name HE ))
ASSI { 251}
( segid " " and resid 107 and name HB% )
(( segid " " and resid 107 and name HN ))
2.600 0.800 0.800 peak 251 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 1.394 ppm2 8.025 CV 1
ASSI { 252}
(( segid " " and resid 107 and name HA ))
( segid " " and resid 107 and name HB% )
2.600 0.800 0.800 peak 252 spectrum 1 weight 0.10000E+01 volume 0.20392E-02 ppm1 4.195 ppm2 1.391 CV 1
ASSI { 253}
(( segid " " and resid 84 and name HB2 ))
(( segid " " and resid 84 and name HN ))
2.400 2.400 3.600 peak 253 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 1.672 ppm2 8.204 CV 1
ASSI { 254}
(( segid " " and resid 84 and name HB3 ))
(( segid " " and resid 84 and name HN ))
2.500 2.500 3.500 peak 254 spectrum 1 weight 0.10000E+01 volume 0.25248E-02 ppm1 1.622 ppm2 8.203 CV 1
ASSI { 256}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HB2 ))
2.400 0.700 0.700 peak 256 spectrum 1 weight 0.10000E+01 volume 0.31754E-02 ppm1 4.379 ppm2 1.662 CV 1
ASSI { 257}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HB3 ))
2.500 0.800 0.800 peak 257 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 4.381 ppm2 1.612 CV 1
ASSI { 259}
(( segid " " and resid 79 and name HB ))
(( segid " " and resid 79 and name HN ))
2.500 0.800 0.800 peak 259 spectrum 1 weight 0.10000E+01 volume 0.24471E-02 ppm1 2.052 ppm2 8.226 CV 1
ASSI { 260}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HB ))
2.500 0.800 0.800 peak 260 spectrum 1 weight 0.10000E+01 volume 0.23111E-02 ppm1 4.114 ppm2 2.047 CV 1
ASSI { 261}
(( segid " " and resid 79 and name HA ))
( segid " " and resid 79 and name HG1%)
2.500 0.800 0.800 peak 261 spectrum 1 weight 0.10000E+01 volume 0.22334E-02 ppm1 4.105 ppm2 0.924 CV 1
OR { 261}
(( segid " " and resid 79 and name HA ))
( segid " " and resid 79 and name HG2%)
ASSI { 262}
(( segid " " and resid 79 and name HB ))
( segid " " and resid 79 and name HG1%)
2.600 0.900 0.900 peak 262 spectrum 1 weight 0.10000E+01 volume 0.18644E-02 ppm1 2.062 ppm2 0.921 CV 1
OR { 262}
(( segid " " and resid 79 and name HB ))
( segid " " and resid 79 and name HG2%)
ASSI { 263}
(( segid " " and resid 104 and name HG2 ))
(( segid " " and resid 104 and name HN ))
2.500 0.800 0.800 peak 263 spectrum 1 weight 0.10000E+01 volume 0.25539E-02 ppm1 2.248 ppm2 8.113 CV 1
OR { 263}
(( segid " " and resid 104 and name HG3 ))
(( segid " " and resid 104 and name HN ))
ASSI { 264}
(( segid " " and resid 104 and name HB2 ))
(( segid " " and resid 104 and name HN ))
2.500 2.500 3.500 peak 264 spectrum 1 weight 0.10000E+01 volume 0.25927E-02 ppm1 2.105 ppm2 8.113 CV 1
ASSI { 265}
(( segid " " and resid 104 and name HB3 ))
(( segid " " and resid 104 and name HN ))
2.500 2.500 3.500 peak 265 spectrum 1 weight 0.10000E+01 volume 0.22140E-02 ppm1 1.943 ppm2 8.113 CV 1
ASSI { 266}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 104 and name HG3 ))
2.500 0.800 0.800 peak 266 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 4.346 ppm2 2.238 CV 1
OR { 266}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 104 and name HG2 ))
ASSI { 267}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 104 and name HB2 ))
2.500 0.800 0.800 peak 267 spectrum 1 weight 0.10000E+01 volume 0.22529E-02 ppm1 4.346 ppm2 2.105 CV 1
ASSI { 268}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 104 and name HB3 ))
2.500 0.800 0.800 peak 268 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 4.346 ppm2 1.937 CV 1
ASSI { 269}
(( segid " " and resid 76 and name HB ))
(( segid " " and resid 76 and name HN ))
2.500 0.800 0.800 peak 269 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 2.084 ppm2 8.024 CV 1
ASSI { 270}
( segid " " and resid 76 and name HG1%)
(( segid " " and resid 76 and name HN ))
2.600 0.800 0.800 peak 270 spectrum 1 weight 0.10000E+01 volume 0.21460E-02 ppm1 0.914 ppm2 8.029 CV 1
OR { 270}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 76 and name HN ))
ASSI { 271}
(( segid " " and resid 76 and name HB ))
( segid " " and resid 76 and name HG1%)
2.600 0.800 0.800 peak 271 spectrum 1 weight 0.10000E+01 volume 0.19713E-02 ppm1 2.080 ppm2 0.910 CV 1
OR { 271}
(( segid " " and resid 76 and name HB ))
( segid " " and resid 76 and name HG2%)
ASSI { 272}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 76 and name HG1%)
2.600 0.800 0.800 peak 272 spectrum 1 weight 0.10000E+01 volume 0.22043E-02 ppm1 4.120 ppm2 0.911 CV 1
OR { 272}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 76 and name HG2%)
ASSI { 273}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HB ))
2.500 0.800 0.800 peak 273 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 4.113 ppm2 2.075 CV 1
ASSI { 274}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HN ))
2.400 0.700 0.700 peak 274 spectrum 1 weight 0.10000E+01 volume 0.30297E-02 ppm1 5.608 ppm2 7.873 CV 1
ASSI { 275}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HN ))
2.400 0.700 0.700 peak 275 spectrum 1 weight 0.10000E+01 volume 0.34667E-02 ppm1 5.350 ppm2 7.623 CV 1
ASSI { 276}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HN ))
2.500 0.800 0.800 peak 276 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 4.297 ppm2 8.306 CV 1
ASSI { 277}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HN ))
2.500 2.500 3.500 peak 277 spectrum 1 weight 0.10000E+01 volume 0.22917E-02 ppm1 1.525 ppm2 8.307 CV 1
ASSI { 278}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 3 and name HN ))
2.400 2.400 3.600 peak 278 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 1.449 ppm2 8.306 CV 1
ASSI { 282}
(( segid " " and resid 3 and name HB2 ))
( segid " " and resid 3 and name HD1%)
2.400 0.700 0.700 peak 282 spectrum 1 weight 0.10000E+01 volume 0.29229E-02 ppm1 1.542 ppm2 0.788 CV 1
OR { 282}
(( segid " " and resid 3 and name HB2 ))
( segid " " and resid 3 and name HD2%)
ASSI { 283}
(( segid " " and resid 3 and name HB3 ))
( segid " " and resid 3 and name HD2%)
2.500 0.800 0.800 peak 283 spectrum 1 weight 0.10000E+01 volume 0.23403E-02 ppm1 1.437 ppm2 0.787 CV 1
ASSI { 285}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 3 and name HD1%)
2.500 0.800 0.800 peak 285 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 4.301 ppm2 0.825 CV 1
ASSI { 287}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HB3 ))
2.500 0.800 0.800 peak 287 spectrum 1 weight 0.10000E+01 volume 0.23694E-02 ppm1 4.298 ppm2 1.439 CV 1
ASSI { 288}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HB2 ))
2.500 0.800 0.800 peak 288 spectrum 1 weight 0.10000E+01 volume 0.22334E-02 ppm1 4.298 ppm2 1.530 CV 1
ASSI { 289}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HN ))
2.500 0.800 0.800 peak 289 spectrum 1 weight 0.10000E+01 volume 0.27287E-02 ppm1 4.639 ppm2 8.164 CV 1
ASSI { 290}
(( segid " " and resid 81 and name HG3 ))
(( segid " " and resid 81 and name HN ))
2.500 0.800 0.800 peak 290 spectrum 1 weight 0.10000E+01 volume 0.26122E-02 ppm1 2.302 ppm2 8.156 CV 1
OR { 290}
(( segid " " and resid 81 and name HG2 ))
(( segid " " and resid 81 and name HN ))
ASSI { 291}
(( segid " " and resid 81 and name HB2 ))
(( segid " " and resid 81 and name HN ))
2.500 2.500 3.500 peak 291 spectrum 1 weight 0.10000E+01 volume 0.22917E-02 ppm1 2.045 ppm2 8.156 CV 1
ASSI { 292}
(( segid " " and resid 81 and name HB3 ))
(( segid " " and resid 81 and name HN ))
2.500 2.500 3.500 peak 292 spectrum 1 weight 0.10000E+01 volume 0.23597E-02 ppm1 1.917 ppm2 8.156 CV 1
ASSI { 294}
(( segid " " and resid 114 and name HB2 ))
(( segid " " and resid 114 and name HB3 ))
2.500 0.800 0.800 peak 294 spectrum 1 weight 0.10000E+01 volume 0.22432E-02 ppm1 2.299 ppm2 1.911 CV 1
ASSI { 295}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HG2 ))
2.500 0.800 0.800 peak 295 spectrum 1 weight 0.10000E+01 volume 0.27481E-02 ppm1 4.638 ppm2 2.300 CV 1
OR { 295}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HG3 ))
ASSI { 296}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HB2 ))
2.400 0.700 0.700 peak 296 spectrum 1 weight 0.10000E+01 volume 0.29035E-02 ppm1 4.643 ppm2 2.049 CV 1
ASSI { 297}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 81 and name HB3 ))
2.500 0.800 0.800 peak 297 spectrum 1 weight 0.10000E+01 volume 0.26607E-02 ppm1 4.626 ppm2 1.911 CV 1
ASSI { 298}
(( segid " " and resid 111 and name HB ))
(( segid " " and resid 111 and name HN ))
2.400 0.700 0.700 peak 298 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 1.870 ppm2 7.989 CV 1
ASSI { 299}
(( segid " " and resid 111 and name HG13))
(( segid " " and resid 111 and name HN ))
2.400 2.400 3.600 peak 299 spectrum 1 weight 0.10000E+01 volume 0.30783E-02 ppm1 1.147 ppm2 7.996 CV 1
ASSI { 301}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 111 and name HB ))
2.400 0.700 0.700 peak 301 spectrum 1 weight 0.10000E+01 volume 0.29423E-02 ppm1 4.215 ppm2 1.859 CV 1
ASSI { 302}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 111 and name HG13))
2.400 2.400 3.600 peak 302 spectrum 1 weight 0.10000E+01 volume 0.34376E-02 ppm1 4.207 ppm2 1.145 CV 1
ASSI { 303}
(( segid " " and resid 111 and name HA ))
( segid " " and resid 111 and name HG2%)
2.500 0.800 0.800 peak 303 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 4.207 ppm2 0.894 CV 1
OR { 303}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 111 and name HG13))
ASSI { 304}
(( segid " " and resid 111 and name HB ))
(( segid " " and resid 111 and name HG13))
2.400 0.700 0.700 peak 304 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 1.859 ppm2 1.145 CV 1
ASSI { 305}
(( segid " " and resid 111 and name HB ))
( segid " " and resid 111 and name HG2%)
2.600 0.800 0.800 peak 305 spectrum 1 weight 0.10000E+01 volume 0.19713E-02 ppm1 1.859 ppm2 0.894 CV 1
OR { 305}
(( segid " " and resid 111 and name HB ))
(( segid " " and resid 111 and name HG12))
OR { 305}
(( segid " " and resid 111 and name HB ))
(( segid " " and resid 111 and name HG13))
ASSI { 307}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HN ))
2.400 0.700 0.700 peak 307 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 5.799 ppm2 8.443 CV 1
ASSI { 308}
( segid " " and resid 78 and name HG2%)
(( segid " " and resid 78 and name HN ))
2.600 0.800 0.800 peak 308 spectrum 1 weight 0.10000E+01 volume 0.21849E-02 ppm1 0.910 ppm2 8.165 CV 1
ASSI { 309}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 78 and name HG1%)
2.500 0.800 0.800 peak 309 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 4.114 ppm2 0.885 CV 1
OR { 309}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 78 and name HG2%)
ASSI { 310}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HN ))
2.400 0.700 0.700 peak 310 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 4.703 ppm2 7.438 CV 1
ASSI { 313}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HN ))
2.400 0.700 0.700 peak 313 spectrum 1 weight 0.10000E+01 volume 0.29715E-02 ppm1 4.319 ppm2 7.291 CV 1
ASSI { 314}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HN ))
2.600 0.800 0.800 peak 314 spectrum 1 weight 0.10000E+01 volume 0.19518E-02 ppm1 4.293 ppm2 8.346 CV 1
ASSI { 315}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HN ))
2.400 0.700 0.700 peak 315 spectrum 1 weight 0.10000E+01 volume 0.31365E-02 ppm1 4.779 ppm2 7.614 CV 1
ASSI { 316}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 4 and name HN ))
2.500 2.500 3.500 peak 316 spectrum 1 weight 0.10000E+01 volume 0.23985E-02 ppm1 1.218 ppm2 8.348 CV 1
ASSI { 317}
(( segid " " and resid 4 and name HG ))
(( segid " " and resid 4 and name HN ))
2.500 0.800 0.800 peak 317 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 1.088 ppm2 8.348 CV 1
ASSI { 318}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 4 and name HN ))
2.500 2.500 3.500 peak 318 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 0.810 ppm2 8.348 CV 1
ASSI { 319}
(( segid " " and resid 4 and name HG ))
( segid " " and resid 4 and name HD2%)
2.600 0.800 0.800 peak 319 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 1.089 ppm2 0.095 CV 1
OR { 319}
(( segid " " and resid 4 and name HG ))
( segid " " and resid 4 and name HD1%)
ASSI { 321}
(( segid " " and resid 4 and name HB2 ))
( segid " " and resid 4 and name HD1%)
2.500 0.800 0.800 peak 321 spectrum 1 weight 0.10000E+01 volume 0.26122E-02 ppm1 1.225 ppm2 0.096 CV 1
ASSI { 323}
(( segid " " and resid 4 and name HB3 ))
( segid " " and resid 4 and name HD2%)
2.500 0.800 0.800 peak 323 spectrum 1 weight 0.10000E+01 volume 0.23597E-02 ppm1 0.801 ppm2 -0.056 CV 1
ASSI { 328}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HB2 ))
2.400 0.700 0.700 peak 328 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 4.502 ppm2 3.929 CV 1
ASSI { 329}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HB3 ))
2.400 0.700 0.700 peak 329 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 4.504 ppm2 3.875 CV 1
ASSI { 330}
(( segid " " and resid 72 and name HB3 ))
(( segid " " and resid 72 and name HN ))
2.400 2.400 3.600 peak 330 spectrum 1 weight 0.10000E+01 volume 0.34084E-02 ppm1 3.893 ppm2 8.364 CV 1
ASSI { 331}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HN ))
2.400 2.400 3.600 peak 331 spectrum 1 weight 0.10000E+01 volume 0.30783E-02 ppm1 3.932 ppm2 8.364 CV 1
ASSI { 332}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HN ))
2.500 0.800 0.800 peak 332 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 4.504 ppm2 8.370 CV 1
ASSI { 333}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HN ))
2.400 0.700 0.700 peak 333 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 4.717 ppm2 6.566 CV 1
ASSI { 335}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HE ))
2.400 2.400 3.600 peak 335 spectrum 1 weight 0.10000E+01 volume 0.30200E-02 ppm1 1.948 ppm2 7.116 CV 1
ASSI { 336}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HE ))
2.300 2.300 3.700 peak 336 spectrum 1 weight 0.10000E+01 volume 0.36221E-02 ppm1 1.723 ppm2 7.124 CV 1
ASSI { 337}
(( segid " " and resid 58 and name HG2 ))
(( segid " " and resid 58 and name HE ))
2.300 0.700 0.700 peak 337 spectrum 1 weight 0.10000E+01 volume 0.40396E-02 ppm1 1.437 ppm2 7.122 CV 1
OR { 337}
(( segid " " and resid 58 and name HG3 ))
(( segid " " and resid 58 and name HE ))
ASSI { 338}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HD2 ))
2.400 0.700 0.700 peak 338 spectrum 1 weight 0.10000E+01 volume 0.31462E-02 ppm1 3.917 ppm2 3.202 CV 1
ASSI { 339}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HB2 ))
2.600 0.900 0.900 peak 339 spectrum 1 weight 0.10000E+01 volume 0.18062E-02 ppm1 3.201 ppm2 1.965 CV 1
OR { 339}
(( segid " " and resid 62 and name HD3 ))
(( segid " " and resid 62 and name HB2 ))
OR { 339}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 58 and name HB2 ))
ASSI { 340}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HB2 ))
2.600 0.800 0.800 peak 340 spectrum 1 weight 0.10000E+01 volume 0.20781E-02 ppm1 3.917 ppm2 1.964 CV 1
ASSI { 341}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HG2 ))
2.400 2.400 3.600 peak 341 spectrum 1 weight 0.10000E+01 volume 0.33016E-02 ppm1 3.907 ppm2 1.431 CV 1
ASSI { 342}
(( segid " " and resid 58 and name HD3 ))
(( segid " " and resid 58 and name HG3 ))
2.600 0.800 0.800 peak 342 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 3.193 ppm2 1.413 CV 1
OR { 342}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 58 and name HG2 ))
OR { 342}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 58 and name HG3 ))
ASSI { 343}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 58 and name HB3 ))
6.000 4.500 0.000 peak 343 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.201 ppm2 1.696 CV 1
OR { 343}
(( segid " " and resid 58 and name HD3 ))
(( segid " " and resid 58 and name HB3 ))
ASSI { 344}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HB3 ))
2.500 0.800 0.800 peak 344 spectrum 1 weight 0.10000E+01 volume 0.26510E-02 ppm1 3.911 ppm2 1.696 CV 1
ASSI { 350}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HG2 ))
2.600 0.800 0.800 peak 350 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 1.969 ppm2 1.417 CV 1
OR { 350}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HG3 ))
ASSI { 354}
(( segid " " and resid 94 and name HB2 ))
(( segid " " and resid 94 and name HN ))
2.500 0.800 0.800 peak 354 spectrum 1 weight 0.10000E+01 volume 0.22140E-02 ppm1 1.799 ppm2 7.571 CV 1
OR { 354}
(( segid " " and resid 94 and name HB3 ))
(( segid " " and resid 94 and name HN ))
ASSI { 355}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HG2 ))
2.500 0.800 0.800 peak 355 spectrum 1 weight 0.10000E+01 volume 0.23403E-02 ppm1 4.045 ppm2 1.616 CV 1
OR { 355}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HG3 ))
ASSI { 356}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HB2 ))
2.600 0.800 0.800 peak 356 spectrum 1 weight 0.10000E+01 volume 0.20975E-02 ppm1 4.045 ppm2 1.806 CV 1
OR { 356}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HB3 ))
OR { 356}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB3 ))
ASSI { 365}
(( segid " " and resid 46 and name HB3 ))
(( segid " " and resid 46 and name HE ))
2.400 0.700 0.700 peak 365 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 1.601 ppm2 7.281 CV 1
OR { 365}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HE ))
ASSI { 366}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 46 and name HE ))
2.400 2.400 3.600 peak 366 spectrum 1 weight 0.10000E+01 volume 0.33016E-02 ppm1 1.497 ppm2 7.281 CV 1
ASSI { 367}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 46 and name HE ))
2.500 0.800 0.800 peak 367 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 3.218 ppm2 7.270 CV 1
OR { 367}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HE ))
ASSI { 374}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HE ))
2.500 0.800 0.800 peak 374 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 3.217 ppm2 7.351 CV 1
ASSI { 375}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 53 and name HN ))
2.400 2.400 3.600 peak 375 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 1.945 ppm2 7.615 CV 1
ASSI { 376}
(( segid " " and resid 53 and name HG3 ))
(( segid " " and resid 53 and name HN ))
2.500 0.800 0.800 peak 376 spectrum 1 weight 0.10000E+01 volume 0.26510E-02 ppm1 1.667 ppm2 7.621 CV 1
ASSI { 378}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HN ))
2.400 0.700 0.700 peak 378 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 4.003 ppm2 6.910 CV 1
ASSI { 379}
(( segid " " and resid 8 and name HA1 ))
(( segid " " and resid 8 and name HN ))
2.500 0.800 0.800 peak 379 spectrum 1 weight 0.10000E+01 volume 0.25248E-02 ppm1 4.545 ppm2 9.455 CV 1
ASSI { 380}
(( segid " " and resid 14 and name HA1 ))
(( segid " " and resid 14 and name HN ))
2.500 0.800 0.800 peak 380 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 4.435 ppm2 9.301 CV 1
ASSI { 381}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HN ))
2.600 0.800 0.800 peak 381 spectrum 1 weight 0.10000E+01 volume 0.20295E-02 ppm1 4.728 ppm2 8.645 CV 1
ASSI { 383}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HA ))
2.400 0.700 0.700 peak 383 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 2.917 ppm2 5.752 CV 1
ASSI { 384}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HA ))
2.400 0.700 0.700 peak 384 spectrum 1 weight 0.10000E+01 volume 0.31365E-02 ppm1 2.772 ppm2 5.606 CV 1
ASSI { 385}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HA ))
2.400 0.700 0.700 peak 385 spectrum 1 weight 0.10000E+01 volume 0.30783E-02 ppm1 2.636 ppm2 5.869 CV 1
ASSI { 386}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HA ))
2.400 0.700 0.700 peak 386 spectrum 1 weight 0.10000E+01 volume 0.30588E-02 ppm1 2.528 ppm2 5.786 CV 1
ASSI { 387}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HA ))
2.300 0.700 0.700 peak 387 spectrum 1 weight 0.10000E+01 volume 0.37774E-02 ppm1 1.859 ppm2 5.665 CV 1
ASSI { 390}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HA ))
2.500 0.800 0.800 peak 390 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 1.772 ppm2 6.096 CV 1
OR { 390}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 55 and name HA ))
ASSI { 392}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HE ))
2.300 2.300 3.700 peak 392 spectrum 1 weight 0.10000E+01 volume 0.43601E-02 ppm1 2.050 ppm2 7.354 CV 1
ASSI { 393}
(( segid " " and resid 99 and name HB2 ))
(( segid " " and resid 99 and name HE ))
2.400 0.700 0.700 peak 393 spectrum 1 weight 0.10000E+01 volume 0.29423E-02 ppm1 1.813 ppm2 7.356 CV 1
OR { 393}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 39 and name HE ))
ASSI { 395}
( segid " " and resid 83 and name HG2%)
(( segid " " and resid 83 and name HN ))
2.500 0.800 0.800 peak 395 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 1.209 ppm2 8.210 CV 1
ASSI { 396}
(( segid " " and resid 83 and name HB ))
( segid " " and resid 83 and name HG2%)
2.600 0.800 0.800 peak 396 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 4.220 ppm2 1.224 CV 1
ASSI { 397}
(( segid " " and resid 83 and name HA ))
( segid " " and resid 83 and name HG2%)
2.500 0.800 0.800 peak 397 spectrum 1 weight 0.10000E+01 volume 0.25345E-02 ppm1 4.305 ppm2 1.222 CV 1
ASSI { 398}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HB ))
2.300 0.700 0.700 peak 398 spectrum 1 weight 0.10000E+01 volume 0.36124E-02 ppm1 4.308 ppm2 4.218 CV 1
ASSI { 399}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HB2 ))
2.400 2.400 3.600 peak 399 spectrum 1 weight 0.10000E+01 volume 0.31948E-02 ppm1 3.198 ppm2 2.052 CV 1
ASSI { 400}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HG2 ))
2.600 0.900 0.900 peak 400 spectrum 1 weight 0.10000E+01 volume 0.18547E-02 ppm1 3.200 ppm2 1.808 CV 1
OR { 400}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HG3 ))
OR { 400}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HB3 ))
ASSI { 404}
(( segid " " and resid 84 and name HG ))
(( segid " " and resid 84 and name HN ))
2.400 0.700 0.700 peak 404 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 1.245 ppm2 8.212 CV 1
ASSI { 405}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HB ))
2.500 0.800 0.800 peak 405 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 4.395 ppm2 4.237 CV 1
ASSI { 406}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HG ))
2.600 0.900 0.900 peak 406 spectrum 1 weight 0.10000E+01 volume 0.19227E-02 ppm1 4.388 ppm2 1.244 CV 1
ASSI { 411}
(( segid " " and resid 37 and name HA1 ))
(( segid " " and resid 37 and name HA2 ))
2.600 0.800 0.800 peak 411 spectrum 1 weight 0.10000E+01 volume 0.21946E-02 ppm1 4.232 ppm2 3.959 CV 1
ASSI { 412}
(( segid " " and resid 86 and name HA2 ))
(( segid " " and resid 86 and name HN ))
6.000 4.500 0.000 peak 412 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.968 ppm2 8.468 CV 1
ASSI { 413}
(( segid " " and resid 14 and name HA2 ))
(( segid " " and resid 14 and name HN ))
2.500 0.800 0.800 peak 413 spectrum 1 weight 0.10000E+01 volume 0.23305E-02 ppm1 3.625 ppm2 9.301 CV 1
ASSI { 414}
(( segid " " and resid 14 and name HA1 ))
(( segid " " and resid 14 and name HA2 ))
2.600 0.900 0.900 peak 414 spectrum 1 weight 0.10000E+01 volume 0.18644E-02 ppm1 4.435 ppm2 3.627 CV 1
ASSI { 418}
( segid " " and resid 31 and name HD1%)
(( segid " " and resid 31 and name HN ))
2.500 2.500 3.500 peak 418 spectrum 1 weight 0.10000E+01 volume 0.26219E-02 ppm1 -1.001 ppm2 6.912 CV 1
OR { 418}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 31 and name HN ))
ASSI { 420}
(( segid " " and resid 31 and name HG ))
(( segid " " and resid 31 and name HN ))
2.400 2.400 3.600 peak 420 spectrum 1 weight 0.10000E+01 volume 0.31754E-02 ppm1 0.894 ppm2 6.921 CV 1
ASSI { 421}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 31 and name HG ))
2.500 0.800 0.800 peak 421 spectrum 1 weight 0.10000E+01 volume 0.25248E-02 ppm1 3.987 ppm2 0.888 CV 1
ASSI { 423}
(( segid " " and resid 31 and name HG ))
( segid " " and resid 31 and name HD1%)
2.500 0.800 0.800 peak 423 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 0.874 ppm2 -1.002 CV 1
OR { 423}
(( segid " " and resid 31 and name HG ))
( segid " " and resid 31 and name HD2%)
ASSI { 426}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 100 and name HN ))
2.500 0.800 0.800 peak 426 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 0.972 ppm2 8.838 CV 1
ASSI { 428}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HB3 ))
2.400 0.700 0.700 peak 428 spectrum 1 weight 0.10000E+01 volume 0.28161E-02 ppm1 4.589 ppm2 0.324 CV 1
ASSI { 434}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 89 and name HZ ))
2.300 2.300 3.700 peak 434 spectrum 1 weight 0.10000E+01 volume 0.41659E-02 ppm1 7.282 ppm2 8.513 CV 1
ASSI { 435}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HB3 ))
2.400 0.700 0.700 peak 435 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 4.988 ppm2 2.717 CV 1
ASSI { 436}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB2 ))
2.400 0.700 0.700 peak 436 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 4.303 ppm2 1.720 CV 1
OR { 436}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB3 ))
ASSI { 437}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 24 and name HN ))
2.400 2.400 3.600 peak 437 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 2.292 ppm2 7.955 CV 1
ASSI { 438}
(( segid " " and resid 24 and name HG3 ))
(( segid " " and resid 24 and name HN ))
2.400 2.400 3.600 peak 438 spectrum 1 weight 0.10000E+01 volume 0.33599E-02 ppm1 2.153 ppm2 7.953 CV 1
ASSI { 441}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HN ))
2.500 2.500 3.500 peak 441 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 1.716 ppm2 7.952 CV 1
ASSI { 443}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HG3 ))
2.500 2.500 3.500 peak 443 spectrum 1 weight 0.10000E+01 volume 0.25151E-02 ppm1 4.303 ppm2 2.153 CV 1
ASSI { 444}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HN ))
2.500 0.800 0.800 peak 444 spectrum 1 weight 0.10000E+01 volume 0.22626E-02 ppm1 4.310 ppm2 8.213 CV 1
ASSI { 445}
( segid " " and resid 108 and name HB% )
(( segid " " and resid 108 and name HN ))
2.600 0.800 0.800 peak 445 spectrum 1 weight 0.10000E+01 volume 0.21072E-02 ppm1 1.383 ppm2 8.217 CV 1
ASSI { 446}
(( segid " " and resid 108 and name HA ))
( segid " " and resid 108 and name HB% )
2.600 0.800 0.800 peak 446 spectrum 1 weight 0.10000E+01 volume 0.20392E-02 ppm1 4.290 ppm2 1.378 CV 1
ASSI { 447}
(( segid " " and resid 111 and name HG13))
(( segid " " and resid 111 and name HN ))
2.400 0.700 0.700 peak 447 spectrum 1 weight 0.10000E+01 volume 0.33502E-02 ppm1 0.914 ppm2 7.987 CV 1
OR { 447}
(( segid " " and resid 111 and name HG12))
(( segid " " and resid 111 and name HN ))
ASSI { 448}
( segid " " and resid 111 and name HD1%)
(( segid " " and resid 111 and name HN ))
2.400 0.700 0.700 peak 448 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 0.873 ppm2 7.987 CV 1
ASSI { 449}
(( segid " " and resid 111 and name HA ))
( segid " " and resid 111 and name HD1%)
2.400 2.400 3.600 peak 449 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 4.207 ppm2 0.857 CV 1
ASSI { 450}
(( segid " " and resid 111 and name HB ))
( segid " " and resid 111 and name HD1%)
2.500 0.800 0.800 peak 450 spectrum 1 weight 0.10000E+01 volume 0.22140E-02 ppm1 1.859 ppm2 0.856 CV 1
ASSI { 452}
( segid " " and resid 84 and name HD1%)
(( segid " " and resid 84 and name HN ))
2.300 0.700 0.700 peak 452 spectrum 1 weight 0.10000E+01 volume 0.38940E-02 ppm1 0.915 ppm2 8.200 CV 1
ASSI { 454}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 84 and name HD2%)
2.400 0.700 0.700 peak 454 spectrum 1 weight 0.10000E+01 volume 0.33113E-02 ppm1 4.381 ppm2 0.904 CV 1
ASSI { 456}
(( segid " " and resid 84 and name HB2 ))
( segid " " and resid 84 and name HD2%)
6.000 4.500 0.000 peak 456 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.673 ppm2 0.901 CV 1
ASSI { 459}
(( segid " " and resid 84 and name HB3 ))
( segid " " and resid 84 and name HD1%)
2.600 0.800 0.800 peak 459 spectrum 1 weight 0.10000E+01 volume 0.21655E-02 ppm1 1.619 ppm2 0.849 CV 1
ASSI { 460}
(( segid " " and resid 92 and name HG3 ))
(( segid " " and resid 92 and name HN ))
2.500 0.800 0.800 peak 460 spectrum 1 weight 0.10000E+01 volume 0.24568E-02 ppm1 2.413 ppm2 9.000 CV 1
OR { 460}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 92 and name HN ))
ASSI { 461}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 92 and name HN ))
2.600 0.800 0.800 peak 461 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 2.145 ppm2 8.999 CV 1
OR { 461}
(( segid " " and resid 92 and name HB3 ))
(( segid " " and resid 92 and name HN ))
ASSI { 464}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HB3 ))
2.500 0.800 0.800 peak 464 spectrum 1 weight 0.10000E+01 volume 0.25345E-02 ppm1 4.263 ppm2 2.129 CV 1
OR { 464}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HB2 ))
ASSI { 465}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HG2 ))
2.500 0.800 0.800 peak 465 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 4.260 ppm2 2.415 CV 1
OR { 465}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HG3 ))
ASSI { 467}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 35 and name HN ))
2.500 0.800 0.800 peak 467 spectrum 1 weight 0.10000E+01 volume 0.25151E-02 ppm1 1.643 ppm2 9.066 CV 1
ASSI { 468}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 89 and name HN ))
2.400 0.700 0.700 peak 468 spectrum 1 weight 0.10000E+01 volume 0.34861E-02 ppm1 4.701 ppm2 8.388 CV 1
ASSI { 469}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 89 and name HN ))
2.500 2.500 3.500 peak 469 spectrum 1 weight 0.10000E+01 volume 0.23403E-02 ppm1 3.046 ppm2 8.395 CV 1
ASSI { 470}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HN ))
2.500 2.500 3.500 peak 470 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 3.245 ppm2 8.399 CV 1
ASSI { 472}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HB3 ))
2.700 0.900 0.900 peak 472 spectrum 1 weight 0.10000E+01 volume 0.17479E-02 ppm1 3.242 ppm2 3.037 CV 1
ASSI { 476}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 89 and name HB2 ))
6.000 4.500 0.000 peak 476 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.705 ppm2 3.234 CV 1
ASSI { 486}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HB ))
2.500 0.800 0.800 peak 486 spectrum 1 weight 0.10000E+01 volume 0.23403E-02 ppm1 3.563 ppm2 2.071 CV 1
ASSI { 487}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 22 and name HN ))
2.400 0.700 0.700 peak 487 spectrum 1 weight 0.10000E+01 volume 0.35832E-02 ppm1 2.087 ppm2 10.053 CV 1
ASSI { 488}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 22 and name HN ))
2.500 2.500 3.500 peak 488 spectrum 1 weight 0.10000E+01 volume 0.23985E-02 ppm1 0.495 ppm2 10.056 CV 1
ASSI { 489}
(( segid " " and resid 22 and name HG13))
(( segid " " and resid 22 and name HN ))
2.400 0.700 0.700 peak 489 spectrum 1 weight 0.10000E+01 volume 0.35152E-02 ppm1 1.150 ppm2 10.051 CV 1
ASSI { 493}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HG13))
2.300 2.300 3.700 peak 493 spectrum 1 weight 0.10000E+01 volume 0.43406E-02 ppm1 3.556 ppm2 1.141 CV 1
ASSI { 494}
(( segid " " and resid 13 and name HB ))
( segid " " and resid 13 and name HG2%)
2.600 0.900 0.900 peak 494 spectrum 1 weight 0.10000E+01 volume 0.18256E-02 ppm1 1.168 ppm2 0.485 CV 1
ASSI { 496}
(( segid " " and resid 22 and name HB ))
( segid " " and resid 22 and name HG2%)
2.500 0.800 0.800 peak 496 spectrum 1 weight 0.10000E+01 volume 0.22237E-02 ppm1 2.077 ppm2 0.494 CV 1
ASSI { 497}
(( segid " " and resid 22 and name HB ))
( segid " " and resid 22 and name HD1%)
2.500 0.800 0.800 peak 497 spectrum 1 weight 0.10000E+01 volume 0.22140E-02 ppm1 2.082 ppm2 0.600 CV 1
ASSI { 498}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 22 and name HD1%)
2.600 0.800 0.800 peak 498 spectrum 1 weight 0.10000E+01 volume 0.19713E-02 ppm1 1.729 ppm2 0.600 CV 1
ASSI { 499}
( segid " " and resid 22 and name HD1%)
( segid " " and resid 22 and name HG2%)
2.500 0.800 0.800 peak 499 spectrum 1 weight 0.10000E+01 volume 0.22334E-02 ppm1 0.623 ppm2 0.485 CV 1
ASSI { 500}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HN ))
2.400 0.700 0.700 peak 500 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 3.996 ppm2 9.959 CV 1
ASSI { 501}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 27 and name HN ))
2.500 0.800 0.800 peak 501 spectrum 1 weight 0.10000E+01 volume 0.22334E-02 ppm1 5.872 ppm2 9.162 CV 1
ASSI { 502}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HN ))
2.300 2.300 3.700 peak 502 spectrum 1 weight 0.10000E+01 volume 0.36124E-02 ppm1 2.636 ppm2 9.355 CV 1
ASSI { 503}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HN ))
2.300 0.600 0.600 peak 503 spectrum 1 weight 0.10000E+01 volume 0.46028E-02 ppm1 2.636 ppm2 9.166 CV 1
ASSI { 504}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HN ))
2.400 0.700 0.700 peak 504 spectrum 1 weight 0.10000E+01 volume 0.30297E-02 ppm1 2.968 ppm2 9.668 CV 1
ASSI { 505}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 34 and name HN ))
2.500 0.800 0.800 peak 505 spectrum 1 weight 0.10000E+01 volume 0.26219E-02 ppm1 2.612 ppm2 9.668 CV 1
ASSI { 506}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name HN ))
2.400 2.400 3.600 peak 506 spectrum 1 weight 0.10000E+01 volume 0.31948E-02 ppm1 4.595 ppm2 9.071 CV 1
ASSI { 507}
( segid " " and resid 35 and name HD1%)
(( segid " " and resid 35 and name HN ))
2.400 2.400 3.600 peak 507 spectrum 1 weight 0.10000E+01 volume 0.28161E-02 ppm1 0.982 ppm2 9.066 CV 1
OR { 507}
( segid " " and resid 35 and name HD2%)
(( segid " " and resid 35 and name HN ))
ASSI { 510}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 49 and name HD% )
2.400 2.400 3.600 peak 510 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 5.747 ppm2 6.719 CV 1
ASSI { 512}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HN ))
2.400 0.700 0.700 peak 512 spectrum 1 weight 0.10000E+01 volume 0.35541E-02 ppm1 5.763 ppm2 8.837 CV 1
ASSI { 518}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 49 and name HD% )
2.400 0.700 0.700 peak 518 spectrum 1 weight 0.10000E+01 volume 0.35152E-02 ppm1 2.919 ppm2 6.716 CV 1
ASSI { 524}
(( segid " " and resid 101 and name HA ))
( segid " " and resid 17 and name HD% )
2.400 0.700 0.700 peak 524 spectrum 1 weight 0.10000E+01 volume 0.31462E-02 ppm1 4.924 ppm2 6.695 CV 1
ASSI { 529}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 18 and name HN ))
2.600 0.800 0.800 peak 529 spectrum 1 weight 0.10000E+01 volume 0.20781E-02 ppm1 5.624 ppm2 8.698 CV 1
ASSI { 531}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 17 and name HD% )
2.400 0.700 0.700 peak 531 spectrum 1 weight 0.10000E+01 volume 0.32531E-02 ppm1 5.614 ppm2 6.691 CV 1
ASSI { 533}
(( segid " " and resid 17 and name HB3 ))
( segid " " and resid 17 and name HD% )
2.400 0.700 0.700 peak 533 spectrum 1 weight 0.10000E+01 volume 0.31365E-02 ppm1 2.763 ppm2 6.695 CV 1
ASSI { 534}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 17 and name HN ))
2.500 0.800 0.800 peak 534 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 2.770 ppm2 7.878 CV 1
ASSI { 538}
(( segid " " and resid 103 and name HB ))
( segid " " and resid 103 and name HG2%)
2.500 0.800 0.800 peak 538 spectrum 1 weight 0.10000E+01 volume 0.22237E-02 ppm1 4.238 ppm2 1.243 CV 1
ASSI { 539}
(( segid " " and resid 103 and name HA ))
( segid " " and resid 103 and name HG2%)
6.000 4.500 0.000 peak 539 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.393 ppm2 1.242 CV 1
ASSI { 542}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HB2 ))
2.500 0.800 0.800 peak 542 spectrum 1 weight 0.10000E+01 volume 0.26898E-02 ppm1 2.845 ppm2 1.158 CV 1
OR { 542}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HB2 ))
ASSI { 544}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HN ))
2.600 2.600 3.400 peak 544 spectrum 1 weight 0.10000E+01 volume 0.20975E-02 ppm1 4.671 ppm2 10.048 CV 1
ASSI { 545}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HN ))
2.500 2.500 3.500 peak 545 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 3.552 ppm2 8.686 CV 1
ASSI { 546}
(( segid " " and resid 7 and name HA2 ))
(( segid " " and resid 7 and name HN ))
2.500 0.800 0.800 peak 546 spectrum 1 weight 0.10000E+01 volume 0.25830E-02 ppm1 2.353 ppm2 9.049 CV 1
ASSI { 547}
(( segid " " and resid 7 and name HA1 ))
(( segid " " and resid 7 and name HN ))
2.500 0.800 0.800 peak 547 spectrum 1 weight 0.10000E+01 volume 0.25248E-02 ppm1 3.654 ppm2 9.047 CV 1
ASSI { 549}
(( segid " " and resid 7 and name HA2 ))
(( segid " " and resid 8 and name HN ))
2.400 2.400 3.600 peak 549 spectrum 1 weight 0.10000E+01 volume 0.34570E-02 ppm1 2.356 ppm2 9.452 CV 1
ASSI { 550}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 5 and name HN ))
2.500 2.500 3.500 peak 550 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 0.884 ppm2 8.128 CV 1
ASSI { 551}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 108 and name HN ))
2.600 0.800 0.800 peak 551 spectrum 1 weight 0.10000E+01 volume 0.22043E-02 ppm1 4.209 ppm2 8.212 CV 1
ASSI { 552}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 107 and name HN ))
2.400 2.400 3.600 peak 552 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 4.489 ppm2 8.024 CV 1
ASSI { 553}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 107 and name HN ))
2.400 0.700 0.700 peak 553 spectrum 1 weight 0.10000E+01 volume 0.32919E-02 ppm1 2.632 ppm2 8.021 CV 1
ASSI { 554}
(( segid " " and resid 106 and name HB3 ))
(( segid " " and resid 107 and name HN ))
2.400 0.700 0.700 peak 554 spectrum 1 weight 0.10000E+01 volume 0.34764E-02 ppm1 2.527 ppm2 8.023 CV 1
ASSI { 555}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 106 and name HN ))
2.600 2.600 3.400 peak 555 spectrum 1 weight 0.10000E+01 volume 0.20101E-02 ppm1 4.362 ppm2 8.152 CV 1
ASSI { 556}
(( segid " " and resid 105 and name HB3 ))
(( segid " " and resid 106 and name HN ))
2.400 2.400 3.600 peak 556 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 3.003 ppm2 8.151 CV 1
ASSI { 557}
(( segid " " and resid 105 and name HB2 ))
(( segid " " and resid 106 and name HN ))
2.400 2.400 3.600 peak 557 spectrum 1 weight 0.10000E+01 volume 0.30491E-02 ppm1 3.077 ppm2 8.152 CV 1
ASSI { 560}
(( segid " " and resid 104 and name HB2 ))
(( segid " " and resid 105 and name HN ))
2.300 2.300 3.700 peak 560 spectrum 1 weight 0.10000E+01 volume 0.39716E-02 ppm1 2.110 ppm2 7.638 CV 1
ASSI { 561}
(( segid " " and resid 104 and name HB3 ))
(( segid " " and resid 105 and name HN ))
2.400 2.400 3.600 peak 561 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 1.932 ppm2 7.624 CV 1
ASSI { 563}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HN ))
2.500 0.800 0.800 peak 563 spectrum 1 weight 0.10000E+01 volume 0.24277E-02 ppm1 4.410 ppm2 8.416 CV 1
ASSI { 564}
( segid " " and resid 103 and name HG2%)
(( segid " " and resid 103 and name HN ))
2.500 2.500 3.500 peak 564 spectrum 1 weight 0.10000E+01 volume 0.22917E-02 ppm1 1.253 ppm2 8.406 CV 1
ASSI { 565}
(( segid " " and resid 103 and name HB ))
(( segid " " and resid 104 and name HN ))
2.500 0.800 0.800 peak 565 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 4.245 ppm2 8.112 CV 1
ASSI { 566}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 104 and name HN ))
2.400 2.400 3.600 peak 566 spectrum 1 weight 0.10000E+01 volume 0.31268E-02 ppm1 4.409 ppm2 8.114 CV 1
ASSI { 567}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HN ))
2.500 0.800 0.800 peak 567 spectrum 1 weight 0.10000E+01 volume 0.26510E-02 ppm1 3.226 ppm2 9.332 CV 1
ASSI { 568}
(( segid " " and resid 102 and name HB3 ))
(( segid " " and resid 102 and name HN ))
2.500 0.800 0.800 peak 568 spectrum 1 weight 0.10000E+01 volume 0.27190E-02 ppm1 2.807 ppm2 9.328 CV 1
ASSI { 569}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HB3 ))
2.500 0.800 0.800 peak 569 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 4.796 ppm2 2.802 CV 1
ASSI { 570}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HB2 ))
2.500 0.800 0.800 peak 570 spectrum 1 weight 0.10000E+01 volume 0.26704E-02 ppm1 4.808 ppm2 3.231 CV 1
ASSI { 571}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HB3 ))
2.600 0.800 0.800 peak 571 spectrum 1 weight 0.10000E+01 volume 0.20781E-02 ppm1 3.224 ppm2 2.807 CV 1
ASSI { 573}
(( segid " " and resid 102 and name HB3 ))
(( segid " " and resid 103 and name HN ))
2.400 2.400 3.600 peak 573 spectrum 1 weight 0.10000E+01 volume 0.35055E-02 ppm1 2.818 ppm2 8.408 CV 1
ASSI { 577}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 21 and name HN ))
2.600 0.800 0.800 peak 577 spectrum 1 weight 0.10000E+01 volume 0.21655E-02 ppm1 5.555 ppm2 9.135 CV 1
ASSI { 579}
(( segid " " and resid 26 and name HZ2 ))
(( segid " " and resid 26 and name HH2 ))
6.000 4.500 0.000 peak 579 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 7.045 ppm2 7.107 CV 1
ASSI { 582}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name HN ))
2.500 0.800 0.800 peak 582 spectrum 1 weight 0.10000E+01 volume 0.23694E-02 ppm1 5.353 ppm2 8.604 CV 1
ASSI { 583}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 63 and name HN ))
2.400 2.400 3.600 peak 583 spectrum 1 weight 0.10000E+01 volume 0.28743E-02 ppm1 4.034 ppm2 7.481 CV 1
ASSI { 584}
(( segid " " and resid 64 and name HA2 ))
(( segid " " and resid 65 and name HN ))
2.500 2.500 3.500 peak 584 spectrum 1 weight 0.10000E+01 volume 0.23597E-02 ppm1 3.692 ppm2 7.932 CV 1
ASSI { 585}
(( segid " " and resid 64 and name HA1 ))
(( segid " " and resid 65 and name HN ))
2.400 2.400 3.600 peak 585 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 3.920 ppm2 7.933 CV 1
ASSI { 586}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HN ))
2.400 2.400 3.600 peak 586 spectrum 1 weight 0.10000E+01 volume 0.34958E-02 ppm1 4.194 ppm2 7.653 CV 1
ASSI { 588}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HA ))
2.400 0.700 0.700 peak 588 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 2.801 ppm2 5.786 CV 1
ASSI { 590}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 25 and name HD% )
2.500 0.800 0.800 peak 590 spectrum 1 weight 0.10000E+01 volume 0.23694E-02 ppm1 2.793 ppm2 7.162 CV 1
ASSI { 592}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 25 and name HD% )
2.400 0.700 0.700 peak 592 spectrum 1 weight 0.10000E+01 volume 0.34376E-02 ppm1 2.532 ppm2 6.777 CV 1
ASSI { 593}
(( segid " " and resid 20 and name HA ))
( segid " " and resid 25 and name HD% )
2.500 2.500 3.500 peak 593 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 5.556 ppm2 7.162 CV 1
ASSI { 596}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 25 and name HD% )
2.400 0.700 0.700 peak 596 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 5.787 ppm2 6.775 CV 1
ASSI { 597}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 25 and name HA ))
2.300 2.300 3.700 peak 597 spectrum 1 weight 0.10000E+01 volume 0.43406E-02 ppm1 5.558 ppm2 5.789 CV 1
ASSI { 599}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HN ))
2.400 0.700 0.700 peak 599 spectrum 1 weight 0.10000E+01 volume 0.30200E-02 ppm1 3.584 ppm2 8.967 CV 1
ASSI { 600}
(( segid " " and resid 57 and name HD3 ))
(( segid " " and resid 57 and name HN ))
2.300 2.300 3.700 peak 600 spectrum 1 weight 0.10000E+01 volume 0.37289E-02 ppm1 3.159 ppm2 8.965 CV 1
OR { 600}
(( segid " " and resid 57 and name HD2 ))
(( segid " " and resid 57 and name HN ))
ASSI { 610}
(( segid " " and resid 12 and name HD22))
(( segid " " and resid 12 and name HD21))
2.600 0.900 0.900 peak 610 spectrum 1 weight 0.10000E+01 volume 0.18450E-02 ppm1 6.854 ppm2 7.464 CV 1
ASSI { 612}
(( segid " " and resid 10 and name HE22))
(( segid " " and resid 10 and name HE21))
2.700 0.900 0.900 peak 612 spectrum 1 weight 0.10000E+01 volume 0.17285E-02 ppm1 6.798 ppm2 7.459 CV 1
ASSI { 613}
(( segid " " and resid 104 and name HE22))
(( segid " " and resid 104 and name HE21))
2.700 0.900 0.900 peak 613 spectrum 1 weight 0.10000E+01 volume 0.16508E-02 ppm1 6.567 ppm2 7.228 CV 1
ASSI { 614}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 18 and name HZ ))
2.600 2.600 3.400 peak 614 spectrum 1 weight 0.10000E+01 volume 0.18159E-02 ppm1 6.932 ppm2 7.437 CV 1
ASSI { 615}
(( segid " " and resid 24 and name HE22))
(( segid " " and resid 24 and name HE21))
2.700 0.900 0.900 peak 615 spectrum 1 weight 0.10000E+01 volume 0.16605E-02 ppm1 6.953 ppm2 7.311 CV 1
ASSI { 618}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 6 and name HN ))
2.400 2.400 3.600 peak 618 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 3.639 ppm2 8.128 CV 1
ASSI { 620}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HN ))
2.500 0.800 0.800 peak 620 spectrum 1 weight 0.10000E+01 volume 0.25927E-02 ppm1 3.419 ppm2 8.131 CV 1
ASSI { 621}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 6 and name HN ))
2.500 0.800 0.800 peak 621 spectrum 1 weight 0.10000E+01 volume 0.27287E-02 ppm1 2.279 ppm2 8.131 CV 1
ASSI { 624}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 7 and name HN ))
2.300 2.300 3.700 peak 624 spectrum 1 weight 0.10000E+01 volume 0.45446E-02 ppm1 2.285 ppm2 9.047 CV 1
ASSI { 625}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HN ))
2.500 2.500 3.500 peak 625 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 3.108 ppm2 8.865 CV 1
ASSI { 628}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 56 and name HN ))
2.300 2.300 3.700 peak 628 spectrum 1 weight 0.10000E+01 volume 0.38260E-02 ppm1 3.004 ppm2 8.734 CV 1
ASSI { 629}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 95 and name HN ))
2.400 0.700 0.700 peak 629 spectrum 1 weight 0.10000E+01 volume 0.34473E-02 ppm1 1.568 ppm2 8.735 CV 1
ASSI { 630}
(( segid " " and resid 95 and name HG2 ))
(( segid " " and resid 95 and name HN ))
2.300 2.300 3.700 peak 630 spectrum 1 weight 0.10000E+01 volume 0.40008E-02 ppm1 1.985 ppm2 8.734 CV 1
ASSI { 636}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 17 and name HN ))
2.400 2.400 3.600 peak 636 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 1.173 ppm2 7.874 CV 1
ASSI { 637}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 17 and name HN ))
2.500 2.500 3.500 peak 637 spectrum 1 weight 0.10000E+01 volume 0.27287E-02 ppm1 1.369 ppm2 7.874 CV 1
ASSI { 641}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HN ))
2.500 2.500 3.500 peak 641 spectrum 1 weight 0.10000E+01 volume 0.27772E-02 ppm1 3.418 ppm2 6.557 CV 1
ASSI { 642}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 15 and name HN ))
2.500 2.500 3.500 peak 642 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 2.587 ppm2 6.564 CV 1
ASSI { 643}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 16 and name HN ))
2.500 0.800 0.800 peak 643 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 3.401 ppm2 8.537 CV 1
ASSI { 644}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 16 and name HN ))
2.300 0.700 0.700 peak 644 spectrum 1 weight 0.10000E+01 volume 0.36124E-02 ppm1 2.599 ppm2 8.535 CV 1
ASSI { 646}
(( segid " " and resid 14 and name HA1 ))
(( segid " " and resid 15 and name HN ))
2.500 0.800 0.800 peak 646 spectrum 1 weight 0.10000E+01 volume 0.27384E-02 ppm1 4.442 ppm2 6.557 CV 1
ASSI { 647}
(( segid " " and resid 14 and name HA2 ))
(( segid " " and resid 15 and name HN ))
2.400 2.400 3.600 peak 647 spectrum 1 weight 0.10000E+01 volume 0.29035E-02 ppm1 3.637 ppm2 6.557 CV 1
ASSI { 648}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HN ))
2.400 2.400 3.600 peak 648 spectrum 1 weight 0.10000E+01 volume 0.35832E-02 ppm1 2.799 ppm2 8.438 CV 1
ASSI { 649}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 25 and name HN ))
2.400 2.400 3.600 peak 649 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 2.538 ppm2 8.438 CV 1
ASSI { 650}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HN ))
2.500 0.800 0.800 peak 650 spectrum 1 weight 0.10000E+01 volume 0.23305E-02 ppm1 4.296 ppm2 8.437 CV 1
ASSI { 651}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 25 and name HN ))
2.400 2.400 3.600 peak 651 spectrum 1 weight 0.10000E+01 volume 0.35735E-02 ppm1 2.289 ppm2 8.440 CV 1
ASSI { 652}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 25 and name HN ))
2.400 2.400 3.600 peak 652 spectrum 1 weight 0.10000E+01 volume 0.31754E-02 ppm1 1.716 ppm2 8.438 CV 1
ASSI { 653}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 26 and name HN ))
2.400 2.400 3.600 peak 653 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 2.799 ppm2 9.355 CV 1
ASSI { 654}
(( segid " " and resid 25 and name HB3 ))
(( segid " " and resid 26 and name HN ))
2.300 2.300 3.700 peak 654 spectrum 1 weight 0.10000E+01 volume 0.37871E-02 ppm1 2.538 ppm2 9.352 CV 1
ASSI { 655}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 26 and name HN ))
2.500 0.800 0.800 peak 655 spectrum 1 weight 0.10000E+01 volume 0.22723E-02 ppm1 5.784 ppm2 9.357 CV 1
ASSI { 656}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 27 and name HN ))
2.400 2.400 3.600 peak 656 spectrum 1 weight 0.10000E+01 volume 0.35152E-02 ppm1 3.732 ppm2 9.169 CV 1
ASSI { 657}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HN ))
2.400 0.700 0.700 peak 657 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 3.931 ppm2 9.165 CV 1
ASSI { 658}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 28 and name HN ))
2.400 0.700 0.700 peak 658 spectrum 1 weight 0.10000E+01 volume 0.32628E-02 ppm1 3.741 ppm2 9.958 CV 1
ASSI { 659}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 28 and name HN ))
2.100 2.100 3.900 peak 659 spectrum 1 weight 0.10000E+01 volume 0.77588E-02 ppm1 3.931 ppm2 9.958 CV 1
ASSI { 661}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 28 and name HN ))
2.500 2.500 3.500 peak 661 spectrum 1 weight 0.10000E+01 volume 0.26801E-02 ppm1 2.568 ppm2 9.955 CV 1
OR { 661}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 28 and name HN ))
ASSI { 662}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HN ))
2.500 0.800 0.800 peak 662 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 2.209 ppm2 9.955 CV 1
ASSI { 663}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 28 and name HN ))
2.500 0.800 0.800 peak 663 spectrum 1 weight 0.10000E+01 volume 0.24762E-02 ppm1 2.139 ppm2 9.955 CV 1
ASSI { 664}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 29 and name HN ))
2.400 2.400 3.600 peak 664 spectrum 1 weight 0.10000E+01 volume 0.33307E-02 ppm1 3.991 ppm2 8.641 CV 1
ASSI { 665}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 29 and name HN ))
2.400 2.400 3.600 peak 665 spectrum 1 weight 0.10000E+01 volume 0.31462E-02 ppm1 2.150 ppm2 8.638 CV 1
ASSI { 667}
(( segid " " and resid 28 and name HG2 ))
(( segid " " and resid 29 and name HN ))
2.300 2.300 3.700 peak 667 spectrum 1 weight 0.10000E+01 volume 0.36803E-02 ppm1 2.556 ppm2 8.638 CV 1
OR { 667}
(( segid " " and resid 28 and name HG3 ))
(( segid " " and resid 29 and name HN ))
ASSI { 668}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 92 and name HN ))
2.500 2.500 3.500 peak 668 spectrum 1 weight 0.10000E+01 volume 0.23985E-02 ppm1 4.675 ppm2 8.995 CV 1
ASSI { 669}
(( segid " " and resid 91 and name HB3 ))
(( segid " " and resid 92 and name HN ))
2.400 2.400 3.600 peak 669 spectrum 1 weight 0.10000E+01 volume 0.33502E-02 ppm1 2.771 ppm2 8.991 CV 1
ASSI { 670}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 92 and name HN ))
2.400 0.700 0.700 peak 670 spectrum 1 weight 0.10000E+01 volume 0.33793E-02 ppm1 2.819 ppm2 8.992 CV 1
ASSI { 671}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 93 and name HN ))
2.400 0.700 0.700 peak 671 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 2.138 ppm2 8.486 CV 1
OR { 671}
(( segid " " and resid 92 and name HB3 ))
(( segid " " and resid 93 and name HN ))
ASSI { 672}
(( segid " " and resid 92 and name HG3 ))
(( segid " " and resid 93 and name HN ))
2.400 2.400 3.600 peak 672 spectrum 1 weight 0.10000E+01 volume 0.32628E-02 ppm1 2.413 ppm2 8.492 CV 1
OR { 672}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 93 and name HN ))
ASSI { 673}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 93 and name HN ))
2.500 2.500 3.500 peak 673 spectrum 1 weight 0.10000E+01 volume 0.26219E-02 ppm1 4.253 ppm2 8.486 CV 1
ASSI { 675}
(( segid " " and resid 26 and name HZ3 ))
(( segid " " and resid 26 and name HH2 ))
2.600 0.800 0.800 peak 675 spectrum 1 weight 0.10000E+01 volume 0.20878E-02 ppm1 6.926 ppm2 7.107 CV 1
ASSI { 676}
(( segid " " and resid 26 and name HZ3 ))
(( segid " " and resid 26 and name HE3 ))
2.500 0.800 0.800 peak 676 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 6.919 ppm2 7.203 CV 1
ASSI { 677}
(( segid " " and resid 26 and name HZ3 ))
(( segid " " and resid 26 and name HZ2 ))
2.500 2.500 3.500 peak 677 spectrum 1 weight 0.10000E+01 volume 0.27093E-02 ppm1 6.926 ppm2 7.049 CV 1
ASSI { 678}
(( segid " " and resid 26 and name HD1 ))
(( segid " " and resid 26 and name HE1 ))
2.500 0.800 0.800 peak 678 spectrum 1 weight 0.10000E+01 volume 0.23500E-02 ppm1 6.919 ppm2 9.896 CV 1
ASSI { 679}
(( segid " " and resid 26 and name HZ2 ))
(( segid " " and resid 26 and name HE1 ))
2.500 0.800 0.800 peak 679 spectrum 1 weight 0.10000E+01 volume 0.27287E-02 ppm1 7.062 ppm2 9.894 CV 1
ASSI { 680}
(( segid " " and resid 26 and name HD1 ))
(( segid " " and resid 26 and name HN ))
2.500 0.800 0.800 peak 680 spectrum 1 weight 0.10000E+01 volume 0.25636E-02 ppm1 6.928 ppm2 9.353 CV 1
ASSI { 687}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HB2 ))
2.600 0.800 0.800 peak 687 spectrum 1 weight 0.10000E+01 volume 0.21072E-02 ppm1 2.919 ppm2 2.338 CV 1
ASSI { 688}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HA ))
2.400 0.700 0.700 peak 688 spectrum 1 weight 0.10000E+01 volume 0.29715E-02 ppm1 2.352 ppm2 5.752 CV 1
ASSI { 689}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HN ))
2.500 2.500 3.500 peak 689 spectrum 1 weight 0.10000E+01 volume 0.26607E-02 ppm1 2.358 ppm2 8.837 CV 1
ASSI { 690}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 49 and name HN ))
2.400 0.700 0.700 peak 690 spectrum 1 weight 0.10000E+01 volume 0.28841E-02 ppm1 2.925 ppm2 8.837 CV 1
ASSI { 692}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 49 and name HD% )
2.300 0.700 0.700 peak 692 spectrum 1 weight 0.10000E+01 volume 0.40785E-02 ppm1 2.336 ppm2 6.719 CV 1
ASSI { 694}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 17 and name HD% )
2.400 0.700 0.700 peak 694 spectrum 1 weight 0.10000E+01 volume 0.32822E-02 ppm1 2.881 ppm2 6.695 CV 1
ASSI { 697}
(( segid " " and resid 105 and name HB3 ))
( segid " " and resid 105 and name HD% )
2.300 0.700 0.700 peak 697 spectrum 1 weight 0.10000E+01 volume 0.41853E-02 ppm1 3.013 ppm2 7.341 CV 1
ASSI { 698}
(( segid " " and resid 105 and name HB2 ))
( segid " " and resid 105 and name HD% )
2.300 0.600 0.600 peak 698 spectrum 1 weight 0.10000E+01 volume 0.44475E-02 ppm1 3.070 ppm2 7.340 CV 1
ASSI { 699}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 105 and name HD% )
2.400 0.700 0.700 peak 699 spectrum 1 weight 0.10000E+01 volume 0.36026E-02 ppm1 4.359 ppm2 7.343 CV 1
ASSI { 702}
( segid " " and resid 105 and name HD% )
(( segid " " and resid 105 and name HN ))
2.500 2.500 3.500 peak 702 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 7.203 ppm2 7.633 CV 1
ASSI { 711}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 26 and name HE3 ))
2.400 0.700 0.700 peak 711 spectrum 1 weight 0.10000E+01 volume 0.31462E-02 ppm1 5.864 ppm2 7.206 CV 1
ASSI { 713}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 26 and name HA ))
2.500 0.800 0.800 peak 713 spectrum 1 weight 0.10000E+01 volume 0.25927E-02 ppm1 3.496 ppm2 5.869 CV 1
ASSI { 714}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 26 and name HB2 ))
2.500 0.800 0.800 peak 714 spectrum 1 weight 0.10000E+01 volume 0.25830E-02 ppm1 3.501 ppm2 2.640 CV 1
ASSI { 720}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HA ))
2.400 0.700 0.700 peak 720 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 2.884 ppm2 5.611 CV 1
ASSI { 721}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HE ))
2.500 0.800 0.800 peak 721 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 2.841 ppm2 7.111 CV 1
OR { 721}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HE ))
ASSI { 722}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HN ))
2.500 0.800 0.800 peak 722 spectrum 1 weight 0.10000E+01 volume 0.22237E-02 ppm1 6.094 ppm2 8.731 CV 1
ASSI { 723}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 55 and name HN ))
2.600 0.800 0.800 peak 723 spectrum 1 weight 0.10000E+01 volume 0.21849E-02 ppm1 5.056 ppm2 9.352 CV 1
ASSI { 724}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HN ))
2.500 0.800 0.800 peak 724 spectrum 1 weight 0.10000E+01 volume 0.22626E-02 ppm1 5.667 ppm2 9.303 CV 1
ASSI { 725}
( segid " " and resid 4 and name HD1%)
(( segid " " and resid 4 and name HN ))
2.400 0.700 0.700 peak 725 spectrum 1 weight 0.10000E+01 volume 0.30200E-02 ppm1 0.102 ppm2 8.348 CV 1
OR { 725}
( segid " " and resid 4 and name HD2%)
(( segid " " and resid 4 and name HN ))
ASSI { 727}
(( segid " " and resid 55 and name HG ))
(( segid " " and resid 55 and name HA ))
2.500 2.500 3.500 peak 727 spectrum 1 weight 0.10000E+01 volume 0.27869E-02 ppm1 1.586 ppm2 6.095 CV 1
ASSI { 728}
( segid " " and resid 55 and name HD2%)
(( segid " " and resid 55 and name HA ))
2.500 0.800 0.800 peak 728 spectrum 1 weight 0.10000E+01 volume 0.26219E-02 ppm1 0.986 ppm2 6.095 CV 1
OR { 728}
( segid " " and resid 55 and name HD1%)
(( segid " " and resid 55 and name HA ))
ASSI { 729}
(( segid " " and resid 55 and name HG ))
( segid " " and resid 55 and name HD2%)
2.600 0.800 0.800 peak 729 spectrum 1 weight 0.10000E+01 volume 0.21460E-02 ppm1 1.583 ppm2 0.973 CV 1
OR { 729}
(( segid " " and resid 55 and name HG ))
( segid " " and resid 55 and name HD1%)
ASSI { 730}
(( segid " " and resid 55 and name HB3 ))
( segid " " and resid 55 and name HD2%)
2.500 0.800 0.800 peak 730 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 1.779 ppm2 0.973 CV 1
OR { 730}
(( segid " " and resid 55 and name HB3 ))
( segid " " and resid 55 and name HD1%)
ASSI { 733}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB2 ))
2.400 0.700 0.700 peak 733 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 6.103 ppm2 1.763 CV 1
OR { 733}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB3 ))
ASSI { 734}
( segid " " and resid 55 and name HD2%)
(( segid " " and resid 55 and name HN ))
2.300 0.700 0.700 peak 734 spectrum 1 weight 0.10000E+01 volume 0.37483E-02 ppm1 0.977 ppm2 9.350 CV 1
ASSI { 735}
(( segid " " and resid 55 and name HG ))
(( segid " " and resid 55 and name HN ))
2.500 2.500 3.500 peak 735 spectrum 1 weight 0.10000E+01 volume 0.27869E-02 ppm1 1.590 ppm2 9.347 CV 1
ASSI { 736}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 55 and name HN ))
2.500 0.800 0.800 peak 736 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 1.772 ppm2 9.349 CV 1
ASSI { 737}
( segid " " and resid 55 and name HD1%)
(( segid " " and resid 56 and name HN ))
2.400 2.400 3.600 peak 737 spectrum 1 weight 0.10000E+01 volume 0.34667E-02 ppm1 0.988 ppm2 8.736 CV 1
OR { 737}
( segid " " and resid 55 and name HD2%)
(( segid " " and resid 56 and name HN ))
ASSI { 738}
(( segid " " and resid 55 and name HG ))
(( segid " " and resid 56 and name HN ))
2.300 0.700 0.700 peak 738 spectrum 1 weight 0.10000E+01 volume 0.39425E-02 ppm1 1.590 ppm2 8.735 CV 1
ASSI { 739}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 56 and name HN ))
2.400 0.700 0.700 peak 739 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 1.758 ppm2 8.735 CV 1
ASSI { 740}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HN ))
2.400 2.400 3.600 peak 740 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 3.427 ppm2 8.730 CV 1
ASSI { 741}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 56 and name HN ))
2.400 2.400 3.600 peak 741 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 2.805 ppm2 8.731 CV 1
ASSI { 742}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HN ))
2.500 0.800 0.800 peak 742 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 4.782 ppm2 8.818 CV 1
ASSI { 743}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 83 and name HN ))
2.600 0.800 0.800 peak 743 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 4.477 ppm2 8.211 CV 1
ASSI { 744}
(( segid " " and resid 82 and name HB3 ))
(( segid " " and resid 83 and name HN ))
2.500 0.800 0.800 peak 744 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 1.936 ppm2 8.203 CV 1
ASSI { 745}
(( segid " " and resid 82 and name HB2 ))
(( segid " " and resid 83 and name HN ))
2.500 0.800 0.800 peak 745 spectrum 1 weight 0.10000E+01 volume 0.26801E-02 ppm1 2.288 ppm2 8.203 CV 1
ASSI { 748}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 19 and name HN ))
2.500 0.800 0.800 peak 748 spectrum 1 weight 0.10000E+01 volume 0.25539E-02 ppm1 4.932 ppm2 9.139 CV 1
ASSI { 749}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 102 and name HN ))
2.600 0.800 0.800 peak 749 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 4.915 ppm2 9.336 CV 1
ASSI { 754}
( segid " " and resid 21 and name HB% )
(( segid " " and resid 22 and name HN ))
2.400 0.700 0.700 peak 754 spectrum 1 weight 0.10000E+01 volume 0.35929E-02 ppm1 1.137 ppm2 10.050 CV 1
ASSI { 757}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 30 and name HN ))
2.400 0.700 0.700 peak 757 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 4.517 ppm2 7.649 CV 1
ASSI { 758}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HN ))
2.400 2.400 3.600 peak 758 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 4.499 ppm2 6.904 CV 1
ASSI { 761}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HN ))
2.500 0.800 0.800 peak 761 spectrum 1 weight 0.10000E+01 volume 0.25927E-02 ppm1 4.011 ppm2 7.628 CV 1
ASSI { 762}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 32 and name HN ))
2.500 2.500 3.500 peak 762 spectrum 1 weight 0.10000E+01 volume 0.26801E-02 ppm1 -0.977 ppm2 7.628 CV 1
ASSI { 763}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HN ))
2.300 2.300 3.700 peak 763 spectrum 1 weight 0.10000E+01 volume 0.40202E-02 ppm1 2.968 ppm2 9.073 CV 1
ASSI { 764}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 35 and name HN ))
2.300 0.600 0.600 peak 764 spectrum 1 weight 0.10000E+01 volume 0.45349E-02 ppm1 2.612 ppm2 9.068 CV 1
ASSI { 765}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HN ))
2.400 2.400 3.600 peak 765 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 4.673 ppm2 8.241 CV 1
ASSI { 766}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 36 and name HN ))
2.500 2.500 3.500 peak 766 spectrum 1 weight 0.10000E+01 volume 0.26122E-02 ppm1 1.643 ppm2 8.235 CV 1
ASSI { 768}
( segid " " and resid 35 and name HD2%)
(( segid " " and resid 36 and name HN ))
2.400 2.400 3.600 peak 768 spectrum 1 weight 0.10000E+01 volume 0.34084E-02 ppm1 0.982 ppm2 8.238 CV 1
OR { 768}
( segid " " and resid 35 and name HD1%)
(( segid " " and resid 36 and name HN ))
ASSI { 770}
(( segid " " and resid 35 and name HB3 ))
(( segid " " and resid 36 and name HN ))
2.400 0.700 0.700 peak 770 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 1.405 ppm2 8.242 CV 1
ASSI { 775}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 51 and name HN ))
2.600 0.800 0.800 peak 775 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 4.451 ppm2 9.466 CV 1
ASSI { 776}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name HN ))
2.500 0.800 0.800 peak 776 spectrum 1 weight 0.10000E+01 volume 0.22334E-02 ppm1 5.763 ppm2 8.422 CV 1
ASSI { 777}
(( segid " " and resid 49 and name HB3 ))
(( segid " " and resid 50 and name HN ))
2.300 2.300 3.700 peak 777 spectrum 1 weight 0.10000E+01 volume 0.39814E-02 ppm1 2.925 ppm2 8.422 CV 1
ASSI { 778}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 50 and name HN ))
2.300 0.700 0.700 peak 778 spectrum 1 weight 0.10000E+01 volume 0.38066E-02 ppm1 2.358 ppm2 8.426 CV 1
ASSI { 779}
(( segid " " and resid 104 and name HG3 ))
(( segid " " and resid 104 and name HE22))
2.300 2.300 3.700 peak 779 spectrum 1 weight 0.10000E+01 volume 0.39328E-02 ppm1 2.248 ppm2 6.572 CV 1
OR { 779}
(( segid " " and resid 104 and name HG2 ))
(( segid " " and resid 104 and name HE22))
ASSI { 780}
(( segid " " and resid 104 and name HG3 ))
(( segid " " and resid 104 and name HE21))
2.500 0.800 0.800 peak 780 spectrum 1 weight 0.10000E+01 volume 0.24471E-02 ppm1 2.250 ppm2 7.227 CV 1
OR { 780}
(( segid " " and resid 104 and name HG2 ))
(( segid " " and resid 104 and name HE21))
ASSI { 781}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HD21))
2.400 2.400 3.600 peak 781 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 3.222 ppm2 7.632 CV 1
ASSI { 782}
(( segid " " and resid 102 and name HB3 ))
(( segid " " and resid 102 and name HD21))
2.400 2.400 3.600 peak 782 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 2.815 ppm2 7.630 CV 1
ASSI { 783}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HD21))
2.500 2.500 3.500 peak 783 spectrum 1 weight 0.10000E+01 volume 0.26996E-02 ppm1 4.802 ppm2 7.630 CV 1
ASSI { 784}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HD22))
2.400 2.400 3.600 peak 784 spectrum 1 weight 0.10000E+01 volume 0.29715E-02 ppm1 3.238 ppm2 6.611 CV 1
ASSI { 785}
(( segid " " and resid 102 and name HB3 ))
(( segid " " and resid 102 and name HD22))
2.400 2.400 3.600 peak 785 spectrum 1 weight 0.10000E+01 volume 0.30200E-02 ppm1 2.838 ppm2 6.611 CV 1
ASSI { 787}
(( segid " " and resid 102 and name HD22))
(( segid " " and resid 102 and name HD21))
2.600 0.900 0.900 peak 787 spectrum 1 weight 0.10000E+01 volume 0.17965E-02 ppm1 6.604 ppm2 7.629 CV 1
ASSI { 788}
(( segid " " and resid 65 and name HA2 ))
(( segid " " and resid 66 and name HN ))
2.500 2.500 3.500 peak 788 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 3.178 ppm2 8.329 CV 1
ASSI { 789}
(( segid " " and resid 65 and name HA1 ))
(( segid " " and resid 66 and name HN ))
2.500 2.500 3.500 peak 789 spectrum 1 weight 0.10000E+01 volume 0.22237E-02 ppm1 3.454 ppm2 8.330 CV 1
ASSI { 790}
(( segid " " and resid 52 and name HA2 ))
(( segid " " and resid 52 and name HN ))
2.600 0.800 0.800 peak 790 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 3.424 ppm2 7.837 CV 1
ASSI { 792}
(( segid " " and resid 52 and name HA1 ))
(( segid " " and resid 52 and name HN ))
2.500 0.800 0.800 peak 792 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 4.054 ppm2 7.837 CV 1
ASSI { 793}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name HN ))
2.500 2.500 3.500 peak 793 spectrum 1 weight 0.10000E+01 volume 0.22626E-02 ppm1 3.888 ppm2 7.843 CV 1
ASSI { 796}
(( segid " " and resid 52 and name HA1 ))
(( segid " " and resid 53 and name HN ))
2.400 2.400 3.600 peak 796 spectrum 1 weight 0.10000E+01 volume 0.33016E-02 ppm1 4.054 ppm2 7.624 CV 1
ASSI { 797}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HN ))
2.400 0.700 0.700 peak 797 spectrum 1 weight 0.10000E+01 volume 0.35250E-02 ppm1 3.428 ppm2 8.241 CV 1
ASSI { 798}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 36 and name HN ))
2.500 2.500 3.500 peak 798 spectrum 1 weight 0.10000E+01 volume 0.24665E-02 ppm1 3.212 ppm2 8.241 CV 1
ASSI { 799}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 37 and name HN ))
2.400 0.700 0.700 peak 799 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 3.428 ppm2 8.031 CV 1
ASSI { 800}
(( segid " " and resid 37 and name HA2 ))
(( segid " " and resid 37 and name HN ))
2.500 0.800 0.800 peak 800 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 3.973 ppm2 8.031 CV 1
ASSI { 801}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 37 and name HN ))
2.400 2.400 3.600 peak 801 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 5.017 ppm2 8.030 CV 1
ASSI { 803}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HN ))
2.600 0.800 0.800 peak 803 spectrum 1 weight 0.10000E+01 volume 0.21169E-02 ppm1 1.982 ppm2 7.822 CV 1
ASSI { 804}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HN ))
2.500 0.800 0.800 peak 804 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 1.816 ppm2 7.822 CV 1
ASSI { 805}
(( segid " " and resid 62 and name HG2 ))
(( segid " " and resid 62 and name HN ))
2.400 2.400 3.600 peak 805 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 1.632 ppm2 7.827 CV 1
OR { 805}
(( segid " " and resid 62 and name HG3 ))
(( segid " " and resid 62 and name HN ))
ASSI { 806}
(( segid " " and resid 84 and name HB3 ))
( segid " " and resid 89 and name HE% )
2.400 2.400 3.600 peak 806 spectrum 1 weight 0.10000E+01 volume 0.31462E-02 ppm1 1.616 ppm2 7.237 CV 1
OR { 806}
(( segid " " and resid 57 and name HG2 ))
( segid " " and resid 89 and name HE% )
ASSI { 807}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 62 and name HE ))
2.300 2.300 3.700 peak 807 spectrum 1 weight 0.10000E+01 volume 0.36415E-02 ppm1 1.803 ppm2 7.238 CV 1
ASSI { 808}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HE ))
2.300 2.300 3.700 peak 808 spectrum 1 weight 0.10000E+01 volume 0.36318E-02 ppm1 1.960 ppm2 7.239 CV 1
ASSI { 809}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 63 and name HN ))
2.500 0.800 0.800 peak 809 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 1.972 ppm2 7.480 CV 1
ASSI { 812}
(( segid " " and resid 62 and name HD3 ))
(( segid " " and resid 62 and name HE ))
2.500 0.800 0.800 peak 812 spectrum 1 weight 0.10000E+01 volume 0.25830E-02 ppm1 3.193 ppm2 7.235 CV 1
OR { 812}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 62 and name HE ))
ASSI { 813}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 38 and name HN ))
2.500 0.800 0.800 peak 813 spectrum 1 weight 0.10000E+01 volume 0.27384E-02 ppm1 3.430 ppm2 8.865 CV 1
ASSI { 814}
(( segid " " and resid 37 and name HA2 ))
(( segid " " and resid 38 and name HN ))
2.400 2.400 3.600 peak 814 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 3.974 ppm2 8.865 CV 1
ASSI { 817}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 39 and name HN ))
2.500 0.800 0.800 peak 817 spectrum 1 weight 0.10000E+01 volume 0.24471E-02 ppm1 3.265 ppm2 8.782 CV 1
ASSI { 818}
(( segid " " and resid 38 and name HB3 ))
(( segid " " and resid 39 and name HN ))
2.500 0.800 0.800 peak 818 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 3.105 ppm2 8.781 CV 1
ASSI { 819}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HN ))
2.400 2.400 3.600 peak 819 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 2.070 ppm2 8.783 CV 1
ASSI { 820}
(( segid " " and resid 39 and name HB2 ))
(( segid " " and resid 39 and name HN ))
2.500 0.800 0.800 peak 820 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 1.827 ppm2 8.783 CV 1
OR { 820}
(( segid " " and resid 39 and name HG2 ))
(( segid " " and resid 39 and name HN ))
ASSI { 827}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 95 and name HN ))
2.500 0.800 0.800 peak 827 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 4.032 ppm2 8.736 CV 1
ASSI { 829}
(( segid " " and resid 99 and name HG2 ))
(( segid " " and resid 99 and name HE ))
2.500 0.800 0.800 peak 829 spectrum 1 weight 0.10000E+01 volume 0.26510E-02 ppm1 1.441 ppm2 7.368 CV 1
OR { 829}
(( segid " " and resid 99 and name HG3 ))
(( segid " " and resid 99 and name HE ))
ASSI { 830}
(( segid " " and resid 99 and name HB2 ))
(( segid " " and resid 99 and name HE ))
2.400 0.700 0.700 peak 830 spectrum 1 weight 0.10000E+01 volume 0.33987E-02 ppm1 1.827 ppm2 7.366 CV 1
OR { 830}
(( segid " " and resid 39 and name HG3 ))
(( segid " " and resid 39 and name HE ))
OR { 830}
(( segid " " and resid 39 and name HG2 ))
(( segid " " and resid 39 and name HE ))
ASSI { 831}
(( segid " " and resid 99 and name HG3 ))
(( segid " " and resid 99 and name HN ))
2.500 0.800 0.800 peak 831 spectrum 1 weight 0.10000E+01 volume 0.24471E-02 ppm1 1.440 ppm2 8.844 CV 1
ASSI { 832}
(( segid " " and resid 24 and name HG3 ))
(( segid " " and resid 25 and name HN ))
2.400 2.400 3.600 peak 832 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 2.153 ppm2 8.440 CV 1
ASSI { 833}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 24 and name HE21))
2.500 2.500 3.500 peak 833 spectrum 1 weight 0.10000E+01 volume 0.27869E-02 ppm1 2.292 ppm2 7.313 CV 1
ASSI { 834}
(( segid " " and resid 24 and name HG3 ))
(( segid " " and resid 24 and name HE21))
2.400 2.400 3.600 peak 834 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 2.153 ppm2 7.317 CV 1
ASSI { 835}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HE21))
2.400 2.400 3.600 peak 835 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 1.718 ppm2 7.313 CV 1
OR { 835}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HE21))
ASSI { 836}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 24 and name HE22))
2.400 2.400 3.600 peak 836 spectrum 1 weight 0.10000E+01 volume 0.32336E-02 ppm1 2.290 ppm2 6.956 CV 1
ASSI { 837}
(( segid " " and resid 24 and name HG3 ))
(( segid " " and resid 24 and name HE22))
2.300 2.300 3.700 peak 837 spectrum 1 weight 0.10000E+01 volume 0.45446E-02 ppm1 2.153 ppm2 6.963 CV 1
ASSI { 838}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 24 and name HE22))
2.300 2.300 3.700 peak 838 spectrum 1 weight 0.10000E+01 volume 0.37386E-02 ppm1 1.718 ppm2 6.958 CV 1
OR { 838}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 24 and name HE22))
ASSI { 841}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HN ))
2.500 2.500 3.500 peak 841 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 4.546 ppm2 8.779 CV 1
ASSI { 843}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HD21))
2.400 2.400 3.600 peak 843 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 2.663 ppm2 7.466 CV 1
ASSI { 844}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HE21))
2.400 2.400 3.600 peak 844 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 2.262 ppm2 7.458 CV 1
ASSI { 845}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 12 and name HD21))
2.400 2.400 3.600 peak 845 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 2.535 ppm2 7.464 CV 1
ASSI { 846}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HD22))
2.300 2.300 3.700 peak 846 spectrum 1 weight 0.10000E+01 volume 0.39814E-02 ppm1 2.653 ppm2 6.847 CV 1
ASSI { 847}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 12 and name HD22))
2.300 2.300 3.700 peak 847 spectrum 1 weight 0.10000E+01 volume 0.45834E-02 ppm1 2.512 ppm2 6.848 CV 1
ASSI { 849}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HN ))
2.500 0.800 0.800 peak 849 spectrum 1 weight 0.10000E+01 volume 0.26801E-02 ppm1 4.714 ppm2 8.289 CV 1
ASSI { 851}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HN ))
2.400 2.400 3.600 peak 851 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 2.514 ppm2 8.286 CV 1
ASSI { 852}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 11 and name HN ))
2.400 2.400 3.600 peak 852 spectrum 1 weight 0.10000E+01 volume 0.35832E-02 ppm1 2.440 ppm2 8.286 CV 1
ASSI { 853}
(( segid " " and resid 11 and name HG3 ))
(( segid " " and resid 11 and name HN ))
2.500 0.800 0.800 peak 853 spectrum 1 weight 0.10000E+01 volume 0.22917E-02 ppm1 2.305 ppm2 8.286 CV 1
ASSI { 854}
(( segid " " and resid 11 and name HG2 ))
(( segid " " and resid 12 and name HN ))
2.400 2.400 3.600 peak 854 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 2.305 ppm2 8.649 CV 1
ASSI { 855}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 12 and name HN ))
2.500 2.500 3.500 peak 855 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 2.440 ppm2 8.644 CV 1
ASSI { 856}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 12 and name HN ))
2.500 2.500 3.500 peak 856 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 2.514 ppm2 8.647 CV 1
ASSI { 862}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 6 and name HB3 ))
2.500 0.800 0.800 peak 862 spectrum 1 weight 0.10000E+01 volume 0.22917E-02 ppm1 3.416 ppm2 2.274 CV 1
ASSI { 863}
(( segid " " and resid 89 and name HB3 ))
(( segid " " and resid 90 and name HN ))
2.400 0.700 0.700 peak 863 spectrum 1 weight 0.10000E+01 volume 0.32336E-02 ppm1 3.046 ppm2 8.513 CV 1
ASSI { 864}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 90 and name HN ))
2.400 0.700 0.700 peak 864 spectrum 1 weight 0.10000E+01 volume 0.32142E-02 ppm1 3.243 ppm2 8.510 CV 1
ASSI { 865}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 90 and name HN ))
2.500 2.500 3.500 peak 865 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 4.701 ppm2 8.513 CV 1
ASSI { 866}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HG ))
2.400 0.700 0.700 peak 866 spectrum 1 weight 0.10000E+01 volume 0.31754E-02 ppm1 1.316 ppm2 0.880 CV 1
ASSI { 867}
(( segid " " and resid 19 and name HB3 ))
( segid " " and resid 19 and name HD2%)
2.400 0.700 0.700 peak 867 spectrum 1 weight 0.10000E+01 volume 0.30977E-02 ppm1 1.316 ppm2 0.999 CV 1
ASSI { 874}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 19 and name HG ))
2.400 0.700 0.700 peak 874 spectrum 1 weight 0.10000E+01 volume 0.30977E-02 ppm1 5.690 ppm2 0.880 CV 1
ASSI { 876}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 19 and name HA ))
2.200 0.600 0.600 peak 876 spectrum 1 weight 0.10000E+01 volume 0.52243E-02 ppm1 1.666 ppm2 5.665 CV 1
ASSI { 877}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HA ))
2.400 0.700 0.700 peak 877 spectrum 1 weight 0.10000E+01 volume 0.31462E-02 ppm1 1.297 ppm2 5.665 CV 1
ASSI { 880}
(( segid " " and resid 19 and name HG ))
(( segid " " and resid 19 and name HN ))
2.300 2.300 3.700 peak 880 spectrum 1 weight 0.10000E+01 volume 0.37871E-02 ppm1 0.878 ppm2 9.148 CV 1
ASSI { 881}
( segid " " and resid 19 and name HD2%)
(( segid " " and resid 19 and name HN ))
2.400 2.400 3.600 peak 881 spectrum 1 weight 0.10000E+01 volume 0.30491E-02 ppm1 1.002 ppm2 9.143 CV 1
OR { 881}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 19 and name HN ))
ASSI { 882}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 19 and name HN ))
2.300 2.300 3.700 peak 882 spectrum 1 weight 0.10000E+01 volume 0.40105E-02 ppm1 1.318 ppm2 9.143 CV 1
ASSI { 884}
(( segid " " and resid 19 and name HB2 ))
(( segid " " and resid 19 and name HN ))
2.400 2.400 3.600 peak 884 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 1.858 ppm2 9.137 CV 1
ASSI { 887}
( segid " " and resid 19 and name HD1%)
(( segid " " and resid 20 and name HN ))
2.300 0.700 0.700 peak 887 spectrum 1 weight 0.10000E+01 volume 0.40785E-02 ppm1 1.667 ppm2 9.311 CV 1
ASSI { 888}
(( segid " " and resid 19 and name HB3 ))
(( segid " " and resid 20 and name HN ))
2.400 2.400 3.600 peak 888 spectrum 1 weight 0.10000E+01 volume 0.31657E-02 ppm1 1.297 ppm2 9.306 CV 1
ASSI { 890}
(( segid " " and resid 19 and name HG ))
(( segid " " and resid 20 and name HN ))
2.400 2.400 3.600 peak 890 spectrum 1 weight 0.10000E+01 volume 0.28064E-02 ppm1 0.878 ppm2 9.311 CV 1
ASSI { 891}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HN ))
2.400 2.400 3.600 peak 891 spectrum 1 weight 0.10000E+01 volume 0.32531E-02 ppm1 1.859 ppm2 9.303 CV 1
ASSI { 892}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name HN ))
2.300 0.700 0.700 peak 892 spectrum 1 weight 0.10000E+01 volume 0.37386E-02 ppm1 1.670 ppm2 9.303 CV 1
ASSI { 893}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 20 and name HN ))
2.300 2.300 3.700 peak 893 spectrum 1 weight 0.10000E+01 volume 0.44183E-02 ppm1 1.242 ppm2 9.303 CV 1
ASSI { 896}
(( segid " " and resid 20 and name HD3 ))
(( segid " " and resid 20 and name HN ))
2.300 2.300 3.700 peak 896 spectrum 1 weight 0.10000E+01 volume 0.40688E-02 ppm1 0.898 ppm2 9.303 CV 1
ASSI { 897}
(( segid " " and resid 20 and name HD2 ))
(( segid " " and resid 21 and name HN ))
2.400 2.400 3.600 peak 897 spectrum 1 weight 0.10000E+01 volume 0.36026E-02 ppm1 1.149 ppm2 9.132 CV 1
ASSI { 898}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 21 and name HN ))
2.400 2.400 3.600 peak 898 spectrum 1 weight 0.10000E+01 volume 0.32336E-02 ppm1 1.242 ppm2 9.134 CV 1
ASSI { 899}
(( segid " " and resid 20 and name HG3 ))
(( segid " " and resid 21 and name HN ))
2.400 2.400 3.600 peak 899 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 1.013 ppm2 9.136 CV 1
ASSI { 900}
(( segid " " and resid 20 and name HD3 ))
(( segid " " and resid 21 and name HN ))
2.300 2.300 3.700 peak 900 spectrum 1 weight 0.10000E+01 volume 0.40785E-02 ppm1 0.898 ppm2 9.134 CV 1
ASSI { 906}
(( segid " " and resid 20 and name HG3 ))
(( segid " " and resid 20 and name HA ))
2.300 2.300 3.700 peak 906 spectrum 1 weight 0.10000E+01 volume 0.37483E-02 ppm1 1.013 ppm2 5.564 CV 1
ASSI { 907}
(( segid " " and resid 20 and name HD2 ))
(( segid " " and resid 20 and name HA ))
2.200 2.200 3.800 peak 907 spectrum 1 weight 0.10000E+01 volume 0.59623E-02 ppm1 1.149 ppm2 5.559 CV 1
ASSI { 908}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 20 and name HA ))
2.300 2.300 3.700 peak 908 spectrum 1 weight 0.10000E+01 volume 0.37871E-02 ppm1 1.242 ppm2 5.559 CV 1
ASSI { 909}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 20 and name HA ))
2.400 0.700 0.700 peak 909 spectrum 1 weight 0.10000E+01 volume 0.35444E-02 ppm1 1.670 ppm2 5.559 CV 1
ASSI { 911}
(( segid " " and resid 20 and name HB3 ))
(( segid " " and resid 26 and name HD1 ))
2.400 2.400 3.600 peak 911 spectrum 1 weight 0.10000E+01 volume 0.32531E-02 ppm1 1.672 ppm2 6.909 CV 1
ASSI { 912}
(( segid " " and resid 4 and name HB2 ))
( segid " " and resid 18 and name HD% )
2.300 2.300 3.700 peak 912 spectrum 1 weight 0.10000E+01 volume 0.43795E-02 ppm1 1.220 ppm2 6.917 CV 1
OR { 912}
( segid " " and resid 98 and name HG2%)
( segid " " and resid 20 and name HZ% )
OR { 912}
(( segid " " and resid 4 and name HB2 ))
( segid " " and resid 20 and name HZ% )
ASSI { 914}
( segid " " and resid 19 and name HD2%)
(( segid " " and resid 31 and name HN ))
2.400 2.400 3.600 peak 914 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 0.990 ppm2 6.913 CV 1
ASSI { 915}
( segid " " and resid 100 and name HD2%)
( segid " " and resid 20 and name HZ% )
2.400 0.700 0.700 peak 915 spectrum 1 weight 0.10000E+01 volume 0.32725E-02 ppm1 0.885 ppm2 6.931 CV 1
ASSI { 917}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HN ))
6.000 4.500 0.000 peak 917 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.889 ppm2 8.183 CV 1
ASSI { 918}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 13 and name HN ))
2.400 0.700 0.700 peak 918 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 1.156 ppm2 8.184 CV 1
ASSI { 919}
(( segid " " and resid 13 and name HG12))
(( segid " " and resid 13 and name HN ))
2.400 2.400 3.600 peak 919 spectrum 1 weight 0.10000E+01 volume 0.32919E-02 ppm1 1.104 ppm2 8.182 CV 1
ASSI { 920}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 13 and name HN ))
2.300 2.300 3.700 peak 920 spectrum 1 weight 0.10000E+01 volume 0.41756E-02 ppm1 0.484 ppm2 8.190 CV 1
ASSI { 921}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 13 and name HN ))
2.400 0.700 0.700 peak 921 spectrum 1 weight 0.10000E+01 volume 0.34278E-02 ppm1 0.180 ppm2 8.187 CV 1
ASSI { 922}
(( segid " " and resid 13 and name HG13))
(( segid " " and resid 13 and name HN ))
2.300 2.300 3.700 peak 922 spectrum 1 weight 0.10000E+01 volume 0.37483E-02 ppm1 -0.576 ppm2 8.179 CV 1
ASSI { 923}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 13 and name HG13))
2.500 0.800 0.800 peak 923 spectrum 1 weight 0.10000E+01 volume 0.26122E-02 ppm1 0.181 ppm2 -0.582 CV 1
ASSI { 924}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 13 and name HG13))
2.400 0.700 0.700 peak 924 spectrum 1 weight 0.10000E+01 volume 0.31268E-02 ppm1 0.490 ppm2 -0.582 CV 1
ASSI { 925}
(( segid " " and resid 13 and name HG12))
(( segid " " and resid 13 and name HG13))
2.500 0.800 0.800 peak 925 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 1.083 ppm2 -0.582 CV 1
ASSI { 926}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 13 and name HG13))
2.400 0.700 0.700 peak 926 spectrum 1 weight 0.10000E+01 volume 0.33307E-02 ppm1 1.162 ppm2 -0.582 CV 1
ASSI { 927}
(( segid " " and resid 13 and name HG12))
( segid " " and resid 13 and name HD1%)
2.500 0.800 0.800 peak 927 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 1.083 ppm2 0.178 CV 1
ASSI { 928}
(( segid " " and resid 13 and name HB ))
( segid " " and resid 13 and name HD1%)
2.500 0.800 0.800 peak 928 spectrum 1 weight 0.10000E+01 volume 0.23985E-02 ppm1 1.162 ppm2 0.183 CV 1
ASSI { 929}
( segid " " and resid 13 and name HG2%)
( segid " " and resid 13 and name HD1%)
2.600 0.800 0.800 peak 929 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 0.490 ppm2 0.180 CV 1
ASSI { 930}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HG13))
2.400 0.700 0.700 peak 930 spectrum 1 weight 0.10000E+01 volume 0.35444E-02 ppm1 3.872 ppm2 -0.582 CV 1
ASSI { 931}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 13 and name HD1%)
2.300 2.300 3.700 peak 931 spectrum 1 weight 0.10000E+01 volume 0.36318E-02 ppm1 3.862 ppm2 0.183 CV 1
ASSI { 932}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 13 and name HG2%)
2.500 0.800 0.800 peak 932 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 3.862 ppm2 0.482 CV 1
ASSI { 933}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HG12))
2.300 0.700 0.700 peak 933 spectrum 1 weight 0.10000E+01 volume 0.39134E-02 ppm1 3.879 ppm2 1.080 CV 1
ASSI { 934}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HB ))
2.200 2.200 3.800 peak 934 spectrum 1 weight 0.10000E+01 volume 0.48456E-02 ppm1 3.879 ppm2 1.158 CV 1
ASSI { 936}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 14 and name HN ))
2.400 0.700 0.700 peak 936 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 0.487 ppm2 9.302 CV 1
ASSI { 938}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 14 and name HN ))
2.500 0.800 0.800 peak 938 spectrum 1 weight 0.10000E+01 volume 0.23305E-02 ppm1 3.858 ppm2 9.301 CV 1
ASSI { 939}
(( segid " " and resid 69 and name HB3 ))
(( segid " " and resid 70 and name HN ))
2.300 0.700 0.700 peak 939 spectrum 1 weight 0.10000E+01 volume 0.37677E-02 ppm1 3.163 ppm2 8.541 CV 1
ASSI { 940}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 70 and name HN ))
2.400 0.700 0.700 peak 940 spectrum 1 weight 0.10000E+01 volume 0.34958E-02 ppm1 3.270 ppm2 8.541 CV 1
ASSI { 941}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 70 and name HN ))
2.500 2.500 3.500 peak 941 spectrum 1 weight 0.10000E+01 volume 0.22917E-02 ppm1 4.720 ppm2 8.543 CV 1
ASSI { 942}
(( segid " " and resid 8 and name HA2 ))
(( segid " " and resid 8 and name HN ))
2.500 0.800 0.800 peak 942 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 4.024 ppm2 9.455 CV 1
ASSI { 945}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 57 and name HN ))
2.500 0.800 0.800 peak 945 spectrum 1 weight 0.10000E+01 volume 0.25539E-02 ppm1 4.925 ppm2 8.965 CV 1
ASSI { 946}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 57 and name HN ))
2.400 2.400 3.600 peak 946 spectrum 1 weight 0.10000E+01 volume 0.28938E-02 ppm1 3.427 ppm2 8.963 CV 1
ASSI { 947}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 57 and name HN ))
2.400 2.400 3.600 peak 947 spectrum 1 weight 0.10000E+01 volume 0.33890E-02 ppm1 2.805 ppm2 8.964 CV 1
ASSI { 948}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HN ))
2.400 0.700 0.700 peak 948 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 1.943 ppm2 8.965 CV 1
ASSI { 949}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 57 and name HN ))
2.300 2.300 3.700 peak 949 spectrum 1 weight 0.10000E+01 volume 0.41756E-02 ppm1 1.623 ppm2 8.968 CV 1
ASSI { 950}
(( segid " " and resid 57 and name HG3 ))
(( segid " " and resid 57 and name HN ))
2.300 2.300 3.700 peak 950 spectrum 1 weight 0.10000E+01 volume 0.41950E-02 ppm1 1.410 ppm2 8.968 CV 1
ASSI { 951}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HN ))
2.400 2.400 3.600 peak 951 spectrum 1 weight 0.10000E+01 volume 0.36026E-02 ppm1 3.697 ppm2 7.822 CV 1
ASSI { 952}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HN ))
2.500 0.800 0.800 peak 952 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 3.697 ppm2 8.225 CV 1
ASSI { 953}
( segid " " and resid 61 and name HD2%)
(( segid " " and resid 62 and name HN ))
2.300 2.300 3.700 peak 953 spectrum 1 weight 0.10000E+01 volume 0.43892E-02 ppm1 0.827 ppm2 7.822 CV 1
OR { 953}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 62 and name HN ))
ASSI { 954}
(( segid " " and resid 61 and name HG ))
(( segid " " and resid 62 and name HN ))
2.300 2.300 3.700 peak 954 spectrum 1 weight 0.10000E+01 volume 0.41270E-02 ppm1 0.724 ppm2 7.822 CV 1
ASSI { 958}
(( segid " " and resid 95 and name HD3 ))
(( segid " " and resid 95 and name HE ))
2.500 0.800 0.800 peak 958 spectrum 1 weight 0.10000E+01 volume 0.25636E-02 ppm1 3.025 ppm2 7.430 CV 1
ASSI { 961}
(( segid " " and resid 95 and name HB2 ))
(( segid " " and resid 95 and name HE ))
2.400 2.400 3.600 peak 961 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 1.573 ppm2 7.430 CV 1
ASSI { 962}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HN ))
2.400 2.400 3.600 peak 962 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 3.366 ppm2 7.990 CV 1
ASSI { 963}
(( segid " " and resid 9 and name HB3 ))
(( segid " " and resid 9 and name HN ))
2.400 2.400 3.600 peak 963 spectrum 1 weight 0.10000E+01 volume 0.33016E-02 ppm1 3.109 ppm2 7.990 CV 1
ASSI { 966}
( segid " " and resid 63 and name HD1%)
(( segid " " and resid 63 and name HN ))
2.400 0.700 0.700 peak 966 spectrum 1 weight 0.10000E+01 volume 0.30200E-02 ppm1 0.787 ppm2 7.479 CV 1
ASSI { 967}
(( segid " " and resid 63 and name HG ))
(( segid " " and resid 63 and name HN ))
2.500 0.800 0.800 peak 967 spectrum 1 weight 0.10000E+01 volume 0.23305E-02 ppm1 1.762 ppm2 7.479 CV 1
ASSI { 968}
( segid " " and resid 63 and name HD2%)
(( segid " " and resid 64 and name HN ))
2.300 2.300 3.700 peak 968 spectrum 1 weight 0.10000E+01 volume 0.43892E-02 ppm1 0.787 ppm2 7.659 CV 1
OR { 968}
( segid " " and resid 63 and name HD1%)
(( segid " " and resid 64 and name HN ))
ASSI { 970}
(( segid " " and resid 63 and name HB3 ))
(( segid " " and resid 64 and name HN ))
2.400 2.400 3.600 peak 970 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 1.605 ppm2 7.655 CV 1
ASSI { 971}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 64 and name HN ))
2.300 2.300 3.700 peak 971 spectrum 1 weight 0.10000E+01 volume 0.38066E-02 ppm1 1.760 ppm2 7.657 CV 1
ASSI { 972}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 60 and name HN ))
2.600 0.800 0.800 peak 972 spectrum 1 weight 0.10000E+01 volume 0.21849E-02 ppm1 2.717 ppm2 8.825 CV 1
ASSI { 974}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 60 and name HD% )
2.500 0.800 0.800 peak 974 spectrum 1 weight 0.10000E+01 volume 0.22432E-02 ppm1 4.018 ppm2 6.424 CV 1
ASSI { 975}
(( segid " " and resid 60 and name HB3 ))
(( segid " " and resid 61 and name HN ))
2.400 0.700 0.700 peak 975 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 2.717 ppm2 8.228 CV 1
OR { 975}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 61 and name HN ))
ASSI { 976}
(( segid " " and resid 60 and name HB2 ))
( segid " " and resid 60 and name HE% )
2.500 2.500 3.500 peak 976 spectrum 1 weight 0.10000E+01 volume 0.25053E-02 ppm1 2.719 ppm2 6.573 CV 1
OR { 976}
(( segid " " and resid 60 and name HB3 ))
( segid " " and resid 60 and name HE% )
ASSI { 977}
(( segid " " and resid 60 and name HB2 ))
( segid " " and resid 60 and name HD% )
2.600 0.800 0.800 peak 977 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 2.705 ppm2 6.423 CV 1
OR { 977}
(( segid " " and resid 60 and name HB3 ))
( segid " " and resid 60 and name HD% )
ASSI { 978}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 98 and name HN ))
2.500 0.800 0.800 peak 978 spectrum 1 weight 0.10000E+01 volume 0.22626E-02 ppm1 4.525 ppm2 8.891 CV 1
ASSI { 979}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HN ))
2.400 0.700 0.700 peak 979 spectrum 1 weight 0.10000E+01 volume 0.33599E-02 ppm1 4.520 ppm2 8.253 CV 1
ASSI { 982}
( segid " " and resid 97 and name HD1%)
(( segid " " and resid 97 and name HN ))
2.300 2.300 3.700 peak 982 spectrum 1 weight 0.10000E+01 volume 0.36124E-02 ppm1 0.449 ppm2 8.261 CV 1
ASSI { 985}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 97 and name HN ))
2.400 2.400 3.600 peak 985 spectrum 1 weight 0.10000E+01 volume 0.29229E-02 ppm1 0.701 ppm2 8.262 CV 1
ASSI { 986}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 98 and name HN ))
2.300 2.300 3.700 peak 986 spectrum 1 weight 0.10000E+01 volume 0.38648E-02 ppm1 1.489 ppm2 8.894 CV 1
ASSI { 989}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 98 and name HN ))
2.500 0.800 0.800 peak 989 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 0.708 ppm2 8.894 CV 1
ASSI { 990}
( segid " " and resid 97 and name HD1%)
(( segid " " and resid 98 and name HN ))
2.400 2.400 3.600 peak 990 spectrum 1 weight 0.10000E+01 volume 0.29229E-02 ppm1 0.450 ppm2 8.894 CV 1
ASSI { 992}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HN ))
2.400 0.700 0.700 peak 992 spectrum 1 weight 0.10000E+01 volume 0.33987E-02 ppm1 1.608 ppm2 7.689 CV 1
OR { 992}
(( segid " " and resid 46 and name HB3 ))
(( segid " " and resid 46 and name HN ))
ASSI { 993}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 46 and name HN ))
2.500 0.800 0.800 peak 993 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 1.497 ppm2 7.689 CV 1
ASSI { 994}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HN ))
2.500 0.800 0.800 peak 994 spectrum 1 weight 0.10000E+01 volume 0.26219E-02 ppm1 4.477 ppm2 7.688 CV 1
ASSI { 996}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 96 and name HN ))
2.600 2.600 3.400 peak 996 spectrum 1 weight 0.10000E+01 volume 0.19421E-02 ppm1 1.576 ppm2 8.350 CV 1
ASSI { 997}
(( segid " " and resid 3 and name HB3 ))
(( segid " " and resid 4 and name HN ))
2.400 0.700 0.700 peak 997 spectrum 1 weight 0.10000E+01 volume 0.28938E-02 ppm1 1.449 ppm2 8.346 CV 1
ASSI { 998}
(( segid " " and resid 96 and name HG ))
(( segid " " and resid 96 and name HN ))
2.300 0.600 0.600 peak 998 spectrum 1 weight 0.10000E+01 volume 0.45252E-02 ppm1 1.319 ppm2 8.353 CV 1
ASSI { 1001}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 97 and name HN ))
2.400 2.400 3.600 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 1.584 ppm2 8.259 CV 1
ASSI { 1002}
(( segid " " and resid 96 and name HB3 ))
(( segid " " and resid 97 and name HN ))
2.400 2.400 3.600 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.35347E-02 ppm1 1.448 ppm2 8.259 CV 1
ASSI { 1003}
(( segid " " and resid 96 and name HG ))
(( segid " " and resid 97 and name HN ))
2.300 2.300 3.700 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.41561E-02 ppm1 1.331 ppm2 8.234 CV 1
ASSI { 1004}
(( segid " " and resid 95 and name HG2 ))
(( segid " " and resid 96 and name HN ))
2.300 2.300 3.700 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.36997E-02 ppm1 1.996 ppm2 8.344 CV 1
ASSI { 1005}
(( segid " " and resid 95 and name HB3 ))
(( segid " " and resid 95 and name HN ))
2.300 2.300 3.700 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.37192E-02 ppm1 1.323 ppm2 8.737 CV 1
ASSI { 1012}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HN ))
2.500 2.500 3.500 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.23985E-02 ppm1 1.961 ppm2 8.179 CV 1
ASSI { 1013}
(( segid " " and resid 58 and name HB3 ))
(( segid " " and resid 58 and name HN ))
2.300 2.300 3.700 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.40396E-02 ppm1 1.723 ppm2 8.177 CV 1
ASSI { 1014}
(( segid " " and resid 58 and name HG3 ))
(( segid " " and resid 58 and name HN ))
2.400 0.700 0.700 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.35735E-02 ppm1 1.433 ppm2 8.179 CV 1
ASSI { 1015}
(( segid " " and resid 58 and name HD3 ))
(( segid " " and resid 58 and name HN ))
2.400 2.400 3.600 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.36026E-02 ppm1 3.198 ppm2 8.177 CV 1
ASSI { 1016}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HN ))
6.000 4.500 0.000 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.917 ppm2 8.177 CV 1
ASSI { 1017}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HN ))
2.600 0.800 0.800 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.22043E-02 ppm1 4.113 ppm2 7.853 CV 1
ASSI { 1018}
(( segid " " and resid 10 and name HB3 ))
(( segid " " and resid 10 and name HN ))
2.400 0.700 0.700 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 2.380 ppm2 7.853 CV 1
ASSI { 1019}
(( segid " " and resid 10 and name HG2 ))
(( segid " " and resid 10 and name HN ))
2.400 2.400 3.600 peak 1019 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 2.294 ppm2 7.853 CV 1
ASSI { 1026}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HB% )
2.600 0.800 0.800 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 4.676 ppm2 1.143 CV 1
ASSI { 1027}
(( segid " " and resid 111 and name HG12))
(( segid " " and resid 111 and name HN ))
2.400 2.400 3.600 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.31948E-02 ppm1 1.427 ppm2 7.997 CV 1
ASSI { 1028}
(( segid " " and resid 111 and name HB ))
(( segid " " and resid 111 and name HG12))
2.600 0.900 0.900 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.17770E-02 ppm1 1.825 ppm2 1.433 CV 1
ASSI { 1029}
(( segid " " and resid 111 and name HG12))
(( segid " " and resid 111 and name HG13))
2.600 0.800 0.800 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.19421E-02 ppm1 1.424 ppm2 1.145 CV 1
ASSI { 1031}
(( segid " " and resid 111 and name HG12))
( segid " " and resid 111 and name HD1%)
6.000 4.500 0.000 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.424 ppm2 0.862 CV 1
ASSI { 1032}
(( segid " " and resid 63 and name HG ))
( segid " " and resid 63 and name HD2%)
2.600 0.800 0.800 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.20975E-02 ppm1 1.759 ppm2 0.786 CV 1
OR { 1032}
(( segid " " and resid 63 and name HG ))
( segid " " and resid 63 and name HD1%)
ASSI { 1035}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HD1%)
2.500 0.800 0.800 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 4.198 ppm2 0.813 CV 1
OR { 1035}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HD2%)
ASSI { 1036}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HB3 ))
2.600 0.800 0.800 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.21946E-02 ppm1 4.198 ppm2 1.621 CV 1
ASSI { 1037}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HB2 ))
2.500 0.800 0.800 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 4.198 ppm2 1.755 CV 1
ASSI { 1038}
(( segid " " and resid 42 and name HG3 ))
(( segid " " and resid 42 and name HN ))
2.400 0.700 0.700 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.32336E-02 ppm1 2.272 ppm2 7.294 CV 1
OR { 1038}
(( segid " " and resid 42 and name HG2 ))
(( segid " " and resid 42 and name HN ))
ASSI { 1039}
(( segid " " and resid 42 and name HB2 ))
(( segid " " and resid 42 and name HN ))
2.300 2.300 3.700 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.37192E-02 ppm1 1.005 ppm2 7.286 CV 1
OR { 1039}
(( segid " " and resid 42 and name HB3 ))
(( segid " " and resid 42 and name HN ))
ASSI { 1040}
(( segid " " and resid 42 and name HG3 ))
(( segid " " and resid 42 and name HB2 ))
2.700 0.900 0.900 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.17188E-02 ppm1 2.260 ppm2 0.993 CV 1
OR { 1040}
(( segid " " and resid 42 and name HG2 ))
(( segid " " and resid 42 and name HB3 ))
OR { 1040}
(( segid " " and resid 42 and name HG3 ))
(( segid " " and resid 42 and name HB3 ))
ASSI { 1041}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB3 ))
2.400 0.700 0.700 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 4.320 ppm2 1.009 CV 1
OR { 1041}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HB2 ))
ASSI { 1042}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HG2 ))
2.500 0.800 0.800 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 4.326 ppm2 2.279 CV 1
OR { 1042}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HG3 ))
ASSI { 1044}
(( segid " " and resid 51 and name HG ))
(( segid " " and resid 51 and name HN ))
2.500 2.500 3.500 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.25830E-02 ppm1 1.517 ppm2 9.465 CV 1
ASSI { 1045}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 51 and name HN ))
2.400 0.700 0.700 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 0.900 ppm2 9.461 CV 1
ASSI { 1049}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 50 and name HN ))
2.400 2.400 3.600 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 1.880 ppm2 8.422 CV 1
ASSI { 1053}
(( segid " " and resid 50 and name HE3 ))
(( segid " " and resid 50 and name HB2 ))
2.500 2.500 3.500 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 2.933 ppm2 1.862 CV 1
OR { 1053}
(( segid " " and resid 50 and name HE2 ))
(( segid " " and resid 50 and name HB2 ))
OR { 1053}
(( segid " " and resid 99 and name HD2 ))
(( segid " " and resid 19 and name HB3 ))
ASSI { 1054}
(( segid " " and resid 50 and name HE2 ))
(( segid " " and resid 50 and name HB3 ))
2.500 2.500 3.500 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 2.925 ppm2 1.679 CV 1
OR { 1054}
(( segid " " and resid 50 and name HE3 ))
(( segid " " and resid 50 and name HB3 ))
OR { 1054}
(( segid " " and resid 50 and name HE3 ))
(( segid " " and resid 53 and name HG3 ))
OR { 1054}
(( segid " " and resid 50 and name HE2 ))
(( segid " " and resid 53 and name HG3 ))
ASSI { 1055}
(( segid " " and resid 50 and name HE3 ))
(( segid " " and resid 50 and name HG2 ))
2.400 0.700 0.700 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.28841E-02 ppm1 2.925 ppm2 1.639 CV 1
OR { 1055}
(( segid " " and resid 50 and name HE2 ))
(( segid " " and resid 50 and name HG2 ))
ASSI { 1056}
(( segid " " and resid 50 and name HE3 ))
(( segid " " and resid 50 and name HD2 ))
2.500 0.800 0.800 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.24277E-02 ppm1 2.925 ppm2 1.464 CV 1
OR { 1056}
(( segid " " and resid 50 and name HE2 ))
(( segid " " and resid 50 and name HD2 ))
ASSI { 1057}
(( segid " " and resid 50 and name HE2 ))
(( segid " " and resid 50 and name HD3 ))
2.600 0.800 0.800 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.20198E-02 ppm1 2.925 ppm2 1.425 CV 1
OR { 1057}
(( segid " " and resid 50 and name HE3 ))
(( segid " " and resid 50 and name HD3 ))
ASSI { 1058}
(( segid " " and resid 50 and name HE2 ))
(( segid " " and resid 50 and name HG3 ))
2.500 0.800 0.800 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.27384E-02 ppm1 2.925 ppm2 1.338 CV 1
OR { 1058}
(( segid " " and resid 50 and name HE3 ))
(( segid " " and resid 50 and name HG3 ))
ASSI { 1059}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HN ))
2.500 2.500 3.500 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.25248E-02 ppm1 1.635 ppm2 8.432 CV 1
ASSI { 1060}
(( segid " " and resid 50 and name HG3 ))
(( segid " " and resid 50 and name HN ))
2.200 2.200 3.800 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.48262E-02 ppm1 1.331 ppm2 8.422 CV 1
ASSI { 1061}
(( segid " " and resid 50 and name HG3 ))
(( segid " " and resid 51 and name HN ))
2.400 2.400 3.600 peak 1061 spectrum 1 weight 0.10000E+01 volume 0.34861E-02 ppm1 1.331 ppm2 9.457 CV 1
ASSI { 1062}
(( segid " " and resid 50 and name HD3 ))
(( segid " " and resid 51 and name HN ))
2.300 2.300 3.700 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.42144E-02 ppm1 1.420 ppm2 9.462 CV 1
ASSI { 1063}
(( segid " " and resid 50 and name HD2 ))
(( segid " " and resid 51 and name HN ))
2.300 2.300 3.700 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.37580E-02 ppm1 1.459 ppm2 9.461 CV 1
ASSI { 1064}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 51 and name HN ))
2.300 2.300 3.700 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.42824E-02 ppm1 1.644 ppm2 9.462 CV 1
ASSI { 1065}
(( segid " " and resid 50 and name HB3 ))
(( segid " " and resid 51 and name HN ))
2.400 2.400 3.600 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.32919E-02 ppm1 1.683 ppm2 9.466 CV 1
ASSI { 1066}
(( segid " " and resid 50 and name HB2 ))
(( segid " " and resid 51 and name HN ))
2.300 2.300 3.700 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.40979E-02 ppm1 1.880 ppm2 9.462 CV 1
ASSI { 1068}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HN ))
2.500 0.800 0.800 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.26996E-02 ppm1 3.682 ppm2 8.537 CV 1
ASSI { 1069}
(( segid " " and resid 102 and name HB3 ))
(( segid " " and resid 16 and name HN ))
2.400 2.400 3.600 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.34667E-02 ppm1 2.817 ppm2 8.532 CV 1
ASSI { 1070}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HN ))
2.500 2.500 3.500 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.25636E-02 ppm1 1.388 ppm2 8.533 CV 1
ASSI { 1071}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HN ))
2.500 2.500 3.500 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.24277E-02 ppm1 1.165 ppm2 8.530 CV 1
ASSI { 1073}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HE ))
2.300 2.300 3.700 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.44572E-02 ppm1 3.675 ppm2 7.113 CV 1
ASSI { 1074}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HE ))
2.300 2.300 3.700 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.36803E-02 ppm1 1.387 ppm2 7.117 CV 1
ASSI { 1075}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HE ))
2.400 2.400 3.600 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 1.147 ppm2 7.114 CV 1
ASSI { 1076}
(( segid " " and resid 16 and name HG2 ))
(( segid " " and resid 16 and name HE ))
2.400 0.700 0.700 peak 1076 spectrum 1 weight 0.10000E+01 volume 0.29035E-02 ppm1 0.661 ppm2 7.114 CV 1
OR { 1076}
(( segid " " and resid 16 and name HG3 ))
(( segid " " and resid 16 and name HE ))
ASSI { 1077}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB3 ))
6.000 4.500 0.000 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.698 ppm2 1.150 CV 1
ASSI { 1078}
(( segid " " and resid 16 and name HD2 ))
(( segid " " and resid 16 and name HB3 ))
2.500 0.800 0.800 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.26510E-02 ppm1 2.844 ppm2 1.385 CV 1
OR { 1078}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HB3 ))
ASSI { 1079}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HG2 ))
2.500 0.800 0.800 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.23985E-02 ppm1 2.840 ppm2 0.651 CV 1
OR { 1079}
(( segid " " and resid 16 and name HD3 ))
(( segid " " and resid 16 and name HG3 ))
ASSI { 1080}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HB2 ))
2.400 0.700 0.700 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 3.698 ppm2 1.385 CV 1
ASSI { 1081}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HG2 ))
2.400 2.400 3.600 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 3.686 ppm2 0.651 CV 1
OR { 1081}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HG3 ))
ASSI { 1082}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HG3 ))
2.400 0.700 0.700 peak 1082 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 1.116 ppm2 0.671 CV 1
OR { 1082}
(( segid " " and resid 16 and name HB3 ))
(( segid " " and resid 16 and name HG2 ))
ASSI { 1083}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HG3 ))
2.500 0.800 0.800 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 1.389 ppm2 0.671 CV 1
OR { 1083}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HG2 ))
ASSI { 1084}
(( segid " " and resid 16 and name HB2 ))
(( segid " " and resid 16 and name HB3 ))
6.000 4.500 0.000 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.389 ppm2 1.124 CV 1
ASSI { 1085}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HN ))
2.500 0.800 0.800 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.26801E-02 ppm1 4.201 ppm2 8.599 CV 1
ASSI { 1088}
(( segid " " and resid 2 and name HB2 ))
(( segid " " and resid 3 and name HN ))
2.500 0.800 0.800 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.26607E-02 ppm1 3.764 ppm2 8.303 CV 1
OR { 1088}
(( segid " " and resid 2 and name HB3 ))
(( segid " " and resid 3 and name HN ))
ASSI { 1089}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 3 and name HN ))
2.600 0.800 0.800 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.21460E-02 ppm1 4.468 ppm2 8.306 CV 1
ASSI { 1091}
(( segid " " and resid 57 and name HG2 ))
(( segid " " and resid 57 and name HE ))
2.400 2.400 3.600 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.31754E-02 ppm1 1.633 ppm2 7.440 CV 1
ASSI { 1093}
(( segid " " and resid 57 and name HD2 ))
(( segid " " and resid 57 and name HE ))
2.500 0.800 0.800 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 3.165 ppm2 7.440 CV 1
OR { 1093}
(( segid " " and resid 57 and name HD3 ))
(( segid " " and resid 57 and name HE ))
ASSI { 1094}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 12 and name HN ))
2.400 2.400 3.600 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 2.538 ppm2 8.644 CV 1
ASSI { 1095}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 12 and name HN ))
2.500 2.500 3.500 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.25151E-02 ppm1 2.680 ppm2 8.644 CV 1
ASSI { 1096}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HD21))
2.300 2.300 3.700 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.42047E-02 ppm1 4.728 ppm2 7.461 CV 1
ASSI { 1097}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HD22))
2.300 2.300 3.700 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.42921E-02 ppm1 4.733 ppm2 6.847 CV 1
ASSI { 1098}
(( segid " " and resid 53 and name HD3 ))
(( segid " " and resid 53 and name HE ))
2.400 0.700 0.700 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.35541E-02 ppm1 3.081 ppm2 7.430 CV 1
OR { 1098}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 53 and name HE ))
ASSI { 1099}
(( segid " " and resid 53 and name HG3 ))
(( segid " " and resid 53 and name HE ))
2.400 0.700 0.700 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.35055E-02 ppm1 1.666 ppm2 7.435 CV 1
ASSI { 1101}
(( segid " " and resid 8 and name HA2 ))
(( segid " " and resid 9 and name HN ))
2.400 2.400 3.600 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.31754E-02 ppm1 4.025 ppm2 7.992 CV 1
ASSI { 1104}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HN ))
2.400 2.400 3.600 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 2.879 ppm2 7.878 CV 1
ASSI { 1105}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 18 and name HN ))
2.400 2.400 3.600 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 2.770 ppm2 8.698 CV 1
ASSI { 1106}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 18 and name HN ))
2.400 2.400 3.600 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 2.879 ppm2 8.698 CV 1
ASSI { 1107}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
2.500 0.800 0.800 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.27287E-02 ppm1 3.989 ppm2 7.959 CV 1
ASSI { 1109}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 27 and name HN ))
2.400 0.700 0.700 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 3.503 ppm2 9.167 CV 1
ASSI { 1113}
(( segid " " and resid 89 and name HB2 ))
( segid " " and resid 89 and name HD% )
2.400 0.800 0.800 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.28064E-02 ppm1 3.239 ppm2 7.294 CV 1
ASSI { 1115}
(( segid " " and resid 89 and name HB3 ))
( segid " " and resid 89 and name HD% )
2.400 0.700 0.700 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.30977E-02 ppm1 3.048 ppm2 7.294 CV 1
ASSI { 1116}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HN ))
2.400 2.400 3.600 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.34570E-02 ppm1 3.694 ppm2 7.873 CV 1
ASSI { 1118}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HN ))
2.300 2.300 3.700 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.37192E-02 ppm1 3.514 ppm2 7.621 CV 1
ASSI { 1119}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 32 and name HN ))
2.400 2.400 3.600 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 3.414 ppm2 7.622 CV 1
ASSI { 1120}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 33 and name HN ))
2.500 0.800 0.800 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.24277E-02 ppm1 3.426 ppm2 8.599 CV 1
ASSI { 1121}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 33 and name HN ))
2.400 0.700 0.700 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 3.501 ppm2 8.599 CV 1
ASSI { 1122}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 33 and name HN ))
2.500 0.800 0.800 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.27772E-02 ppm1 3.002 ppm2 8.600 CV 1
ASSI { 1123}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 34 and name HN ))
2.600 0.800 0.800 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.21460E-02 ppm1 4.202 ppm2 9.666 CV 1
ASSI { 1124}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 34 and name HN ))
2.400 2.400 3.600 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.30783E-02 ppm1 2.998 ppm2 9.671 CV 1
ASSI { 1125}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 33 and name HN ))
2.400 0.700 0.700 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 1.567 ppm2 8.599 CV 1
ASSI { 1126}
(( segid " " and resid 33 and name HB3 ))
(( segid " " and resid 34 and name HN ))
2.300 2.300 3.700 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.39716E-02 ppm1 1.567 ppm2 9.664 CV 1
ASSI { 1128}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HA ))
2.400 0.700 0.700 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.34084E-02 ppm1 3.514 ppm2 5.344 CV 1
ASSI { 1129}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 32 and name HA ))
2.400 0.700 0.700 peak 1129 spectrum 1 weight 0.10000E+01 volume 0.35638E-02 ppm1 3.411 ppm2 5.344 CV 1
ASSI { 1132}
(( segid " " and resid 18 and name HB2 ))
(( segid " " and resid 19 and name HN ))
2.400 0.800 0.800 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.28064E-02 ppm1 3.440 ppm2 9.142 CV 1
ASSI { 1133}
(( segid " " and resid 18 and name HB3 ))
(( segid " " and resid 19 and name HN ))
2.400 2.400 3.600 peak 1133 spectrum 1 weight 0.10000E+01 volume 0.29423E-02 ppm1 3.092 ppm2 9.135 CV 1
ASSI { 1134}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB2 ))
2.500 0.800 0.800 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.23985E-02 ppm1 4.666 ppm2 1.634 CV 1
ASSI { 1135}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB3 ))
2.500 0.800 0.800 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 4.664 ppm2 1.399 CV 1
ASSI { 1136}
(( segid " " and resid 35 and name HG ))
(( segid " " and resid 35 and name HN ))
2.400 2.400 3.600 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.29423E-02 ppm1 1.590 ppm2 9.066 CV 1
ASSI { 1137}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 41 and name HN ))
2.400 0.700 0.700 peak 1137 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 3.639 ppm2 9.167 CV 1
ASSI { 1138}
(( segid " " and resid 41 and name HA1 ))
(( segid " " and resid 41 and name HN ))
2.400 0.700 0.700 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 4.058 ppm2 9.164 CV 1
ASSI { 1139}
(( segid " " and resid 41 and name HA1 ))
(( segid " " and resid 41 and name HA2 ))
2.600 0.800 0.800 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.21558E-02 ppm1 4.078 ppm2 3.637 CV 1
ASSI { 1140}
(( segid " " and resid 41 and name HA1 ))
(( segid " " and resid 42 and name HN ))
2.200 2.200 3.800 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.56225E-02 ppm1 4.080 ppm2 7.294 CV 1
ASSI { 1145}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HN ))
2.200 2.200 3.800 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.53311E-02 ppm1 4.324 ppm2 7.989 CV 1
ASSI { 1146}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 43 and name HN ))
2.400 2.400 3.600 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.31365E-02 ppm1 2.272 ppm2 7.990 CV 1
ASSI { 1154}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 36 and name HN ))
2.300 2.300 3.700 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.39911E-02 ppm1 1.768 ppm2 8.239 CV 1
OR { 1154}
(( segid " " and resid 63 and name HG ))
(( segid " " and resid 61 and name HN ))
OR { 1154}
(( segid " " and resid 55 and name HB3 ))
(( segid " " and resid 36 and name HN ))
OR { 1154}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 61 and name HN ))
ASSI { 1155}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 45 and name HN ))
2.400 2.400 3.600 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 1.906 ppm2 8.236 CV 1
ASSI { 1156}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HN ))
2.500 2.500 3.500 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.27093E-02 ppm1 2.062 ppm2 8.239 CV 1
ASSI { 1159}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 45 and name HE ))
2.400 0.700 0.700 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 3.017 ppm2 7.286 CV 1
OR { 1159}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 45 and name HE ))
ASSI { 1160}
(( segid " " and resid 45 and name HB2 ))
(( segid " " and resid 45 and name HE ))
2.400 0.700 0.700 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 2.061 ppm2 7.286 CV 1
ASSI { 1161}
(( segid " " and resid 45 and name HB3 ))
(( segid " " and resid 45 and name HE ))
2.400 0.700 0.700 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.33599E-02 ppm1 1.913 ppm2 7.286 CV 1
ASSI { 1163}
(( segid " " and resid 97 and name HB ))
(( segid " " and resid 97 and name HN ))
2.300 2.300 3.700 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.36706E-02 ppm1 1.485 ppm2 8.259 CV 1
ASSI { 1164}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HB ))
2.400 0.700 0.700 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.30977E-02 ppm1 4.523 ppm2 1.482 CV 1
ASSI { 1165}
(( segid " " and resid 97 and name HA ))
( segid " " and resid 97 and name HG2%)
2.500 0.800 0.800 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.23111E-02 ppm1 4.517 ppm2 0.699 CV 1
ASSI { 1166}
(( segid " " and resid 97 and name HB ))
( segid " " and resid 97 and name HG2%)
2.600 0.800 0.800 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.21460E-02 ppm1 1.470 ppm2 0.701 CV 1
ASSI { 1167}
(( segid " " and resid 97 and name HB ))
( segid " " and resid 97 and name HD1%)
2.600 0.900 0.900 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.18547E-02 ppm1 1.472 ppm2 0.457 CV 1
ASSI { 1169}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 94 and name HN ))
2.400 2.400 3.600 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.32142E-02 ppm1 4.976 ppm2 7.573 CV 1
ASSI { 1171}
(( segid " " and resid 93 and name HB3 ))
(( segid " " and resid 94 and name HN ))
2.300 2.300 3.700 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.41659E-02 ppm1 2.732 ppm2 7.573 CV 1
ASSI { 1173}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 89 and name HN ))
2.400 0.700 0.700 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.34861E-02 ppm1 7.279 ppm2 8.395 CV 1
ASSI { 1178}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 47 and name HD1%)
2.600 0.800 0.800 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.19615E-02 ppm1 1.332 ppm2 0.624 CV 1
OR { 1178}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 47 and name HD2%)
ASSI { 1181}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB3 ))
2.400 0.700 0.700 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.34764E-02 ppm1 4.649 ppm2 1.328 CV 1
OR { 1181}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HB2 ))
ASSI { 1183}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 40 and name HD1%)
2.600 0.800 0.800 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.21849E-02 ppm1 1.562 ppm2 0.395 CV 1
OR { 1183}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 40 and name HD2%)
ASSI { 1185}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 40 and name HD2%)
2.500 0.800 0.800 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.23305E-02 ppm1 1.132 ppm2 0.395 CV 1
ASSI { 1194}
(( segid " " and resid 51 and name HG ))
( segid " " and resid 51 and name HD2%)
2.600 0.800 0.800 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.21946E-02 ppm1 1.516 ppm2 0.931 CV 1
OR { 1194}
(( segid " " and resid 51 and name HG ))
( segid " " and resid 51 and name HD1%)
ASSI { 1196}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HG ))
2.500 0.800 0.800 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.23500E-02 ppm1 1.802 ppm2 1.508 CV 1
ASSI { 1197}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HG ))
2.500 2.500 3.500 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 3.887 ppm2 1.508 CV 1
ASSI { 1198}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HD1%)
2.500 0.800 0.800 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 3.887 ppm2 0.927 CV 1
OR { 1198}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HD2%)
ASSI { 1200}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 51 and name HN ))
2.500 0.800 0.800 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 0.931 ppm2 9.461 CV 1
ASSI { 1201}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB3 ))
2.500 0.800 0.800 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.24277E-02 ppm1 3.887 ppm2 1.686 CV 1
ASSI { 1203}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 61 and name HG ))
2.600 0.900 0.900 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.19130E-02 ppm1 1.815 ppm2 0.718 CV 1
ASSI { 1204}
(( segid " " and resid 61 and name HB3 ))
( segid " " and resid 61 and name HD1%)
2.600 0.800 0.800 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.21169E-02 ppm1 1.815 ppm2 0.829 CV 1
OR { 1204}
(( segid " " and resid 61 and name HB3 ))
( segid " " and resid 61 and name HD2%)
ASSI { 1206}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 61 and name HG ))
2.500 0.800 0.800 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.22140E-02 ppm1 1.347 ppm2 0.718 CV 1
ASSI { 1211}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 62 and name HN ))
2.400 2.400 3.600 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.33696E-02 ppm1 1.347 ppm2 7.826 CV 1
ASSI { 1212}
(( segid " " and resid 61 and name HB2 ))
(( segid " " and resid 61 and name HN ))
2.400 0.700 0.700 peak 1212 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 1.358 ppm2 8.233 CV 1
ASSI { 1213}
(( segid " " and resid 5 and name HB ))
( segid " " and resid 5 and name HG2%)
2.600 0.800 0.800 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.21072E-02 ppm1 3.644 ppm2 0.882 CV 1
ASSI { 1214}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 5 and name HG2%)
2.500 0.800 0.800 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.25927E-02 ppm1 4.231 ppm2 0.882 CV 1
ASSI { 1215}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB2 ))
2.400 0.700 0.700 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.32919E-02 ppm1 4.205 ppm2 2.994 CV 1
ASSI { 1216}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HG ))
2.500 0.800 0.800 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.27190E-02 ppm1 4.599 ppm2 1.312 CV 1
ASSI { 1218}
(( segid " " and resid 100 and name HA ))
( segid " " and resid 100 and name HD1%)
2.600 0.800 0.800 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 4.591 ppm2 0.872 CV 1
ASSI { 1219}
(( segid " " and resid 100 and name HG ))
( segid " " and resid 100 and name HD1%)
2.500 0.800 0.800 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.26704E-02 ppm1 1.323 ppm2 0.867 CV 1
OR { 1219}
(( segid " " and resid 100 and name HG ))
( segid " " and resid 100 and name HD2%)
ASSI { 1223}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 100 and name HB3 ))
2.500 0.800 0.800 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.22334E-02 ppm1 0.990 ppm2 0.327 CV 1
ASSI { 1225}
(( segid " " and resid 100 and name HG ))
(( segid " " and resid 100 and name HB2 ))
2.400 0.700 0.700 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 1.323 ppm2 0.995 CV 1
ASSI { 1227}
( segid " " and resid 100 and name HD1%)
(( segid " " and resid 100 and name HN ))
2.600 2.600 3.400 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.21946E-02 ppm1 0.866 ppm2 8.841 CV 1
OR { 1227}
( segid " " and resid 100 and name HD2%)
(( segid " " and resid 100 and name HN ))
ASSI { 1228}
(( segid " " and resid 100 and name HG ))
(( segid " " and resid 100 and name HN ))
2.500 2.500 3.500 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 1.326 ppm2 8.840 CV 1
ASSI { 1229}
(( segid " " and resid 52 and name HA1 ))
(( segid " " and resid 52 and name HA2 ))
2.600 0.900 0.900 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.18936E-02 ppm1 4.088 ppm2 3.426 CV 1
ASSI { 1230}
(( segid " " and resid 8 and name HA1 ))
(( segid " " and resid 8 and name HA2 ))
2.500 0.800 0.800 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.25539E-02 ppm1 4.552 ppm2 4.021 CV 1
ASSI { 1231}
(( segid " " and resid 7 and name HA1 ))
(( segid " " and resid 7 and name HA2 ))
2.600 0.900 0.900 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.19130E-02 ppm1 3.661 ppm2 2.348 CV 1
ASSI { 1232}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HN ))
2.400 2.400 3.600 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.34667E-02 ppm1 2.914 ppm2 8.676 CV 1
ASSI { 1233}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB2 ))
2.500 0.800 0.800 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.24471E-02 ppm1 3.984 ppm2 2.897 CV 1
ASSI { 1234}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HN ))
2.500 0.800 0.800 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.22626E-02 ppm1 5.120 ppm2 9.960 CV 1
ASSI { 1236}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HG2 ))
2.400 0.700 0.700 peak 1236 spectrum 1 weight 0.10000E+01 volume 0.36026E-02 ppm1 3.984 ppm2 2.561 CV 1
OR { 1236}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HG3 ))
ASSI { 1237}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB2 ))
2.400 0.700 0.700 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.35250E-02 ppm1 3.983 ppm2 2.206 CV 1
ASSI { 1238}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 28 and name HB3 ))
2.500 0.800 0.800 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 3.985 ppm2 2.134 CV 1
ASSI { 1239}
(( segid " " and resid 53 and name HD3 ))
(( segid " " and resid 53 and name HG3 ))
2.500 0.800 0.800 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.23111E-02 ppm1 3.094 ppm2 1.667 CV 1
OR { 1239}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 53 and name HG3 ))
ASSI { 1240}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 53 and name HG2 ))
2.400 0.700 0.700 peak 1240 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 3.094 ppm2 1.714 CV 1
OR { 1240}
(( segid " " and resid 53 and name HD3 ))
(( segid " " and resid 53 and name HG2 ))
ASSI { 1241}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HG2 ))
2.400 2.400 3.600 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.31851E-02 ppm1 4.782 ppm2 1.714 CV 1
ASSI { 1243}
(( segid " " and resid 53 and name HD2 ))
(( segid " " and resid 53 and name HB3 ))
2.400 0.700 0.700 peak 1243 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 3.094 ppm2 1.966 CV 1
OR { 1243}
(( segid " " and resid 53 and name HD3 ))
(( segid " " and resid 53 and name HB3 ))
OR { 1243}
(( segid " " and resid 53 and name HD3 ))
(( segid " " and resid 53 and name HB2 ))
ASSI { 1244}
(( segid " " and resid 53 and name HG2 ))
(( segid " " and resid 53 and name HE ))
2.300 0.700 0.700 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.38260E-02 ppm1 1.716 ppm2 7.435 CV 1
ASSI { 1245}
(( segid " " and resid 53 and name HG2 ))
(( segid " " and resid 53 and name HN ))
2.400 0.700 0.700 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 1.721 ppm2 7.622 CV 1
ASSI { 1246}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HG2 ))
2.300 0.700 0.700 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.36415E-02 ppm1 3.193 ppm2 1.505 CV 1
OR { 1246}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 46 and name HG2 ))
ASSI { 1247}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HG3 ))
2.400 0.700 0.700 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 3.193 ppm2 1.468 CV 1
OR { 1247}
(( segid " " and resid 46 and name HD3 ))
(( segid " " and resid 46 and name HG3 ))
ASSI { 1249}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 35 and name HG ))
2.400 2.400 3.600 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.35152E-02 ppm1 3.217 ppm2 1.584 CV 1
ASSI { 1250}
(( segid " " and resid 46 and name HG3 ))
(( segid " " and resid 46 and name HE ))
2.400 2.400 3.600 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.35638E-02 ppm1 1.473 ppm2 7.281 CV 1
ASSI { 1251}
(( segid " " and resid 46 and name HG3 ))
(( segid " " and resid 46 and name HN ))
2.400 2.400 3.600 peak 1251 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 1.476 ppm2 7.689 CV 1
ASSI { 1252}
(( segid " " and resid 56 and name HB3 ))
(( segid " " and resid 55 and name HG ))
2.400 2.400 3.600 peak 1252 spectrum 1 weight 0.10000E+01 volume 0.28743E-02 ppm1 2.799 ppm2 1.595 CV 1
ASSI { 1253}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 26 and name HD1 ))
2.500 0.800 0.800 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 5.562 ppm2 6.915 CV 1
ASSI { 1254}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 20 and name HN ))
2.300 2.300 3.700 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.37483E-02 ppm1 3.972 ppm2 9.309 CV 1
ASSI { 1257}
(( segid " " and resid 54 and name HD3 ))
(( segid " " and resid 54 and name HN ))
2.400 2.400 3.600 peak 1257 spectrum 1 weight 0.10000E+01 volume 0.32919E-02 ppm1 0.990 ppm2 8.820 CV 1
ASSI { 1259}
(( segid " " and resid 54 and name HB3 ))
(( segid " " and resid 54 and name HN ))
2.300 2.300 3.700 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.41659E-02 ppm1 1.333 ppm2 8.820 CV 1
ASSI { 1260}
(( segid " " and resid 54 and name HG3 ))
(( segid " " and resid 54 and name HN ))
2.500 0.800 0.800 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.23694E-02 ppm1 1.581 ppm2 8.820 CV 1
ASSI { 1261}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HN ))
2.500 2.500 3.500 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.26607E-02 ppm1 1.764 ppm2 8.820 CV 1
ASSI { 1263}
(( segid " " and resid 54 and name HB3 ))
(( segid " " and resid 55 and name HN ))
2.300 2.300 3.700 peak 1263 spectrum 1 weight 0.10000E+01 volume 0.36318E-02 ppm1 1.333 ppm2 9.350 CV 1
ASSI { 1265}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB2 ))
2.400 0.700 0.700 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 5.054 ppm2 1.759 CV 1
ASSI { 1266}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HG3 ))
2.400 2.400 3.600 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.33599E-02 ppm1 5.054 ppm2 1.568 CV 1
ASSI { 1267}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB3 ))
2.500 0.800 0.800 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.27384E-02 ppm1 5.055 ppm2 1.347 CV 1
ASSI { 1271}
(( segid " " and resid 54 and name HE3 ))
(( segid " " and resid 54 and name HD3 ))
2.400 0.700 0.700 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.28161E-02 ppm1 2.968 ppm2 0.990 CV 1
ASSI { 1273}
(( segid " " and resid 54 and name HE3 ))
(( segid " " and resid 54 and name HB3 ))
2.400 2.400 3.600 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 2.960 ppm2 1.341 CV 1
ASSI { 1274}
(( segid " " and resid 54 and name HE3 ))
(( segid " " and resid 54 and name HG3 ))
2.500 2.500 3.500 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.26607E-02 ppm1 2.959 ppm2 1.571 CV 1
ASSI { 1275}
(( segid " " and resid 54 and name HE3 ))
(( segid " " and resid 54 and name HB2 ))
2.400 2.400 3.600 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 2.960 ppm2 1.769 CV 1
ASSI { 1277}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 61 and name HN ))
2.500 0.800 0.800 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 1.827 ppm2 8.232 CV 1
ASSI { 1278}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HB3 ))
2.400 0.700 0.700 peak 1278 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 3.702 ppm2 1.841 CV 1
ASSI { 1279}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HB2 ))
2.500 0.800 0.800 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.27384E-02 ppm1 3.702 ppm2 1.357 CV 1
ASSI { 1281}
(( segid " " and resid 64 and name HA2 ))
( segid " " and resid 61 and name HD2%)
2.500 2.500 3.500 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.27772E-02 ppm1 3.700 ppm2 0.826 CV 1
OR { 1281}
(( segid " " and resid 64 and name HA2 ))
( segid " " and resid 61 and name HD1%)
ASSI { 1292}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HB3 ))
2.400 0.700 0.700 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 4.495 ppm2 1.985 CV 1
ASSI { 1293}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HB2 ))
2.500 0.800 0.800 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.24762E-02 ppm1 4.495 ppm2 2.030 CV 1
ASSI { 1294}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HG3 ))
2.400 0.700 0.700 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.34084E-02 ppm1 4.495 ppm2 2.485 CV 1
ASSI { 1295}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 77 and name HG2 ))
2.400 0.700 0.700 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.34084E-02 ppm1 4.495 ppm2 2.567 CV 1
ASSI { 1300}
(( segid " " and resid 85 and name HG2 ))
(( segid " " and resid 85 and name HG3 ))
6.000 4.500 0.000 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 2.569 ppm2 2.527 CV 1
ASSI { 1301}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HB3 ))
2.500 0.800 0.800 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.22237E-02 ppm1 2.796 ppm2 2.529 CV 1
ASSI { 1305}
(( segid " " and resid 71 and name HA2 ))
(( segid " " and resid 72 and name HN ))
2.500 0.800 0.800 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.24179E-02 ppm1 4.030 ppm2 8.372 CV 1
OR { 1305}
(( segid " " and resid 71 and name HA1 ))
(( segid " " and resid 72 and name HN ))
ASSI { 1306}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 18 and name HD% )
2.500 2.500 3.500 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 4.937 ppm2 6.909 CV 1
ASSI { 1310}
(( segid " " and resid 18 and name HB3 ))
( segid " " and resid 18 and name HD% )
2.300 0.700 0.700 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.37580E-02 ppm1 3.090 ppm2 6.911 CV 1
ASSI { 1313}
(( segid " " and resid 109 and name HD22))
(( segid " " and resid 109 and name HD21))
2.700 0.900 0.900 peak 1313 spectrum 1 weight 0.10000E+01 volume 0.16217E-02 ppm1 6.895 ppm2 7.600 CV 1
ASSI { 1314}
(( segid " " and resid 109 and name HB2 ))
(( segid " " and resid 109 and name HD21))
2.400 0.700 0.700 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.35347E-02 ppm1 2.835 ppm2 7.605 CV 1
ASSI { 1315}
(( segid " " and resid 109 and name HB3 ))
(( segid " " and resid 109 and name HD21))
2.400 0.700 0.700 peak 1315 spectrum 1 weight 0.10000E+01 volume 0.28161E-02 ppm1 2.733 ppm2 7.598 CV 1
ASSI { 1316}
(( segid " " and resid 109 and name HB2 ))
(( segid " " and resid 109 and name HD22))
2.400 2.400 3.600 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.34084E-02 ppm1 2.841 ppm2 6.895 CV 1
ASSI { 1318}
(( segid " " and resid 11 and name HE22))
(( segid " " and resid 11 and name HE21))
2.500 0.800 0.800 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.25248E-02 ppm1 6.835 ppm2 7.502 CV 1
ASSI { 1319}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 101 and name HB2 ))
2.400 0.700 0.700 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 4.922 ppm2 1.904 CV 1
ASSI { 1320}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 101 and name HB3 ))
2.400 0.700 0.700 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.33890E-02 ppm1 4.918 ppm2 1.837 CV 1
ASSI { 1321}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 101 and name HG3 ))
2.400 0.700 0.700 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.32142E-02 ppm1 4.922 ppm2 1.975 CV 1
OR { 1321}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 101 and name HG2 ))
ASSI { 1322}
(( segid " " and resid 101 and name HG3 ))
(( segid " " and resid 101 and name HN ))
2.300 0.700 0.700 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.40785E-02 ppm1 1.981 ppm2 8.018 CV 1
ASSI { 1323}
(( segid " " and resid 101 and name HB2 ))
(( segid " " and resid 101 and name HN ))
2.400 2.400 3.600 peak 1323 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 1.907 ppm2 8.019 CV 1
ASSI { 1324}
(( segid " " and resid 101 and name HB3 ))
(( segid " " and resid 101 and name HN ))
2.300 2.300 3.700 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.36609E-02 ppm1 1.837 ppm2 8.019 CV 1
ASSI { 1325}
(( segid " " and resid 99 and name HD3 ))
(( segid " " and resid 99 and name HH21))
2.500 2.500 3.500 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.22334E-02 ppm1 2.942 ppm2 6.348 CV 1
OR { 1325}
(( segid " " and resid 99 and name HD2 ))
(( segid " " and resid 99 and name HH21))
OR { 1325}
(( segid " " and resid 99 and name HD3 ))
(( segid " " and resid 99 and name HH22))
ASSI { 1326}
(( segid " " and resid 99 and name HG2 ))
(( segid " " and resid 99 and name HH21))
2.400 2.400 3.600 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.33890E-02 ppm1 1.446 ppm2 6.346 CV 1
OR { 1326}
(( segid " " and resid 99 and name HG2 ))
(( segid " " and resid 99 and name HH22))
OR { 1326}
(( segid " " and resid 99 and name HG3 ))
(( segid " " and resid 99 and name HH21))
ASSI { 1327}
(( segid " " and resid 99 and name HH22))
(( segid " " and resid 99 and name HE ))
2.500 2.500 3.500 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 6.352 ppm2 7.366 CV 1
ASSI { 1328}
( segid " " and resid 31 and name HD1%)
(( segid " " and resid 26 and name HE3 ))
2.400 2.400 3.600 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 -0.996 ppm2 7.202 CV 1
OR { 1328}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 26 and name HE3 ))
ASSI { 1329}
( segid " " and resid 31 and name HD1%)
(( segid " " and resid 26 and name HH2 ))
2.400 2.400 3.600 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.34764E-02 ppm1 -1.000 ppm2 7.101 CV 1
OR { 1329}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 26 and name HH2 ))
ASSI { 1332}
(( segid " " and resid 100 and name HB3 ))
(( segid " " and resid 101 and name HN ))
2.400 0.700 0.700 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 0.332 ppm2 8.012 CV 1
ASSI { 1339}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HN ))
2.500 0.800 0.800 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.26898E-02 ppm1 8.695 ppm2 10.056 CV 1
ASSI { 1340}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HN ))
2.400 0.700 0.700 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.30588E-02 ppm1 8.647 ppm2 9.956 CV 1
ASSI { 1343}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HN ))
2.400 0.700 0.700 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.28841E-02 ppm1 9.080 ppm2 9.666 CV 1
ASSI { 1345}
(( segid " " and resid 100 and name HB3 ))
(( segid " " and resid 100 and name HN ))
2.400 0.700 0.700 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 0.333 ppm2 8.838 CV 1
ASSI { 1346}
(( segid " " and resid 100 and name HG ))
(( segid " " and resid 100 and name HB3 ))
2.500 0.800 0.800 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.25830E-02 ppm1 1.329 ppm2 0.332 CV 1
ASSI { 1347}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 89 and name HB3 ))
2.500 0.800 0.800 peak 1347 spectrum 1 weight 0.10000E+01 volume 0.24568E-02 ppm1 4.692 ppm2 3.029 CV 1
ASSI { 1348}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HB2 ))
2.500 0.800 0.800 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 4.935 ppm2 3.431 CV 1
ASSI { 1349}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HB3 ))
2.500 0.800 0.800 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 4.931 ppm2 3.089 CV 1
ASSI { 1351}
(( segid " " and resid 97 and name HA ))
( segid " " and resid 97 and name HD1%)
2.400 2.400 3.600 peak 1351 spectrum 1 weight 0.10000E+01 volume 0.28161E-02 ppm1 4.513 ppm2 0.454 CV 1
ASSI { 1354}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HG2 ))
2.500 2.500 3.500 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.24179E-02 ppm1 4.303 ppm2 2.302 CV 1
ASSI { 1355}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HG3 ))
2.500 2.500 3.500 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 4.782 ppm2 1.682 CV 1
ASSI { 1356}
( segid " " and resid 31 and name HD1%)
(( segid " " and resid 26 and name HE1 ))
2.300 2.300 3.700 peak 1356 spectrum 1 weight 0.10000E+01 volume 0.39037E-02 ppm1 -0.995 ppm2 9.896 CV 1
ASSI { 1358}
( segid " " and resid 35 and name HD2%)
(( segid " " and resid 34 and name HN ))
2.400 2.400 3.600 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.29035E-02 ppm1 0.973 ppm2 9.665 CV 1
OR { 1358}
( segid " " and resid 35 and name HD1%)
(( segid " " and resid 34 and name HN ))
ASSI { 1359}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 26 and name HE1 ))
2.300 2.300 3.700 peak 1359 spectrum 1 weight 0.10000E+01 volume 0.43601E-02 ppm1 5.570 ppm2 9.894 CV 1
ASSI { 1360}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HN ))
2.500 0.800 0.800 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 7.846 ppm2 9.466 CV 1
ASSI { 1361}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 8 and name HN ))
2.500 0.800 0.800 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.25053E-02 ppm1 7.989 ppm2 9.453 CV 1
ASSI { 1362}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 8 and name HN ))
2.400 0.700 0.700 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.32919E-02 ppm1 9.062 ppm2 9.453 CV 1
ASSI { 1365}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 26 and name HN ))
2.300 2.300 3.700 peak 1365 spectrum 1 weight 0.10000E+01 volume 0.37969E-02 ppm1 7.178 ppm2 9.345 CV 1
ASSI { 1367}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HN ))
2.500 0.800 0.800 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 6.565 ppm2 9.302 CV 1
ASSI { 1368}
( segid " " and resid 60 and name HD% )
(( segid " " and resid 60 and name HN ))
2.400 2.400 3.600 peak 1368 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 6.436 ppm2 8.828 CV 1
ASSI { 1369}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 100 and name HN ))
2.400 0.700 0.700 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.31948E-02 ppm1 5.676 ppm2 8.834 CV 1
ASSI { 1370}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 7 and name HN ))
2.400 0.700 0.700 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.32822E-02 ppm1 5.870 ppm2 9.047 CV 1
ASSI { 1376}
( segid " " and resid 4 and name HD2%)
(( segid " " and resid 5 and name HN ))
2.300 2.300 3.700 peak 1376 spectrum 1 weight 0.10000E+01 volume 0.37095E-02 ppm1 -0.046 ppm2 8.148 CV 1
OR { 1376}
( segid " " and resid 4 and name HD1%)
(( segid " " and resid 5 and name HN ))
ASSI { 1377}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 101 and name HN ))
2.400 2.400 3.600 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.28161E-02 ppm1 0.991 ppm2 8.013 CV 1
ASSI { 1396}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 24 and name HE22))
2.300 0.700 0.700 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.38260E-02 ppm1 0.506 ppm2 6.954 CV 1
ASSI { 1397}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 24 and name HE22))
2.400 2.400 3.600 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.34473E-02 ppm1 0.605 ppm2 6.960 CV 1
ASSI { 1402}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 24 and name HE21))
2.300 0.700 0.700 peak 1402 spectrum 1 weight 0.10000E+01 volume 0.42144E-02 ppm1 0.501 ppm2 7.312 CV 1
ASSI { 1403}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 24 and name HE21))
2.400 2.400 3.600 peak 1403 spectrum 1 weight 0.10000E+01 volume 0.35832E-02 ppm1 0.601 ppm2 7.311 CV 1
ASSI { 1407}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 32 and name HA ))
2.300 2.300 3.700 peak 1407 spectrum 1 weight 0.10000E+01 volume 0.37969E-02 ppm1 4.186 ppm2 5.346 CV 1
ASSI { 1410}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 5 and name HN ))
2.400 0.700 0.700 peak 1410 spectrum 1 weight 0.10000E+01 volume 0.33599E-02 ppm1 0.180 ppm2 8.141 CV 1
ASSI { 1412}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 26 and name HN ))
2.300 2.300 3.700 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.37580E-02 ppm1 0.196 ppm2 9.352 CV 1
ASSI { 1414}
(( segid " " and resid 1 and name HA2 ))
(( segid " " and resid 2 and name HN ))
2.500 0.800 0.800 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 3.855 ppm2 8.598 CV 1
OR { 1414}
(( segid " " and resid 1 and name HA1 ))
(( segid " " and resid 2 and name HN ))
ASSI { 1415}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 19 and name HA ))
2.400 0.700 0.700 peak 1415 spectrum 1 weight 0.10000E+01 volume 0.30977E-02 ppm1 4.828 ppm2 5.665 CV 1
ASSI { 1416}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 10 and name HN ))
2.300 2.300 3.700 peak 1416 spectrum 1 weight 0.10000E+01 volume 0.39911E-02 ppm1 5.022 ppm2 7.858 CV 1
ASSI { 1422}
(( segid " " and resid 61 and name HG ))
( segid " " and resid 60 and name HD% )
2.500 2.500 3.500 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.27093E-02 ppm1 0.729 ppm2 6.574 CV 1
ASSI { 1423}
( segid " " and resid 61 and name HD2%)
( segid " " and resid 60 and name HD% )
2.400 0.700 0.700 peak 1423 spectrum 1 weight 0.10000E+01 volume 0.35347E-02 ppm1 0.826 ppm2 6.575 CV 1
OR { 1423}
( segid " " and resid 61 and name HD1%)
( segid " " and resid 60 and name HD% )
ASSI { 1424}
( segid " " and resid 55 and name HD2%)
( segid " " and resid 60 and name HD% )
2.400 0.700 0.700 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 0.935 ppm2 6.577 CV 1
OR { 1424}
( segid " " and resid 55 and name HD1%)
( segid " " and resid 60 and name HD% )
ASSI { 1428}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 93 and name HN ))
2.500 0.800 0.800 peak 1428 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 7.575 ppm2 8.494 CV 1
ASSI { 1429}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 50 and name HN ))
2.500 2.500 3.500 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 7.623 ppm2 8.421 CV 1
ASSI { 1430}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HN ))
2.500 0.800 0.800 peak 1430 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 7.656 ppm2 8.644 CV 1
ASSI { 1431}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HN ))
2.500 0.800 0.800 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.25248E-02 ppm1 7.889 ppm2 8.536 CV 1
ASSI { 1432}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HN ))
2.500 2.500 3.500 peak 1432 spectrum 1 weight 0.10000E+01 volume 0.24762E-02 ppm1 7.961 ppm2 8.686 CV 1
ASSI { 1433}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 38 and name HN ))
2.500 0.800 0.800 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.27384E-02 ppm1 8.038 ppm2 8.872 CV 1
ASSI { 1435}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 25 and name HN ))
2.400 2.400 3.600 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 7.179 ppm2 8.439 CV 1
ASSI { 1436}
( segid " " and resid 105 and name HD% )
(( segid " " and resid 106 and name HN ))
2.400 2.400 3.600 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 7.209 ppm2 8.151 CV 1
ASSI { 1437}
(( segid " " and resid 27 and name HE1 ))
(( segid " " and resid 11 and name HN ))
2.400 2.400 3.600 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 7.238 ppm2 8.287 CV 1
ASSI { 1441}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 57 and name HN ))
2.300 2.300 3.700 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.42144E-02 ppm1 6.234 ppm2 8.949 CV 1
ASSI { 1442}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 82 and name HD2 ))
2.600 0.800 0.800 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.21752E-02 ppm1 4.642 ppm2 3.813 CV 1
ASSI { 1443}
(( segid " " and resid 81 and name HA ))
(( segid " " and resid 82 and name HD3 ))
2.500 0.800 0.800 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 4.642 ppm2 3.724 CV 1
ASSI { 1444}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 31 and name HD2%)
2.500 0.800 0.800 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 4.014 ppm2 -1.004 CV 1
OR { 1444}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 31 and name HD1%)
ASSI { 1448}
(( segid " " and resid 36 and name HB3 ))
(( segid " " and resid 36 and name HA ))
2.300 0.700 0.700 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.36803E-02 ppm1 3.217 ppm2 5.004 CV 1
ASSI { 1449}
(( segid " " and resid 94 and name HA ))
( segid " " and resid 48 and name HD% )
2.500 2.500 3.500 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.26898E-02 ppm1 4.045 ppm2 6.228 CV 1
ASSI { 1450}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 48 and name HD% )
2.500 2.500 3.500 peak 1450 spectrum 1 weight 0.10000E+01 volume 0.26898E-02 ppm1 3.597 ppm2 6.230 CV 1
ASSI { 1452}
(( segid " " and resid 60 and name HB3 ))
( segid " " and resid 48 and name HD% )
2.500 2.500 3.500 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.24082E-02 ppm1 2.722 ppm2 6.228 CV 1
OR { 1452}
(( segid " " and resid 93 and name HB3 ))
( segid " " and resid 48 and name HD% )
OR { 1452}
(( segid " " and resid 60 and name HB2 ))
( segid " " and resid 48 and name HD% )
ASSI { 1461}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 60 and name HD% )
2.400 0.700 0.700 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 3.601 ppm2 6.421 CV 1
ASSI { 1463}
( segid " " and resid 48 and name HD% )
( segid " " and resid 60 and name HD% )
2.400 2.400 3.600 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 6.243 ppm2 6.575 CV 1
ASSI { 1464}
(( segid " " and resid 99 and name HH21))
( segid " " and resid 17 and name HD% )
2.400 0.700 0.700 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 6.360 ppm2 7.036 CV 1
ASSI { 1465}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 34 and name HN ))
2.400 2.400 3.600 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.33502E-02 ppm1 6.105 ppm2 9.664 CV 1
ASSI { 1466}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HN ))
2.500 2.500 3.500 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 9.155 ppm2 9.352 CV 1
ASSI { 1467}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HN ))
2.500 0.800 0.800 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 8.243 ppm2 9.068 CV 1
ASSI { 1468}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 92 and name HN ))
2.500 0.800 0.800 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 8.340 ppm2 8.996 CV 1
ASSI { 1469}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HN ))
2.400 0.700 0.700 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 8.194 ppm2 8.966 CV 1
ASSI { 1472}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HN ))
2.500 0.800 0.800 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.22432E-02 ppm1 7.665 ppm2 7.934 CV 1
ASSI { 1475}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 66 and name HN ))
2.400 2.400 3.600 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 7.939 ppm2 8.334 CV 1
ASSI { 1476}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 64 and name HN ))
2.500 0.800 0.800 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 7.484 ppm2 7.654 CV 1
ASSI { 1477}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 65 and name HN ))
2.400 2.400 3.600 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.33987E-02 ppm1 7.480 ppm2 7.935 CV 1
ASSI { 1479}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 64 and name HN ))
2.400 2.400 3.600 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.28938E-02 ppm1 4.037 ppm2 7.655 CV 1
ASSI { 1481}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HN ))
2.500 0.800 0.800 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.25151E-02 ppm1 7.475 ppm2 7.822 CV 1
ASSI { 1482}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HN ))
2.400 0.700 0.700 peak 1482 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 7.837 ppm2 8.228 CV 1
ASSI { 1483}
(( segid " " and resid 91 and name HB2 ))
( segid " " and resid 48 and name HD% )
2.300 2.300 3.700 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.42630E-02 ppm1 2.810 ppm2 6.478 CV 1
ASSI { 1484}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HN ))
2.400 0.700 0.700 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.28841E-02 ppm1 8.239 ppm2 8.834 CV 1
ASSI { 1486}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 61 and name HN ))
6.000 4.500 0.000 peak 1486 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.019 ppm2 8.225 CV 1
ASSI { 1487}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 60 and name HN ))
2.300 2.300 3.700 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.37677E-02 ppm1 2.554 ppm2 8.833 CV 1
ASSI { 1488}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 60 and name HN ))
2.400 2.400 3.600 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 3.118 ppm2 8.832 CV 1
ASSI { 1490}
(( segid " " and resid 101 and name HB3 ))
(( segid " " and resid 102 and name HN ))
2.400 2.400 3.600 peak 1490 spectrum 1 weight 0.10000E+01 volume 0.30977E-02 ppm1 1.834 ppm2 9.331 CV 1
ASSI { 1491}
(( segid " " and resid 101 and name HB2 ))
(( segid " " and resid 102 and name HN ))
2.400 2.400 3.600 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.31948E-02 ppm1 1.882 ppm2 9.328 CV 1
ASSI { 1492}
(( segid " " and resid 101 and name HG2 ))
(( segid " " and resid 102 and name HN ))
2.400 2.400 3.600 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 1.967 ppm2 9.331 CV 1
OR { 1492}
(( segid " " and resid 101 and name HG3 ))
(( segid " " and resid 102 and name HN ))
ASSI { 1494}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HN ))
2.500 0.800 0.800 peak 1494 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 8.500 ppm2 8.996 CV 1
ASSI { 1496}
(( segid " " and resid 111 and name HG12))
(( segid " " and resid 112 and name HN ))
2.200 2.200 3.800 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.51369E-02 ppm1 1.424 ppm2 8.438 CV 1
ASSI { 1497}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 112 and name HN ))
2.600 0.800 0.800 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.20781E-02 ppm1 4.218 ppm2 8.439 CV 1
ASSI { 1498}
(( segid " " and resid 110 and name HA2 ))
(( segid " " and resid 111 and name HN ))
2.500 0.800 0.800 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 3.964 ppm2 7.995 CV 1
ASSI { 1500}
(( segid " " and resid 112 and name HA ))
(( segid " " and resid 113 and name HN ))
2.500 0.800 0.800 peak 1500 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 4.696 ppm2 8.270 CV 1
ASSI { 1501}
(( segid " " and resid 113 and name HA ))
(( segid " " and resid 114 and name HN ))
2.400 0.700 0.700 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 4.676 ppm2 7.881 CV 1
ASSI { 1502}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 25 and name HD% )
2.400 0.700 0.700 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.34570E-02 ppm1 4.202 ppm2 7.162 CV 1
ASSI { 1511}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HN ))
2.300 2.300 3.700 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.36706E-02 ppm1 8.442 ppm2 9.348 CV 1
ASSI { 1512}
(( segid " " and resid 15 and name HB2 ))
(( segid " " and resid 17 and name HN ))
2.300 0.700 0.700 peak 1512 spectrum 1 weight 0.10000E+01 volume 0.37192E-02 ppm1 2.589 ppm2 7.875 CV 1
ASSI { 1513}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 17 and name HN ))
2.500 0.800 0.800 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.25830E-02 ppm1 3.422 ppm2 7.875 CV 1
ASSI { 1519}
(( segid " " and resid 20 and name HB2 ))
( segid " " and resid 25 and name HD% )
2.300 0.700 0.700 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.37192E-02 ppm1 1.852 ppm2 7.163 CV 1
ASSI { 1520}
(( segid " " and resid 20 and name HB3 ))
( segid " " and resid 25 and name HD% )
2.500 0.800 0.800 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 1.663 ppm2 7.164 CV 1
ASSI { 1522}
(( segid " " and resid 75 and name HB2 ))
(( segid " " and resid 76 and name HN ))
2.400 2.400 3.600 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.34278E-02 ppm1 2.723 ppm2 8.029 CV 1
ASSI { 1530}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 92 and name HN ))
2.300 2.300 3.700 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.46514E-02 ppm1 6.235 ppm2 8.981 CV 1
ASSI { 1531}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 47 and name HN ))
2.400 2.400 3.600 peak 1531 spectrum 1 weight 0.10000E+01 volume 0.30783E-02 ppm1 6.237 ppm2 8.878 CV 1
ASSI { 1532}
( segid " " and resid 48 and name HD% )
(( segid " " and resid 49 and name HN ))
2.400 2.400 3.600 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 6.238 ppm2 8.837 CV 1
ASSI { 1533}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 104 and name HN ))
2.500 0.800 0.800 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.24179E-02 ppm1 7.638 ppm2 8.115 CV 1
ASSI { 1534}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 106 and name HN ))
2.400 2.400 3.600 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 7.633 ppm2 8.151 CV 1
ASSI { 1538}
(( segid " " and resid 64 and name HA2 ))
(( segid " " and resid 63 and name HN ))
2.300 2.300 3.700 peak 1538 spectrum 1 weight 0.10000E+01 volume 0.36997E-02 ppm1 3.700 ppm2 7.480 CV 1
ASSI { 1541}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 4 and name HN ))
2.200 2.200 3.800 peak 1541 spectrum 1 weight 0.10000E+01 volume 0.47194E-02 ppm1 6.574 ppm2 8.333 CV 1
OR { 1541}
( segid " " and resid 60 and name HE% )
(( segid " " and resid 91 and name HN ))
OR { 1541}
( segid " " and resid 60 and name HE% )
(( segid " " and resid 66 and name HN ))
ASSI { 1548}
(( segid " " and resid 107 and name HA ))
( segid " " and resid 105 and name HD% )
2.400 2.400 3.600 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.35638E-02 ppm1 4.204 ppm2 7.341 CV 1
ASSI { 1550}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 23 and name HN ))
2.400 2.400 3.600 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.30588E-02 ppm1 0.495 ppm2 8.685 CV 1
ASSI { 1556}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 77 and name HN ))
2.500 0.800 0.800 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 0.929 ppm2 8.411 CV 1
OR { 1556}
( segid " " and resid 76 and name HG1%)
(( segid " " and resid 77 and name HN ))
ASSI { 1560}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 34 and name HN ))
2.300 2.300 3.700 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.39716E-02 ppm1 0.413 ppm2 9.668 CV 1
OR { 1560}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 34 and name HN ))
ASSI { 1561}
(( segid " " and resid 97 and name HG12))
(( segid " " and resid 97 and name HN ))
2.400 0.700 0.700 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.33890E-02 ppm1 0.415 ppm2 8.245 CV 1
ASSI { 1563}
(( segid " " and resid 52 and name HA2 ))
( segid " " and resid 49 and name HD% )
2.400 2.400 3.600 peak 1563 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 3.428 ppm2 6.717 CV 1
ASSI { 1567}
( segid " " and resid 47 and name HD1%)
( segid " " and resid 31 and name HD2%)
2.500 0.800 0.800 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 0.620 ppm2 -1.002 CV 1
OR { 1567}
( segid " " and resid 47 and name HD2%)
( segid " " and resid 31 and name HD2%)
OR { 1567}
( segid " " and resid 47 and name HD1%)
( segid " " and resid 31 and name HD1%)
ASSI { 1568}
( segid " " and resid 21 and name HB% )
( segid " " and resid 31 and name HD1%)
2.400 2.400 3.600 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.28938E-02 ppm1 1.156 ppm2 -1.002 CV 1
OR { 1568}
( segid " " and resid 21 and name HB% )
( segid " " and resid 31 and name HD2%)
ASSI { 1569}
(( segid " " and resid 54 and name HE3 ))
( segid " " and resid 31 and name HD2%)
2.400 2.400 3.600 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.36026E-02 ppm1 2.978 ppm2 -1.002 CV 1
OR { 1569}
(( segid " " and resid 54 and name HE3 ))
( segid " " and resid 31 and name HD1%)
ASSI { 1572}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 31 and name HD2%)
2.400 0.700 0.700 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 1.854 ppm2 -1.000 CV 1
OR { 1572}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 31 and name HD1%)
ASSI { 1574}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 31 and name HD2%)
2.400 0.700 0.700 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 4.003 ppm2 0.214 CV 1
OR { 1574}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 31 and name HD1%)
ASSI { 1577}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HA2 ))
2.400 2.400 3.600 peak 1577 spectrum 1 weight 0.10000E+01 volume 0.35638E-02 ppm1 4.354 ppm2 2.353 CV 1
ASSI { 1578}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HA1 ))
2.300 2.300 3.700 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.39231E-02 ppm1 4.356 ppm2 3.672 CV 1
ASSI { 1582}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 22 and name HA ))
2.400 2.400 3.600 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.32142E-02 ppm1 3.993 ppm2 3.552 CV 1
ASSI { 1583}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HD3 ))
2.400 2.400 3.600 peak 1583 spectrum 1 weight 0.10000E+01 volume 0.35055E-02 ppm1 3.693 ppm2 2.832 CV 1
OR { 1583}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HD2 ))
ASSI { 1584}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 102 and name HB2 ))
2.300 2.300 3.700 peak 1584 spectrum 1 weight 0.10000E+01 volume 0.37095E-02 ppm1 3.693 ppm2 3.220 CV 1
ASSI { 1585}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 56 and name HB3 ))
2.500 0.800 0.800 peak 1585 spectrum 1 weight 0.10000E+01 volume 0.23111E-02 ppm1 3.427 ppm2 2.788 CV 1
ASSI { 1587}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 4 and name HD2%)
2.000 2.000 4.000 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.85162E-02 ppm1 2.802 ppm2 0.093 CV 1
OR { 1587}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 4 and name HD1%)
ASSI { 1588}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 4 and name HD2%)
2.200 2.200 3.800 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.48165E-02 ppm1 2.537 ppm2 -0.059 CV 1
OR { 1588}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 4 and name HD1%)
ASSI { 1592}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 4 and name HD2%)
2.500 0.800 0.800 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 4.212 ppm2 -0.058 CV 1
OR { 1592}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 4 and name HD1%)
ASSI { 1594}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 4 and name HD1%)
2.300 2.300 3.700 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.38066E-02 ppm1 4.293 ppm2 0.098 CV 1
OR { 1594}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 4 and name HD2%)
ASSI { 1598}
( segid " " and resid 5 and name HG2%)
( segid " " and resid 4 and name HD1%)
2.400 2.400 3.600 peak 1598 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 0.893 ppm2 -0.052 CV 1
OR { 1598}
( segid " " and resid 5 and name HG2%)
( segid " " and resid 4 and name HD2%)
ASSI { 1602}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 13 and name HD1%)
2.500 0.800 0.800 peak 1602 spectrum 1 weight 0.10000E+01 volume 0.24082E-02 ppm1 4.349 ppm2 0.176 CV 1
ASSI { 1603}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 13 and name HG2%)
2.500 0.800 0.800 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 3.443 ppm2 0.483 CV 1
ASSI { 1612}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 40 and name HD1%)
2.500 0.800 0.800 peak 1612 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 4.189 ppm2 0.393 CV 1
OR { 1612}
(( segid " " and resid 33 and name HA ))
( segid " " and resid 40 and name HD2%)
ASSI { 1614}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 40 and name HD1%)
2.400 2.400 3.600 peak 1614 spectrum 1 weight 0.10000E+01 volume 0.31657E-02 ppm1 4.640 ppm2 0.395 CV 1
OR { 1614}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 40 and name HD2%)
ASSI { 1619}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 40 and name HD2%)
2.400 2.400 3.600 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.31365E-02 ppm1 3.004 ppm2 0.750 CV 1
OR { 1619}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 40 and name HD1%)
ASSI { 1621}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 40 and name HD1%)
2.400 2.400 3.600 peak 1621 spectrum 1 weight 0.10000E+01 volume 0.29229E-02 ppm1 1.771 ppm2 0.392 CV 1
OR { 1621}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 40 and name HD2%)
ASSI { 1624}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 55 and name HA ))
2.200 2.200 3.800 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.47097E-02 ppm1 3.433 ppm2 6.095 CV 1
ASSI { 1637}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 59 and name HB3 ))
2.600 0.800 0.800 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.20101E-02 ppm1 3.113 ppm2 2.538 CV 1
ASSI { 1638}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB3 ))
2.600 0.800 0.800 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.22043E-02 ppm1 4.557 ppm2 3.102 CV 1
ASSI { 1639}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB2 ))
2.600 0.800 0.800 peak 1639 spectrum 1 weight 0.10000E+01 volume 0.21363E-02 ppm1 4.591 ppm2 2.974 CV 1
ASSI { 1640}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB2 ))
2.500 0.800 0.800 peak 1640 spectrum 1 weight 0.10000E+01 volume 0.23888E-02 ppm1 4.557 ppm2 3.268 CV 1
ASSI { 1641}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB3 ))
2.400 0.700 0.700 peak 1641 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 4.601 ppm2 2.605 CV 1
ASSI { 1642}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HB3 ))
2.500 0.800 0.800 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 4.733 ppm2 3.398 CV 1
ASSI { 1645}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HG2 ))
2.400 2.400 3.600 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 4.737 ppm2 2.308 CV 1
OR { 1645}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HG3 ))
ASSI { 1653}
(( segid " " and resid 31 and name HA ))
( segid " " and resid 22 and name HD1%)
2.300 2.300 3.700 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.38260E-02 ppm1 4.003 ppm2 0.598 CV 1
ASSI { 1656}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 13 and name HD1%)
2.300 0.700 0.700 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.38454E-02 ppm1 4.235 ppm2 0.181 CV 1
ASSI { 1658}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 31 and name HB3 ))
2.300 2.300 3.700 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.39328E-02 ppm1 3.490 ppm2 0.596 CV 1
ASSI { 1660}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 19 and name HB2 ))
2.100 2.100 3.900 peak 1660 spectrum 1 weight 0.10000E+01 volume 0.62634E-02 ppm1 3.492 ppm2 1.854 CV 1
ASSI { 1663}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 13 and name HG12))
2.300 2.300 3.700 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.43601E-02 ppm1 3.427 ppm2 1.081 CV 1
ASSI { 1664}
(( segid " " and resid 52 and name HA1 ))
(( segid " " and resid 51 and name HA ))
2.300 2.300 3.700 peak 1664 spectrum 1 weight 0.10000E+01 volume 0.42630E-02 ppm1 4.077 ppm2 3.888 CV 1
ASSI { 1667}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 47 and name HD2%)
2.400 2.400 3.600 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.35929E-02 ppm1 5.758 ppm2 0.618 CV 1
OR { 1667}
(( segid " " and resid 49 and name HA ))
( segid " " and resid 47 and name HD1%)
ASSI { 1668}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 97 and name HG2%)
2.300 2.300 3.700 peak 1668 spectrum 1 weight 0.10000E+01 volume 0.36609E-02 ppm1 5.675 ppm2 0.695 CV 1
ASSI { 1669}
(( segid " " and resid 48 and name HB2 ))
( segid " " and resid 47 and name HD2%)
2.400 2.400 3.600 peak 1669 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 2.356 ppm2 0.617 CV 1
OR { 1669}
(( segid " " and resid 48 and name HB2 ))
( segid " " and resid 47 and name HD1%)
ASSI { 1670}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 22 and name HG2%)
2.300 2.300 3.700 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.45154E-02 ppm1 2.348 ppm2 0.492 CV 1
ASSI { 1671}
(( segid " " and resid 15 and name HB2 ))
( segid " " and resid 13 and name HG2%)
2.300 2.300 3.700 peak 1671 spectrum 1 weight 0.10000E+01 volume 0.43795E-02 ppm1 2.579 ppm2 0.480 CV 1
ASSI { 1673}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 22 and name HG2%)
2.300 2.300 3.700 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.40590E-02 ppm1 2.921 ppm2 0.496 CV 1
ASSI { 1674}
(( segid " " and resid 95 and name HD3 ))
( segid " " and resid 22 and name HG2%)
2.300 2.300 3.700 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.36900E-02 ppm1 3.031 ppm2 0.497 CV 1
ASSI { 1675}
(( segid " " and resid 18 and name HB3 ))
( segid " " and resid 13 and name HG2%)
2.400 0.700 0.700 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.30588E-02 ppm1 3.085 ppm2 0.484 CV 1
ASSI { 1676}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 40 and name HD2%)
2.300 2.300 3.700 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.41561E-02 ppm1 3.004 ppm2 0.396 CV 1
OR { 1676}
(( segid " " and resid 33 and name HB2 ))
( segid " " and resid 40 and name HD1%)
ASSI { 1682}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 13 and name HG2%)
2.400 2.400 3.600 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.34861E-02 ppm1 4.935 ppm2 0.484 CV 1
ASSI { 1685}
(( segid " " and resid 101 and name HB3 ))
( segid " " and resid 17 and name HD% )
2.400 2.400 3.600 peak 1685 spectrum 1 weight 0.10000E+01 volume 0.31365E-02 ppm1 1.833 ppm2 7.036 CV 1
ASSI { 1686}
(( segid " " and resid 101 and name HB2 ))
( segid " " and resid 17 and name HD% )
2.400 2.400 3.600 peak 1686 spectrum 1 weight 0.10000E+01 volume 0.29229E-02 ppm1 1.909 ppm2 7.036 CV 1
ASSI { 1689}
(( segid " " and resid 16 and name HD3 ))
( segid " " and resid 17 and name HE% )
2.500 2.500 3.500 peak 1689 spectrum 1 weight 0.10000E+01 volume 0.24471E-02 ppm1 2.840 ppm2 6.693 CV 1
OR { 1689}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 17 and name HE% )
ASSI { 1695}
(( segid " " and resid 57 and name HG2 ))
( segid " " and resid 48 and name HD% )
2.500 2.500 3.500 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.27772E-02 ppm1 1.623 ppm2 6.481 CV 1
ASSI { 1699}
(( segid " " and resid 61 and name HB2 ))
( segid " " and resid 60 and name HD% )
2.400 0.700 0.700 peak 1699 spectrum 1 weight 0.10000E+01 volume 0.34376E-02 ppm1 1.369 ppm2 6.421 CV 1
ASSI { 1700}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 60 and name HD% )
2.400 2.400 3.600 peak 1700 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 3.704 ppm2 6.421 CV 1
ASSI { 1710}
(( segid " " and resid 57 and name HB3 ))
(( segid " " and resid 57 and name HN ))
2.500 0.800 0.800 peak 1710 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 1.997 ppm2 8.964 CV 1
ASSI { 1711}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HD2 ))
2.300 0.700 0.700 peak 1711 spectrum 1 weight 0.10000E+01 volume 0.36512E-02 ppm1 3.584 ppm2 3.162 CV 1
OR { 1711}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HD3 ))
ASSI { 1715}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HG3 ))
2.400 2.400 3.600 peak 1715 spectrum 1 weight 0.10000E+01 volume 0.31462E-02 ppm1 3.594 ppm2 1.412 CV 1
ASSI { 1720}
(( segid " " and resid 60 and name HB3 ))
( segid " " and resid 48 and name HE% )
2.400 2.400 3.600 peak 1720 spectrum 1 weight 0.10000E+01 volume 0.32725E-02 ppm1 2.710 ppm2 6.478 CV 1
OR { 1720}
(( segid " " and resid 93 and name HB3 ))
( segid " " and resid 48 and name HE% )
OR { 1720}
(( segid " " and resid 60 and name HB2 ))
( segid " " and resid 48 and name HE% )
ASSI { 1722}
(( segid " " and resid 54 and name HG3 ))
( segid " " and resid 49 and name HD% )
2.300 2.300 3.700 peak 1722 spectrum 1 weight 0.10000E+01 volume 0.39425E-02 ppm1 1.569 ppm2 6.902 CV 1
ASSI { 1726}
(( segid " " and resid 54 and name HB2 ))
( segid " " and resid 49 and name HD% )
2.300 2.300 3.700 peak 1726 spectrum 1 weight 0.10000E+01 volume 0.42533E-02 ppm1 1.762 ppm2 6.900 CV 1
ASSI { 1730}
(( segid " " and resid 54 and name HD3 ))
( segid " " and resid 22 and name HD1%)
2.400 2.400 3.600 peak 1730 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 0.997 ppm2 0.616 CV 1
OR { 1730}
(( segid " " and resid 54 and name HD3 ))
( segid " " and resid 47 and name HD1%)
OR { 1730}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 47 and name HD1%)
ASSI { 1731}
( segid " " and resid 19 and name HD2%)
(( segid " " and resid 31 and name HB3 ))
2.400 2.400 3.600 peak 1731 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 0.997 ppm2 0.599 CV 1
OR { 1731}
(( segid " " and resid 54 and name HD3 ))
( segid " " and resid 22 and name HD1%)
ASSI { 1738}
( segid " " and resid 55 and name HD2%)
(( segid " " and resid 55 and name HA ))
2.500 0.800 0.800 peak 1738 spectrum 1 weight 0.10000E+01 volume 0.24859E-02 ppm1 0.951 ppm2 6.095 CV 1
OR { 1738}
( segid " " and resid 55 and name HD1%)
(( segid " " and resid 55 and name HA ))
ASSI { 1739}
( segid " " and resid 55 and name HD1%)
(( segid " " and resid 56 and name HN ))
2.400 2.400 3.600 peak 1739 spectrum 1 weight 0.10000E+01 volume 0.33210E-02 ppm1 0.956 ppm2 8.736 CV 1
OR { 1739}
( segid " " and resid 55 and name HD2%)
(( segid " " and resid 56 and name HN ))
ASSI { 1759}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 49 and name HA ))
2.400 2.400 3.600 peak 1759 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 5.056 ppm2 5.750 CV 1
ASSI { 1760}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 17 and name HA ))
2.400 0.700 0.700 peak 1760 spectrum 1 weight 0.10000E+01 volume 0.28161E-02 ppm1 4.917 ppm2 5.605 CV 1
ASSI { 1761}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 26 and name HA ))
2.400 0.700 0.700 peak 1761 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 4.357 ppm2 5.862 CV 1
ASSI { 1762}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 55 and name HA ))
2.400 2.400 3.600 peak 1762 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 4.211 ppm2 6.096 CV 1
ASSI { 1765}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 27 and name HN ))
2.300 2.300 3.700 peak 1765 spectrum 1 weight 0.10000E+01 volume 0.42921E-02 ppm1 4.352 ppm2 9.171 CV 1
ASSI { 1766}
( segid " " and resid 31 and name HD1%)
(( segid " " and resid 26 and name HZ2 ))
2.400 2.400 3.600 peak 1766 spectrum 1 weight 0.10000E+01 volume 0.33987E-02 ppm1 -1.000 ppm2 7.051 CV 1
OR { 1766}
( segid " " and resid 31 and name HD2%)
(( segid " " and resid 26 and name HZ2 ))
ASSI { 1767}
( segid " " and resid 40 and name HD1%)
( segid " " and resid 31 and name HD2%)
2.400 0.700 0.700 peak 1767 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 0.407 ppm2 -1.001 CV 1
OR { 1767}
( segid " " and resid 40 and name HD2%)
( segid " " and resid 31 and name HD2%)
ASSI { 1768}
( segid " " and resid 47 and name HD1%)
( segid " " and resid 31 and name HD2%)
2.400 0.700 0.700 peak 1768 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 0.476 ppm2 -1.001 CV 1
OR { 1768}
( segid " " and resid 47 and name HD2%)
( segid " " and resid 31 and name HD2%)
OR { 1768}
( segid " " and resid 47 and name HD1%)
( segid " " and resid 31 and name HD1%)
ASSI { 1769}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 31 and name HD1%)
2.400 0.700 0.700 peak 1769 spectrum 1 weight 0.10000E+01 volume 0.28743E-02 ppm1 0.997 ppm2 -1.000 CV 1
OR { 1769}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 31 and name HD2%)
OR { 1769}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 31 and name HD1%)
ASSI { 1772}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 31 and name HD2%)
2.400 2.400 3.600 peak 1772 spectrum 1 weight 0.10000E+01 volume 0.29423E-02 ppm1 1.312 ppm2 0.218 CV 1
OR { 1772}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 31 and name HD1%)
ASSI { 1773}
(( segid " " and resid 13 and name HG13))
(( segid " " and resid 27 and name HE1 ))
2.300 2.300 3.700 peak 1773 spectrum 1 weight 0.10000E+01 volume 0.41756E-02 ppm1 -0.568 ppm2 7.232 CV 1
ASSI { 1774}
(( segid " " and resid 13 and name HG13))
(( segid " " and resid 6 and name HN ))
2.300 2.300 3.700 peak 1774 spectrum 1 weight 0.10000E+01 volume 0.36609E-02 ppm1 -0.579 ppm2 8.141 CV 1
ASSI { 1776}
( segid " " and resid 4 and name HD2%)
( segid " " and resid 25 and name HD% )
2.500 0.800 0.800 peak 1776 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 -0.054 ppm2 7.165 CV 1
ASSI { 1778}
( segid " " and resid 13 and name HD1%)
( segid " " and resid 25 and name HD% )
2.400 0.700 0.700 peak 1778 spectrum 1 weight 0.10000E+01 volume 0.32725E-02 ppm1 0.182 ppm2 7.160 CV 1
ASSI { 1779}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 27 and name HE1 ))
2.200 2.200 3.800 peak 1779 spectrum 1 weight 0.10000E+01 volume 0.47485E-02 ppm1 0.179 ppm2 7.227 CV 1
ASSI { 1782}
( segid " " and resid 4 and name HD2%)
( segid " " and resid 20 and name HZ% )
2.400 0.700 0.700 peak 1782 spectrum 1 weight 0.10000E+01 volume 0.30491E-02 ppm1 0.103 ppm2 6.929 CV 1
ASSI { 1787}
(( segid " " and resid 100 and name HB3 ))
( segid " " and resid 20 and name HZ% )
2.300 2.300 3.700 peak 1787 spectrum 1 weight 0.10000E+01 volume 0.36900E-02 ppm1 0.329 ppm2 6.930 CV 1
ASSI { 1788}
(( segid " " and resid 100 and name HB3 ))
( segid " " and resid 18 and name HD% )
2.400 0.700 0.700 peak 1788 spectrum 1 weight 0.10000E+01 volume 0.35347E-02 ppm1 0.323 ppm2 6.776 CV 1
ASSI { 1790}
( segid " " and resid 13 and name HD1%)
( segid " " and resid 18 and name HD% )
2.500 0.800 0.800 peak 1790 spectrum 1 weight 0.10000E+01 volume 0.27190E-02 ppm1 0.201 ppm2 6.911 CV 1
ASSI { 1791}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 26 and name HZ2 ))
2.500 0.800 0.800 peak 1791 spectrum 1 weight 0.10000E+01 volume 0.27384E-02 ppm1 0.507 ppm2 7.051 CV 1
ASSI { 1792}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 26 and name HH2 ))
2.300 2.300 3.700 peak 1792 spectrum 1 weight 0.10000E+01 volume 0.37095E-02 ppm1 0.509 ppm2 7.104 CV 1
ASSI { 1793}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 26 and name HH2 ))
2.400 2.400 3.600 peak 1793 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 0.603 ppm2 7.105 CV 1
ASSI { 1794}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 26 and name HZ2 ))
2.500 0.800 0.800 peak 1794 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 0.603 ppm2 7.047 CV 1
ASSI { 1795}
( segid " " and resid 22 and name HG2%)
( segid " " and resid 49 and name HD% )
2.400 0.700 0.700 peak 1795 spectrum 1 weight 0.10000E+01 volume 0.31948E-02 ppm1 0.488 ppm2 6.907 CV 1
ASSI { 1796}
( segid " " and resid 22 and name HD1%)
( segid " " and resid 49 and name HD% )
2.500 0.800 0.800 peak 1796 spectrum 1 weight 0.10000E+01 volume 0.26996E-02 ppm1 0.609 ppm2 6.902 CV 1
ASSI { 1799}
( segid " " and resid 13 and name HG2%)
( segid " " and resid 25 and name HD% )
2.400 2.400 3.600 peak 1799 spectrum 1 weight 0.10000E+01 volume 0.33696E-02 ppm1 0.485 ppm2 6.777 CV 1
ASSI { 1800}
(( segid " " and resid 4 and name HB3 ))
( segid " " and resid 25 and name HD% )
2.300 2.300 3.700 peak 1800 spectrum 1 weight 0.10000E+01 volume 0.36803E-02 ppm1 0.804 ppm2 7.165 CV 1
ASSI { 1801}
(( segid " " and resid 20 and name HD3 ))
( segid " " and resid 25 and name HD% )
2.500 2.500 3.500 peak 1801 spectrum 1 weight 0.10000E+01 volume 0.24471E-02 ppm1 0.887 ppm2 7.162 CV 1
ASSI { 1802}
( segid " " and resid 3 and name HD2%)
(( segid " " and resid 12 and name HD22))
2.300 2.300 3.700 peak 1802 spectrum 1 weight 0.10000E+01 volume 0.38648E-02 ppm1 0.824 ppm2 6.844 CV 1
OR { 1802}
( segid " " and resid 3 and name HD1%)
(( segid " " and resid 12 and name HD22))
ASSI { 1806}
(( segid " " and resid 16 and name HG2 ))
( segid " " and resid 17 and name HD% )
2.400 2.400 3.600 peak 1806 spectrum 1 weight 0.10000E+01 volume 0.33696E-02 ppm1 0.664 ppm2 6.690 CV 1
OR { 1806}
(( segid " " and resid 16 and name HG3 ))
( segid " " and resid 17 and name HD% )
ASSI { 1807}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 17 and name HD% )
2.400 2.400 3.600 peak 1807 spectrum 1 weight 0.10000E+01 volume 0.28064E-02 ppm1 1.145 ppm2 7.038 CV 1
ASSI { 1808}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 26 and name HE1 ))
2.300 2.300 3.700 peak 1808 spectrum 1 weight 0.10000E+01 volume 0.37677E-02 ppm1 0.513 ppm2 9.898 CV 1
ASSI { 1809}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 26 and name HE1 ))
2.300 0.700 0.700 peak 1809 spectrum 1 weight 0.10000E+01 volume 0.37192E-02 ppm1 0.607 ppm2 9.898 CV 1
ASSI { 1810}
(( segid " " and resid 22 and name HG13))
(( segid " " and resid 26 and name HE1 ))
2.500 2.500 3.500 peak 1810 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 1.152 ppm2 9.895 CV 1
ASSI { 1811}
(( segid " " and resid 22 and name HG12))
(( segid " " and resid 26 and name HE1 ))
2.500 2.500 3.500 peak 1811 spectrum 1 weight 0.10000E+01 volume 0.23500E-02 ppm1 1.717 ppm2 9.895 CV 1
ASSI { 1812}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 26 and name HE1 ))
2.400 2.400 3.600 peak 1812 spectrum 1 weight 0.10000E+01 volume 0.33307E-02 ppm1 7.966 ppm2 9.895 CV 1
ASSI { 1813}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 26 and name HE1 ))
2.500 0.800 0.800 peak 1813 spectrum 1 weight 0.10000E+01 volume 0.26996E-02 ppm1 9.141 ppm2 9.894 CV 1
ASSI { 1814}
(( segid " " and resid 26 and name HZ3 ))
(( segid " " and resid 8 and name HN ))
2.400 0.700 0.700 peak 1814 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 6.923 ppm2 9.450 CV 1
ASSI { 1815}
(( segid " " and resid 26 and name HE3 ))
(( segid " " and resid 8 and name HN ))
2.400 0.700 0.700 peak 1815 spectrum 1 weight 0.10000E+01 volume 0.29132E-02 ppm1 7.213 ppm2 9.455 CV 1
ASSI { 1817}
( segid " " and resid 17 and name HD% )
(( segid " " and resid 18 and name HN ))
2.400 2.400 3.600 peak 1817 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 7.045 ppm2 8.697 CV 1
ASSI { 1818}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 21 and name HN ))
2.400 2.400 3.600 peak 1818 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 7.963 ppm2 9.131 CV 1
ASSI { 1819}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 35 and name HN ))
2.300 2.300 3.700 peak 1819 spectrum 1 weight 0.10000E+01 volume 0.39231E-02 ppm1 8.038 ppm2 9.074 CV 1
ASSI { 1820}
(( segid " " and resid 26 and name HE3 ))
(( segid " " and resid 27 and name HN ))
2.300 2.300 3.700 peak 1820 spectrum 1 weight 0.10000E+01 volume 0.37386E-02 ppm1 7.219 ppm2 9.159 CV 1
ASSI { 1821}
(( segid " " and resid 26 and name HZ3 ))
(( segid " " and resid 27 and name HN ))
2.300 2.300 3.700 peak 1821 spectrum 1 weight 0.10000E+01 volume 0.40493E-02 ppm1 6.926 ppm2 9.160 CV 1
ASSI { 1822}
(( segid " " and resid 26 and name HD1 ))
(( segid " " and resid 21 and name HN ))
2.500 0.800 0.800 peak 1822 spectrum 1 weight 0.10000E+01 volume 0.25053E-02 ppm1 6.927 ppm2 9.132 CV 1
ASSI { 1823}
( segid " " and resid 25 and name HD% )
(( segid " " and resid 21 and name HN ))
2.200 2.200 3.800 peak 1823 spectrum 1 weight 0.10000E+01 volume 0.46902E-02 ppm1 7.183 ppm2 9.131 CV 1
ASSI { 1824}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 105 and name HD% )
2.400 2.400 3.600 peak 1824 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 3.679 ppm2 7.196 CV 1
ASSI { 1825}
(( segid " " and resid 8 and name HA2 ))
(( segid " " and resid 26 and name HE3 ))
2.400 2.400 3.600 peak 1825 spectrum 1 weight 0.10000E+01 volume 0.30588E-02 ppm1 4.007 ppm2 7.205 CV 1
ASSI { 1826}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 27 and name HE1 ))
2.400 2.400 3.600 peak 1826 spectrum 1 weight 0.10000E+01 volume 0.35541E-02 ppm1 3.876 ppm2 7.230 CV 1
ASSI { 1828}
(( segid " " and resid 8 and name HA1 ))
(( segid " " and resid 26 and name HE3 ))
2.300 2.300 3.700 peak 1828 spectrum 1 weight 0.10000E+01 volume 0.39619E-02 ppm1 4.551 ppm2 7.206 CV 1
ASSI { 1833}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 105 and name HD% )
2.400 0.700 0.700 peak 1833 spectrum 1 weight 0.10000E+01 volume 0.35929E-02 ppm1 1.390 ppm2 7.196 CV 1
ASSI { 1834}
(( segid " " and resid 16 and name HB3 ))
( segid " " and resid 105 and name HD% )
2.300 0.700 0.700 peak 1834 spectrum 1 weight 0.10000E+01 volume 0.40979E-02 ppm1 1.145 ppm2 7.197 CV 1
ASSI { 1836}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 13 and name HD1%)
2.500 0.800 0.800 peak 1836 spectrum 1 weight 0.10000E+01 volume 0.26510E-02 ppm1 2.534 ppm2 0.181 CV 1
ASSI { 1837}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 13 and name HD1%)
2.500 0.800 0.800 peak 1837 spectrum 1 weight 0.10000E+01 volume 0.27481E-02 ppm1 2.794 ppm2 0.176 CV 1
ASSI { 1838}
(( segid " " and resid 6 and name HB2 ))
( segid " " and resid 13 and name HD1%)
2.500 0.800 0.800 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 3.436 ppm2 0.177 CV 1
ASSI { 1839}
(( segid " " and resid 6 and name HB3 ))
( segid " " and resid 13 and name HD1%)
2.400 0.700 0.700 peak 1839 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 2.294 ppm2 0.177 CV 1
ASSI { 1840}
(( segid " " and resid 56 and name HB3 ))
( segid " " and resid 40 and name HD2%)
2.500 2.500 3.500 peak 1840 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 2.799 ppm2 0.752 CV 1
OR { 1840}
(( segid " " and resid 56 and name HB3 ))
( segid " " and resid 40 and name HD1%)
ASSI { 1842}
(( segid " " and resid 65 and name HA1 ))
(( segid " " and resid 61 and name HG ))
2.400 2.400 3.600 peak 1842 spectrum 1 weight 0.10000E+01 volume 0.35250E-02 ppm1 3.454 ppm2 0.720 CV 1
ASSI { 1844}
(( segid " " and resid 32 and name HA ))
( segid " " and resid 40 and name HD1%)
2.300 0.700 0.700 peak 1844 spectrum 1 weight 0.10000E+01 volume 0.38260E-02 ppm1 5.362 ppm2 0.752 CV 1
ASSI { 1846}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 40 and name HG ))
2.400 2.400 3.600 peak 1846 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 5.359 ppm2 1.548 CV 1
ASSI { 1849}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 8 and name HN ))
2.300 2.300 3.700 peak 1849 spectrum 1 weight 0.10000E+01 volume 0.41367E-02 ppm1 3.511 ppm2 9.454 CV 1
ASSI { 1851}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 29 and name HN ))
2.400 0.700 0.700 peak 1851 spectrum 1 weight 0.10000E+01 volume 0.33502E-02 ppm1 3.751 ppm2 8.644 CV 1
ASSI { 1852}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 29 and name HN ))
2.300 2.300 3.700 peak 1852 spectrum 1 weight 0.10000E+01 volume 0.39037E-02 ppm1 3.929 ppm2 8.644 CV 1
ASSI { 1853}
( segid " " and resid 13 and name HG2%)
( segid " " and resid 4 and name HD1%)
2.400 0.700 0.700 peak 1853 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 0.492 ppm2 0.101 CV 1
ASSI { 1855}
(( segid " " and resid 90 and name HA2 ))
(( segid " " and resid 92 and name HN ))
2.300 2.300 3.700 peak 1855 spectrum 1 weight 0.10000E+01 volume 0.44863E-02 ppm1 4.070 ppm2 8.999 CV 1
OR { 1855}
(( segid " " and resid 90 and name HA1 ))
(( segid " " and resid 92 and name HN ))
ASSI { 1856}
(( segid " " and resid 37 and name HA1 ))
(( segid " " and resid 38 and name HN ))
2.300 2.300 3.700 peak 1856 spectrum 1 weight 0.10000E+01 volume 0.36997E-02 ppm1 4.215 ppm2 8.870 CV 1
ASSI { 1857}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HN ))
2.500 0.800 0.800 peak 1857 spectrum 1 weight 0.10000E+01 volume 0.22529E-02 ppm1 4.358 ppm2 9.046 CV 1
ASSI { 1858}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 35 and name HN ))
2.300 2.300 3.700 peak 1858 spectrum 1 weight 0.10000E+01 volume 0.36900E-02 ppm1 4.223 ppm2 9.065 CV 1
ASSI { 1859}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 60 and name HN ))
2.300 2.300 3.700 peak 1859 spectrum 1 weight 0.10000E+01 volume 0.43018E-02 ppm1 3.589 ppm2 8.833 CV 1
ASSI { 1860}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 29 and name HN ))
2.300 2.300 3.700 peak 1860 spectrum 1 weight 0.10000E+01 volume 0.43504E-02 ppm1 5.121 ppm2 8.644 CV 1
ASSI { 1861}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 102 and name HN ))
2.300 2.300 3.700 peak 1861 spectrum 1 weight 0.10000E+01 volume 0.37289E-02 ppm1 3.681 ppm2 9.334 CV 1
ASSI { 1862}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 15 and name HN ))
2.400 2.400 3.600 peak 1862 spectrum 1 weight 0.10000E+01 volume 0.30783E-02 ppm1 3.876 ppm2 6.562 CV 1
ASSI { 1863}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 15 and name HN ))
2.500 0.800 0.800 peak 1863 spectrum 1 weight 0.10000E+01 volume 0.24762E-02 ppm1 0.485 ppm2 6.561 CV 1
ASSI { 1864}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 56 and name HN ))
2.400 2.400 3.600 peak 1864 spectrum 1 weight 0.10000E+01 volume 0.33696E-02 ppm1 0.768 ppm2 8.732 CV 1
OR { 1864}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 56 and name HN ))
ASSI { 1865}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 57 and name HN ))
2.300 2.300 3.700 peak 1865 spectrum 1 weight 0.10000E+01 volume 0.36318E-02 ppm1 0.755 ppm2 8.957 CV 1
OR { 1865}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 57 and name HN ))
ASSI { 1866}
( segid " " and resid 40 and name HD1%)
(( segid " " and resid 33 and name HN ))
2.400 0.700 0.700 peak 1866 spectrum 1 weight 0.10000E+01 volume 0.34764E-02 ppm1 0.762 ppm2 8.601 CV 1
OR { 1866}
( segid " " and resid 40 and name HD2%)
(( segid " " and resid 33 and name HN ))
ASSI { 1867}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 7 and name HN ))
2.400 2.400 3.600 peak 1867 spectrum 1 weight 0.10000E+01 volume 0.33016E-02 ppm1 0.192 ppm2 9.048 CV 1
ASSI { 1868}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 19 and name HN ))
2.400 2.400 3.600 peak 1868 spectrum 1 weight 0.10000E+01 volume 0.33696E-02 ppm1 0.487 ppm2 9.139 CV 1
ASSI { 1869}
( segid " " and resid 13 and name HD1%)
(( segid " " and resid 27 and name HN ))
2.300 2.300 3.700 peak 1869 spectrum 1 weight 0.10000E+01 volume 0.36706E-02 ppm1 0.203 ppm2 9.157 CV 1
ASSI { 1870}
( segid " " and resid 97 and name HG2%)
(( segid " " and resid 20 and name HN ))
2.300 0.700 0.700 peak 1870 spectrum 1 weight 0.10000E+01 volume 0.39328E-02 ppm1 0.705 ppm2 9.299 CV 1
ASSI { 1872}
(( segid " " and resid 94 and name HB2 ))
( segid " " and resid 48 and name HD% )
2.400 0.700 0.700 peak 1872 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 1.796 ppm2 6.230 CV 1
OR { 1872}
(( segid " " and resid 94 and name HB3 ))
( segid " " and resid 48 and name HD% )
ASSI { 1874}
(( segid " " and resid 94 and name HB2 ))
( segid " " and resid 48 and name HE% )
2.400 2.400 3.600 peak 1874 spectrum 1 weight 0.10000E+01 volume 0.28938E-02 ppm1 1.803 ppm2 6.483 CV 1
OR { 1874}
(( segid " " and resid 94 and name HB3 ))
( segid " " and resid 48 and name HE% )
ASSI { 1876}
(( segid " " and resid 58 and name HD3 ))
( segid " " and resid 48 and name HD% )
2.400 2.400 3.600 peak 1876 spectrum 1 weight 0.10000E+01 volume 0.34861E-02 ppm1 3.201 ppm2 6.229 CV 1
OR { 1876}
(( segid " " and resid 58 and name HD2 ))
( segid " " and resid 48 and name HD% )
OR { 1876}
(( segid " " and resid 46 and name HD3 ))
( segid " " and resid 48 and name HD% )
ASSI { 1877}
(( segid " " and resid 58 and name HD3 ))
( segid " " and resid 48 and name HE% )
2.400 2.400 3.600 peak 1877 spectrum 1 weight 0.10000E+01 volume 0.32919E-02 ppm1 3.203 ppm2 6.480 CV 1
OR { 1877}
(( segid " " and resid 58 and name HD2 ))
( segid " " and resid 48 and name HE% )
OR { 1877}
(( segid " " and resid 46 and name HD3 ))
( segid " " and resid 48 and name HE% )
ASSI { 1878}
(( segid " " and resid 58 and name HD2 ))
( segid " " and resid 60 and name HD% )
2.400 2.400 3.600 peak 1878 spectrum 1 weight 0.10000E+01 volume 0.36026E-02 ppm1 3.201 ppm2 6.426 CV 1
OR { 1878}
(( segid " " and resid 58 and name HD3 ))
( segid " " and resid 60 and name HD% )
ASSI { 1879}
( segid " " and resid 47 and name HD2%)
( segid " " and resid 48 and name HD% )
2.300 2.300 3.700 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.42338E-02 ppm1 0.621 ppm2 6.232 CV 1
OR { 1879}
( segid " " and resid 47 and name HD1%)
( segid " " and resid 48 and name HD% )
ASSI { 1880}
( segid " " and resid 55 and name HD2%)
( segid " " and resid 48 and name HD% )
2.300 2.300 3.700 peak 1880 spectrum 1 weight 0.10000E+01 volume 0.37774E-02 ppm1 0.943 ppm2 6.232 CV 1
OR { 1880}
( segid " " and resid 55 and name HD1%)
( segid " " and resid 48 and name HD% )
ASSI { 1883}
(( segid " " and resid 48 and name HB2 ))
( segid " " and resid 48 and name HD% )
2.300 0.700 0.700 peak 1883 spectrum 1 weight 0.10000E+01 volume 0.43115E-02 ppm1 2.374 ppm2 6.479 CV 1
ASSI { 1885}
(( segid " " and resid 52 and name HA1 ))
( segid " " and resid 49 and name HD% )
2.400 2.400 3.600 peak 1885 spectrum 1 weight 0.10000E+01 volume 0.33113E-02 ppm1 4.085 ppm2 6.717 CV 1
ASSI { 1886}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 16 and name HN ))
2.300 2.300 3.700 peak 1886 spectrum 1 weight 0.10000E+01 volume 0.43406E-02 ppm1 6.579 ppm2 8.516 CV 1
ASSI { 1887}
( segid " " and resid 49 and name HD% )
(( segid " " and resid 50 and name HN ))
2.300 2.300 3.700 peak 1887 spectrum 1 weight 0.10000E+01 volume 0.37774E-02 ppm1 6.913 ppm2 8.437 CV 1
ASSI { 1891}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 52 and name HN ))
2.500 0.800 0.800 peak 1891 spectrum 1 weight 0.10000E+01 volume 0.27287E-02 ppm1 0.893 ppm2 7.847 CV 1
OR { 1891}
( segid " " and resid 51 and name HD2%)
(( segid " " and resid 52 and name HN ))
ASSI { 1892}
(( segid " " and resid 61 and name HG ))
( segid " " and resid 89 and name HD% )
2.300 2.300 3.700 peak 1892 spectrum 1 weight 0.10000E+01 volume 0.37192E-02 ppm1 0.729 ppm2 7.261 CV 1
ASSI { 1900}
(( segid " " and resid 12 and name HB3 ))
(( segid " " and resid 13 and name HN ))
2.400 2.400 3.600 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.30588E-02 ppm1 2.535 ppm2 8.185 CV 1
ASSI { 1901}
(( segid " " and resid 12 and name HB2 ))
(( segid " " and resid 13 and name HN ))
2.300 2.300 3.700 peak 1901 spectrum 1 weight 0.10000E+01 volume 0.36900E-02 ppm1 2.675 ppm2 8.185 CV 1
ASSI { 1902}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HN ))
2.600 0.800 0.800 peak 1902 spectrum 1 weight 0.10000E+01 volume 0.22043E-02 ppm1 4.719 ppm2 8.176 CV 1
ASSI { 1903}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 26 and name HZ2 ))
2.400 0.700 0.700 peak 1903 spectrum 1 weight 0.10000E+01 volume 0.33987E-02 ppm1 2.082 ppm2 7.048 CV 1
ASSI { 1904}
(( segid " " and resid 24 and name HG3 ))
(( segid " " and resid 26 and name HZ2 ))
2.300 2.300 3.700 peak 1904 spectrum 1 weight 0.10000E+01 volume 0.44669E-02 ppm1 2.160 ppm2 7.048 CV 1
ASSI { 1905}
(( segid " " and resid 24 and name HG2 ))
(( segid " " and resid 26 and name HZ2 ))
2.300 2.300 3.700 peak 1905 spectrum 1 weight 0.10000E+01 volume 0.40105E-02 ppm1 2.304 ppm2 7.050 CV 1
ASSI { 1906}
(( segid " " and resid 25 and name HB3 ))
( segid " " and resid 20 and name HZ% )
2.400 2.400 3.600 peak 1906 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 2.530 ppm2 6.933 CV 1
ASSI { 1907}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HD1 ))
2.300 2.300 3.700 peak 1907 spectrum 1 weight 0.10000E+01 volume 0.36900E-02 ppm1 2.635 ppm2 6.912 CV 1
ASSI { 1909}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 26 and name HZ2 ))
2.500 2.500 3.500 peak 1909 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 1.726 ppm2 7.049 CV 1
ASSI { 1910}
(( segid " " and resid 99 and name HG2 ))
( segid " " and resid 17 and name HD% )
2.500 2.500 3.500 peak 1910 spectrum 1 weight 0.10000E+01 volume 0.25053E-02 ppm1 1.453 ppm2 7.038 CV 1
ASSI { 1911}
(( segid " " and resid 16 and name HB2 ))
( segid " " and resid 17 and name HD% )
2.400 2.400 3.600 peak 1911 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 1.378 ppm2 7.038 CV 1
ASSI { 1912}
(( segid " " and resid 16 and name HG2 ))
( segid " " and resid 17 and name HD% )
2.300 2.300 3.700 peak 1912 spectrum 1 weight 0.10000E+01 volume 0.37192E-02 ppm1 0.659 ppm2 7.033 CV 1
OR { 1912}
(( segid " " and resid 16 and name HG3 ))
( segid " " and resid 17 and name HD% )
ASSI { 1919}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 26 and name HE3 ))
2.500 2.500 3.500 peak 1919 spectrum 1 weight 0.10000E+01 volume 0.24762E-02 ppm1 3.502 ppm2 7.203 CV 1
ASSI { 1921}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 27 and name HE1 ))
2.400 2.400 3.600 peak 1921 spectrum 1 weight 0.10000E+01 volume 0.31657E-02 ppm1 3.418 ppm2 7.228 CV 1
ASSI { 1929}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB3 ))
2.400 0.700 0.700 peak 1929 spectrum 1 weight 0.10000E+01 volume 0.28743E-02 ppm1 4.728 ppm2 2.429 CV 1
ASSI { 1930}
(( segid " " and resid 11 and name HA ))
(( segid " " and resid 11 and name HB2 ))
2.500 0.800 0.800 peak 1930 spectrum 1 weight 0.10000E+01 volume 0.23403E-02 ppm1 4.728 ppm2 2.510 CV 1
ASSI { 1931}
(( segid " " and resid 6 and name HB2 ))
(( segid " " and resid 11 and name HN ))
2.400 2.400 3.600 peak 1931 spectrum 1 weight 0.10000E+01 volume 0.32822E-02 ppm1 3.419 ppm2 8.288 CV 1
ASSI { 1932}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 37 and name HN ))
2.300 2.300 3.700 peak 1932 spectrum 1 weight 0.10000E+01 volume 0.41561E-02 ppm1 3.013 ppm2 8.029 CV 1
ASSI { 1935}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 5 and name HG2%)
2.300 2.300 3.700 peak 1935 spectrum 1 weight 0.10000E+01 volume 0.36803E-02 ppm1 2.387 ppm2 0.884 CV 1
OR { 1935}
(( segid " " and resid 10 and name HB3 ))
( segid " " and resid 5 and name HG2%)
ASSI { 1936}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 48 and name HD% )
2.500 2.500 3.500 peak 1936 spectrum 1 weight 0.10000E+01 volume 0.27287E-02 ppm1 4.651 ppm2 6.230 CV 1
ASSI { 1937}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 48 and name HD% )
2.500 0.800 0.800 peak 1937 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 4.712 ppm2 6.229 CV 1
ASSI { 1938}
(( segid " " and resid 8 and name HA1 ))
(( segid " " and resid 26 and name HZ3 ))
2.500 2.500 3.500 peak 1938 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 4.556 ppm2 6.914 CV 1
ASSI { 1939}
(( segid " " and resid 54 and name HA ))
( segid " " and resid 49 and name HD% )
2.500 0.800 0.800 peak 1939 spectrum 1 weight 0.10000E+01 volume 0.26996E-02 ppm1 5.051 ppm2 6.902 CV 1
ASSI { 1941}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 48 and name HD% )
2.300 2.300 3.700 peak 1941 spectrum 1 weight 0.10000E+01 volume 0.41173E-02 ppm1 4.943 ppm2 6.229 CV 1
ASSI { 1942}
(( segid " " and resid 20 and name HG3 ))
( segid " " and resid 25 and name HD% )
2.400 0.700 0.700 peak 1942 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 1.016 ppm2 7.165 CV 1
ASSI { 1944}
(( segid " " and resid 4 and name HB2 ))
( segid " " and resid 25 and name HD% )
2.300 2.300 3.700 peak 1944 spectrum 1 weight 0.10000E+01 volume 0.43795E-02 ppm1 1.224 ppm2 7.162 CV 1
ASSI { 1946}
(( segid " " and resid 4 and name HG ))
( segid " " and resid 25 and name HD% )
2.200 2.200 3.800 peak 1946 spectrum 1 weight 0.10000E+01 volume 0.55642E-02 ppm1 1.090 ppm2 6.778 CV 1
ASSI { 1951}
(( segid " " and resid 106 and name HB2 ))
( segid " " and resid 105 and name HD% )
2.400 2.400 3.600 peak 1951 spectrum 1 weight 0.10000E+01 volume 0.32045E-02 ppm1 2.634 ppm2 7.198 CV 1
ASSI { 1952}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 105 and name HD% )
2.400 0.700 0.700 peak 1952 spectrum 1 weight 0.10000E+01 volume 0.33016E-02 ppm1 2.828 ppm2 7.197 CV 1
OR { 1952}
(( segid " " and resid 16 and name HD3 ))
( segid " " and resid 105 and name HD% )
ASSI { 1953}
( segid " " and resid 18 and name HD% )
(( segid " " and resid 18 and name HN ))
2.400 0.700 0.700 peak 1953 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 6.929 ppm2 8.697 CV 1
ASSI { 1954}
( segid " " and resid 49 and name HD% )
(( segid " " and resid 49 and name HN ))
2.300 0.600 0.600 peak 1954 spectrum 1 weight 0.10000E+01 volume 0.44086E-02 ppm1 6.917 ppm2 8.831 CV 1
ASSI { 1958}
(( segid " " and resid 50 and name HE2 ))
( segid " " and resid 60 and name HE% )
2.300 0.700 0.700 peak 1958 spectrum 1 weight 0.10000E+01 volume 0.36221E-02 ppm1 2.922 ppm2 6.573 CV 1
OR { 1958}
(( segid " " and resid 50 and name HE3 ))
( segid " " and resid 60 and name HE% )
ASSI { 1960}
(( segid " " and resid 54 and name HE3 ))
(( segid " " and resid 26 and name HH2 ))
2.400 2.400 3.600 peak 1960 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 2.965 ppm2 7.102 CV 1
ASSI { 1961}
(( segid " " and resid 57 and name HG3 ))
( segid " " and resid 60 and name HD% )
2.300 2.300 3.700 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.37289E-02 ppm1 1.426 ppm2 6.423 CV 1
ASSI { 1963}
(( segid " " and resid 57 and name HG3 ))
( segid " " and resid 48 and name HD% )
2.400 2.400 3.600 peak 1963 spectrum 1 weight 0.10000E+01 volume 0.34667E-02 ppm1 1.428 ppm2 6.484 CV 1
ASSI { 1968}
(( segid " " and resid 57 and name HB3 ))
( segid " " and resid 60 and name HD% )
2.300 2.300 3.700 peak 1968 spectrum 1 weight 0.10000E+01 volume 0.36415E-02 ppm1 1.990 ppm2 6.576 CV 1
ASSI { 1971}
(( segid " " and resid 50 and name HB2 ))
( segid " " and resid 60 and name HD% )
2.400 2.400 3.600 peak 1971 spectrum 1 weight 0.10000E+01 volume 0.30491E-02 ppm1 1.878 ppm2 6.576 CV 1
ASSI { 1972}
(( segid " " and resid 48 and name HB3 ))
( segid " " and resid 48 and name HD% )
2.500 0.800 0.800 peak 1972 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 1.993 ppm2 6.229 CV 1
ASSI { 1975}
(( segid " " and resid 54 and name HG2 ))
(( segid " " and resid 55 and name HN ))
2.400 2.400 3.600 peak 1975 spectrum 1 weight 0.10000E+01 volume 0.35152E-02 ppm1 1.890 ppm2 9.350 CV 1
ASSI { 1977}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 55 and name HN ))
2.400 2.400 3.600 peak 1977 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 0.630 ppm2 9.344 CV 1
OR { 1977}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 55 and name HN ))
ASSI { 1978}
( segid " " and resid 100 and name HD2%)
(( segid " " and resid 101 and name HN ))
2.500 0.800 0.800 peak 1978 spectrum 1 weight 0.10000E+01 volume 0.27772E-02 ppm1 0.884 ppm2 8.011 CV 1
ASSI { 1984}
(( segid " " and resid 16 and name HD2 ))
( segid " " and resid 105 and name HE% )
2.400 2.400 3.600 peak 1984 spectrum 1 weight 0.10000E+01 volume 0.35541E-02 ppm1 2.830 ppm2 7.341 CV 1
OR { 1984}
(( segid " " and resid 16 and name HD3 ))
( segid " " and resid 105 and name HE% )
ASSI { 1985}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 94 and name HN ))
2.300 2.300 3.700 peak 1985 spectrum 1 weight 0.10000E+01 volume 0.39328E-02 ppm1 4.261 ppm2 7.571 CV 1
ASSI { 1986}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 94 and name HN ))
2.300 2.300 3.700 peak 1986 spectrum 1 weight 0.10000E+01 volume 0.37192E-02 ppm1 4.690 ppm2 7.568 CV 1
ASSI { 1989}
(( segid " " and resid 87 and name HA1 ))
( segid " " and resid 89 and name HE% )
2.300 0.700 0.700 peak 1989 spectrum 1 weight 0.10000E+01 volume 0.37677E-02 ppm1 3.958 ppm2 7.259 CV 1
OR { 1989}
(( segid " " and resid 87 and name HA2 ))
( segid " " and resid 89 and name HE% )
ASSI { 1990}
(( segid " " and resid 87 and name HA1 ))
( segid " " and resid 89 and name HD% )
2.300 2.300 3.700 peak 1990 spectrum 1 weight 0.10000E+01 volume 0.44960E-02 ppm1 3.971 ppm2 7.283 CV 1
OR { 1990}
(( segid " " and resid 87 and name HA2 ))
( segid " " and resid 89 and name HD% )
ASSI { 1994}
(( segid " " and resid 17 and name HB3 ))
(( segid " " and resid 99 and name HE ))
2.300 2.300 3.700 peak 1994 spectrum 1 weight 0.10000E+01 volume 0.39619E-02 ppm1 2.769 ppm2 7.363 CV 1
ASSI { 1996}
(( segid " " and resid 48 and name HB2 ))
(( segid " " and resid 48 and name HN ))
2.300 2.300 3.700 peak 1996 spectrum 1 weight 0.10000E+01 volume 0.37289E-02 ppm1 2.357 ppm2 7.438 CV 1
ASSI { 1998}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 48 and name HD% )
2.400 0.700 0.700 peak 1998 spectrum 1 weight 0.10000E+01 volume 0.30006E-02 ppm1 1.941 ppm2 6.482 CV 1
ASSI { 2000}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 32 and name HB3 ))
2.500 2.500 3.500 peak 2000 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 4.203 ppm2 3.405 CV 1
ASSI { 2002}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 24 and name HN ))
2.300 2.300 3.700 peak 2002 spectrum 1 weight 0.10000E+01 volume 0.36997E-02 ppm1 3.555 ppm2 7.951 CV 1
ASSI { 2004}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 40 and name HN ))
2.400 2.400 3.600 peak 2004 spectrum 1 weight 0.10000E+01 volume 0.29423E-02 ppm1 5.350 ppm2 8.233 CV 1
ASSI { 2005}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HN ))
2.300 0.700 0.700 peak 2005 spectrum 1 weight 0.10000E+01 volume 0.36803E-02 ppm1 1.142 ppm2 8.234 CV 1
ASSI { 2006}
( segid " " and resid 98 and name HG2%)
(( segid " " and resid 97 and name HN ))
2.400 2.400 3.600 peak 2006 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 1.220 ppm2 8.241 CV 1
ASSI { 2007}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 35 and name HD2%)
2.400 0.700 0.700 peak 2007 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 2.553 ppm2 0.972 CV 1
ASSI { 2009}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 63 and name HD1%)
2.400 2.400 3.600 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 2.542 ppm2 0.828 CV 1
OR { 2009}
(( segid " " and resid 59 and name HB3 ))
( segid " " and resid 63 and name HD2%)
ASSI { 2012}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 35 and name HD2%)
2.400 0.700 0.700 peak 2012 spectrum 1 weight 0.10000E+01 volume 0.30588E-02 ppm1 3.107 ppm2 0.861 CV 1
ASSI { 2013}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 63 and name HD1%)
2.200 2.200 3.800 peak 2013 spectrum 1 weight 0.10000E+01 volume 0.59623E-02 ppm1 3.104 ppm2 0.776 CV 1
OR { 2013}
(( segid " " and resid 59 and name HB2 ))
( segid " " and resid 63 and name HD2%)
ASSI { 2015}
(( segid " " and resid 95 and name HD3 ))
(( segid " " and resid 95 and name HH11))
2.300 2.300 3.700 peak 2015 spectrum 1 weight 0.10000E+01 volume 0.39037E-02 ppm1 3.015 ppm2 6.822 CV 1
ASSI { 2022}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 93 and name HN ))
2.200 2.200 3.800 peak 2022 spectrum 1 weight 0.10000E+01 volume 0.49330E-02 ppm1 2.820 ppm2 8.489 CV 1
ASSI { 2023}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 101 and name HN ))
2.500 0.800 0.800 peak 2023 spectrum 1 weight 0.10000E+01 volume 0.23305E-02 ppm1 4.588 ppm2 8.013 CV 1
ASSI { 2024}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 107 and name HN ))
2.400 2.400 3.600 peak 2024 spectrum 1 weight 0.10000E+01 volume 0.32725E-02 ppm1 4.359 ppm2 8.026 CV 1
ASSI { 2025}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 76 and name HN ))
2.600 0.800 0.800 peak 2025 spectrum 1 weight 0.10000E+01 volume 0.21072E-02 ppm1 4.643 ppm2 8.032 CV 1
ASSI { 2027}
(( segid " " and resid 50 and name HE2 ))
( segid " " and resid 60 and name HD% )
2.400 0.700 0.700 peak 2027 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 2.931 ppm2 6.420 CV 1
OR { 2027}
(( segid " " and resid 50 and name HE3 ))
( segid " " and resid 60 and name HD% )
ASSI { 2032}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 49 and name HA ))
2.300 2.300 3.700 peak 2032 spectrum 1 weight 0.10000E+01 volume 0.43795E-02 ppm1 0.623 ppm2 5.745 CV 1
OR { 2032}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 49 and name HA ))
ASSI { 2037}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 13 and name HD1%)
2.200 2.200 3.800 peak 2037 spectrum 1 weight 0.10000E+01 volume 0.54379E-02 ppm1 5.125 ppm2 0.188 CV 1
ASSI { 2038}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 13 and name HD1%)
2.300 2.300 3.700 peak 2038 spectrum 1 weight 0.10000E+01 volume 0.44863E-02 ppm1 5.802 ppm2 0.180 CV 1
ASSI { 2039}
(( segid " " and resid 26 and name HA ))
( segid " " and resid 13 and name HD1%)
6.000 4.500 0.000 peak 2039 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 5.872 ppm2 0.178 CV 1
ASSI { 2040}
(( segid " " and resid 54 and name HA ))
( segid " " and resid 47 and name HD2%)
2.500 2.500 3.500 peak 2040 spectrum 1 weight 0.10000E+01 volume 0.26898E-02 ppm1 5.056 ppm2 0.621 CV 1
OR { 2040}
(( segid " " and resid 54 and name HA ))
( segid " " and resid 47 and name HD1%)
ASSI { 2041}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 13 and name HG13))
2.300 2.300 3.700 peak 2041 spectrum 1 weight 0.10000E+01 volume 0.46514E-02 ppm1 2.295 ppm2 -0.584 CV 1
ASSI { 2042}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 47 and name HD2%)
2.400 0.700 0.700 peak 2042 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 2.922 ppm2 0.617 CV 1
OR { 2042}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 47 and name HD1%)
ASSI { 2043}
(( segid " " and resid 49 and name HB2 ))
( segid " " and resid 22 and name HD1%)
2.300 2.300 3.700 peak 2043 spectrum 1 weight 0.10000E+01 volume 0.40493E-02 ppm1 2.344 ppm2 0.596 CV 1
ASSI { 2044}
(( segid " " and resid 49 and name HB3 ))
( segid " " and resid 22 and name HD1%)
2.300 2.300 3.700 peak 2044 spectrum 1 weight 0.10000E+01 volume 0.39231E-02 ppm1 2.925 ppm2 0.596 CV 1
ASSI { 2048}
(( segid " " and resid 97 and name HA ))
( segid " " and resid 21 and name HB% )
2.500 0.800 0.800 peak 2048 spectrum 1 weight 0.10000E+01 volume 0.26122E-02 ppm1 4.516 ppm2 1.142 CV 1
ASSI { 2050}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 30 and name HB2 ))
2.400 2.400 3.600 peak 2050 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 3.998 ppm2 3.509 CV 1
OR { 2050}
(( segid " " and resid 31 and name HA ))
(( segid " " and resid 32 and name HB2 ))
OR { 2050}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 2054}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 32 and name HB2 ))
2.200 2.200 3.800 peak 2054 spectrum 1 weight 0.10000E+01 volume 0.49524E-02 ppm1 4.203 ppm2 3.499 CV 1
ASSI { 2055}
( segid " " and resid 60 and name HD% )
(( segid " " and resid 61 and name HN ))
2.400 0.700 0.700 peak 2055 spectrum 1 weight 0.10000E+01 volume 0.33696E-02 ppm1 6.430 ppm2 8.232 CV 1
ASSI { 2058}
(( segid " " and resid 37 and name HA1 ))
(( segid " " and resid 37 and name HN ))
2.500 0.800 0.800 peak 2058 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 4.232 ppm2 8.032 CV 1
ASSI { 2059}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 94 and name HA ))
2.400 2.400 3.600 peak 2059 spectrum 1 weight 0.10000E+01 volume 0.29520E-02 ppm1 4.702 ppm2 4.038 CV 1
ASSI { 2063}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 39 and name HE ))
2.400 2.400 3.600 peak 2063 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 4.519 ppm2 7.351 CV 1
ASSI { 2065}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 23 and name HN ))
2.300 0.700 0.700 peak 2065 spectrum 1 weight 0.10000E+01 volume 0.42338E-02 ppm1 2.079 ppm2 8.680 CV 1
ASSI { 2066}
( segid " " and resid 103 and name HG2%)
(( segid " " and resid 104 and name HN ))
2.400 0.700 0.700 peak 2066 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 1.249 ppm2 8.115 CV 1
ASSI { 2067}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 99 and name HD2 ))
2.300 2.300 3.700 peak 2067 spectrum 1 weight 0.10000E+01 volume 0.36318E-02 ppm1 4.432 ppm2 2.932 CV 1
OR { 2067}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 99 and name HD3 ))
ASSI { 2071}
(( segid " " and resid 90 and name HA2 ))
(( segid " " and resid 91 and name HN ))
2.500 0.800 0.800 peak 2071 spectrum 1 weight 0.10000E+01 volume 0.26996E-02 ppm1 4.065 ppm2 8.327 CV 1
OR { 2071}
(( segid " " and resid 90 and name HA1 ))
(( segid " " and resid 91 and name HN ))
ASSI { 2073}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 89 and name HZ ))
2.400 2.400 3.600 peak 2073 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 4.273 ppm2 8.516 CV 1
ASSI { 2074}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 86 and name HN ))
2.400 2.400 3.600 peak 2074 spectrum 1 weight 0.10000E+01 volume 0.30783E-02 ppm1 4.382 ppm2 8.467 CV 1
ASSI { 2075}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 62 and name HN ))
2.400 2.400 3.600 peak 2075 spectrum 1 weight 0.10000E+01 volume 0.28841E-02 ppm1 4.676 ppm2 7.822 CV 1
ASSI { 2076}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HN ))
2.400 0.700 0.700 peak 2076 spectrum 1 weight 0.10000E+01 volume 0.33502E-02 ppm1 7.690 ppm2 8.229 CV 1
ASSI { 2077}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
2.400 0.700 0.700 peak 2077 spectrum 1 weight 0.10000E+01 volume 0.29423E-02 ppm1 7.853 ppm2 7.996 CV 1
ASSI { 2078}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 109 and name HN ))
2.400 2.400 3.600 peak 2078 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 8.018 ppm2 8.175 CV 1
OR { 2078}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 74 and name HN ))
OR { 2078}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 78 and name HN ))
ASSI { 2079}
(( segid " " and resid 111 and name HN ))
(( segid " " and resid 112 and name HN ))
2.400 0.700 0.700 peak 2079 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 8.001 ppm2 8.444 CV 1
ASSI { 2083}
(( segid " " and resid 11 and name HG2 ))
( segid " " and resid 5 and name HG2%)
2.400 2.400 3.600 peak 2083 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 2.300 ppm2 0.886 CV 1
OR { 2083}
(( segid " " and resid 11 and name HG3 ))
( segid " " and resid 5 and name HG2%)
OR { 2083}
(( segid " " and resid 81 and name HG2 ))
( segid " " and resid 78 and name HG2%)
OR { 2083}
(( segid " " and resid 81 and name HG3 ))
( segid " " and resid 78 and name HG2%)
OR { 2083}
(( segid " " and resid 81 and name HG2 ))
( segid " " and resid 78 and name HG1%)
OR { 2083}
(( segid " " and resid 114 and name HB2 ))
( segid " " and resid 111 and name HG2%)
ASSI { 2084}
(( segid " " and resid 22 and name HG12))
(( segid " " and resid 22 and name HG13))
2.400 0.700 0.700 peak 2084 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 1.725 ppm2 1.143 CV 1
ASSI { 2085}
( segid " " and resid 98 and name HG2%)
(( segid " " and resid 99 and name HN ))
2.500 0.800 0.800 peak 2085 spectrum 1 weight 0.10000E+01 volume 0.24762E-02 ppm1 1.217 ppm2 8.845 CV 1
ASSI { 2086}
(( segid " " and resid 20 and name HD2 ))
(( segid " " and resid 98 and name HN ))
2.400 2.400 3.600 peak 2086 spectrum 1 weight 0.10000E+01 volume 0.35055E-02 ppm1 1.158 ppm2 8.902 CV 1
ASSI { 2087}
(( segid " " and resid 96 and name HG ))
(( segid " " and resid 98 and name HN ))
2.300 2.300 3.700 peak 2087 spectrum 1 weight 0.10000E+01 volume 0.45252E-02 ppm1 1.331 ppm2 8.893 CV 1
OR { 2087}
(( segid " " and resid 100 and name HG ))
(( segid " " and resid 98 and name HN ))
OR { 2087}
(( segid " " and resid 47 and name HB3 ))
(( segid " " and resid 98 and name HN ))
OR { 2087}
(( segid " " and resid 47 and name HB2 ))
(( segid " " and resid 98 and name HN ))
OR { 2087}
(( segid " " and resid 47 and name HG ))
(( segid " " and resid 98 and name HN ))
ASSI { 2088}
(( segid " " and resid 24 and name HB3 ))
(( segid " " and resid 26 and name HH2 ))
2.400 2.400 3.600 peak 2088 spectrum 1 weight 0.10000E+01 volume 0.33307E-02 ppm1 1.728 ppm2 7.102 CV 1
OR { 2088}
(( segid " " and resid 22 and name HG12))
(( segid " " and resid 26 and name HH2 ))
OR { 2088}
(( segid " " and resid 24 and name HB2 ))
(( segid " " and resid 26 and name HH2 ))
ASSI { 2094}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HG ))
2.400 2.400 3.600 peak 2094 spectrum 1 weight 0.10000E+01 volume 0.35444E-02 ppm1 4.294 ppm2 1.089 CV 1
ASSI { 2095}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 42 and name HB2 ))
2.400 2.400 3.600 peak 2095 spectrum 1 weight 0.10000E+01 volume 0.35055E-02 ppm1 3.643 ppm2 0.991 CV 1
OR { 2095}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 42 and name HB3 ))
ASSI { 2096}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 63 and name HD1%)
2.500 2.500 3.500 peak 2096 spectrum 1 weight 0.10000E+01 volume 0.22529E-02 ppm1 4.664 ppm2 0.833 CV 1
OR { 2096}
(( segid " " and resid 59 and name HA ))
( segid " " and resid 63 and name HD2%)
ASSI { 2097}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 20 and name HD3 ))
2.300 2.300 3.700 peak 2097 spectrum 1 weight 0.10000E+01 volume 0.41076E-02 ppm1 4.665 ppm2 0.888 CV 1
OR { 2097}
(( segid " " and resid 112 and name HA ))
( segid " " and resid 111 and name HG2%)
ASSI { 2098}
(( segid " " and resid 75 and name HA ))
( segid " " and resid 76 and name HG1%)
2.400 2.400 3.600 peak 2098 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 4.640 ppm2 0.913 CV 1
OR { 2098}
(( segid " " and resid 75 and name HA ))
( segid " " and resid 76 and name HG2%)
ASSI { 2099}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 40 and name HD2%)
2.500 2.500 3.500 peak 2099 spectrum 1 weight 0.10000E+01 volume 0.25151E-02 ppm1 4.925 ppm2 0.753 CV 1
OR { 2099}
(( segid " " and resid 56 and name HA ))
( segid " " and resid 40 and name HD1%)
ASSI { 2101}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 19 and name HD2%)
2.600 0.800 0.800 peak 2101 spectrum 1 weight 0.10000E+01 volume 0.21558E-02 ppm1 3.992 ppm2 0.990 CV 1
ASSI { 2102}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 55 and name HD1%)
2.500 0.800 0.800 peak 2102 spectrum 1 weight 0.10000E+01 volume 0.22140E-02 ppm1 4.006 ppm2 0.933 CV 1
ASSI { 2104}
(( segid " " and resid 65 and name HA2 ))
(( segid " " and resid 61 and name HG ))
2.400 2.400 3.600 peak 2104 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 3.184 ppm2 0.715 CV 1
ASSI { 2111}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 28 and name HG3 ))
2.400 0.700 0.700 peak 2111 spectrum 1 weight 0.10000E+01 volume 0.33405E-02 ppm1 4.943 ppm2 2.571 CV 1
OR { 2111}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 2112}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 28 and name HB3 ))
2.400 2.400 3.600 peak 2112 spectrum 1 weight 0.10000E+01 volume 0.35444E-02 ppm1 4.943 ppm2 2.128 CV 1
ASSI { 2114}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG3 ))
2.300 2.300 3.700 peak 2114 spectrum 1 weight 0.10000E+01 volume 0.38551E-02 ppm1 5.125 ppm2 2.573 CV 1
OR { 2114}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HG2 ))
ASSI { 2115}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HB2 ))
2.300 2.300 3.700 peak 2115 spectrum 1 weight 0.10000E+01 volume 0.37871E-02 ppm1 5.133 ppm2 2.215 CV 1
ASSI { 2119}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 89 and name HD% )
2.400 0.700 0.700 peak 2119 spectrum 1 weight 0.10000E+01 volume 0.33890E-02 ppm1 4.719 ppm2 7.285 CV 1
ASSI { 2121}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HN ))
2.500 0.800 0.800 peak 2121 spectrum 1 weight 0.10000E+01 volume 0.24568E-02 ppm1 7.627 ppm2 7.841 CV 1
ASSI { 2122}
( segid " " and resid 17 and name HD% )
(( segid " " and resid 17 and name HN ))
2.500 2.500 3.500 peak 2122 spectrum 1 weight 0.10000E+01 volume 0.27190E-02 ppm1 7.046 ppm2 7.874 CV 1
ASSI { 2140}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HG2 ))
2.500 0.800 0.800 peak 2140 spectrum 1 weight 0.10000E+01 volume 0.26996E-02 ppm1 4.183 ppm2 1.818 CV 1
OR { 2140}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HG3 ))
ASSI { 2141}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB2 ))
2.400 0.700 0.700 peak 2141 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 4.183 ppm2 1.702 CV 1
ASSI { 2143}
(( segid " " and resid 14 and name HA1 ))
(( segid " " and resid 102 and name HD22))
2.300 2.300 3.700 peak 2143 spectrum 1 weight 0.10000E+01 volume 0.41950E-02 ppm1 4.428 ppm2 6.596 CV 1
ASSI { 2144}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 102 and name HD22))
2.300 2.300 3.700 peak 2144 spectrum 1 weight 0.10000E+01 volume 0.41756E-02 ppm1 0.487 ppm2 6.603 CV 1
ASSI { 2147}
(( segid " " and resid 40 and name HA ))
( segid " " and resid 40 and name HD2%)
2.400 0.700 0.700 peak 2147 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 4.064 ppm2 0.395 CV 1
ASSI { 2152}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HG ))
2.400 0.700 0.700 peak 2152 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 4.064 ppm2 1.558 CV 1
ASSI { 2153}
(( segid " " and resid 40 and name HG ))
(( segid " " and resid 40 and name HN ))
2.400 0.700 0.700 peak 2153 spectrum 1 weight 0.10000E+01 volume 0.31657E-02 ppm1 1.570 ppm2 8.234 CV 1
ASSI { 2156}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 31 and name HD2%)
2.300 2.300 3.700 peak 2156 spectrum 1 weight 0.10000E+01 volume 0.45834E-02 ppm1 1.574 ppm2 -1.002 CV 1
ASSI { 2157}
(( segid " " and resid 97 and name HB ))
( segid " " and resid 31 and name HD1%)
2.400 2.400 3.600 peak 2157 spectrum 1 weight 0.10000E+01 volume 0.33890E-02 ppm1 1.461 ppm2 -1.002 CV 1
OR { 2157}
(( segid " " and resid 97 and name HB ))
( segid " " and resid 31 and name HD2%)
ASSI { 2158}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 31 and name HD1%)
2.200 2.200 3.800 peak 2158 spectrum 1 weight 0.10000E+01 volume 0.54768E-02 ppm1 1.735 ppm2 -1.004 CV 1
OR { 2158}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 31 and name HD2%)
ASSI { 2159}
(( segid " " and resid 39 and name HD2 ))
( segid " " and resid 40 and name HD1%)
2.300 2.300 3.700 peak 2159 spectrum 1 weight 0.10000E+01 volume 0.39328E-02 ppm1 3.211 ppm2 0.758 CV 1
OR { 2159}
(( segid " " and resid 36 and name HB3 ))
( segid " " and resid 40 and name HD1%)
OR { 2159}
(( segid " " and resid 58 and name HD3 ))
( segid " " and resid 40 and name HD1%)
ASSI { 2164}
(( segid " " and resid 114 and name HN ))
(( segid " " and resid 107 and name HN ))
2.400 2.400 3.600 peak 2164 spectrum 1 weight 0.10000E+01 volume 0.32531E-02 ppm1 7.871 ppm2 8.033 CV 1
ASSI { 2169}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 18 and name HZ ))
2.300 2.300 3.700 peak 2169 spectrum 1 weight 0.10000E+01 volume 0.39522E-02 ppm1 1.228 ppm2 7.432 CV 1
OR { 2169}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 18 and name HZ ))
ASSI { 2172}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 30 and name HB2 ))
2.300 0.700 0.700 peak 2172 spectrum 1 weight 0.10000E+01 volume 0.40785E-02 ppm1 3.752 ppm2 3.514 CV 1
ASSI { 2173}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HG3 ))
2.400 0.700 0.700 peak 2173 spectrum 1 weight 0.10000E+01 volume 0.30783E-02 ppm1 4.454 ppm2 1.330 CV 1
ASSI { 2174}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 94 and name HB3 ))
2.500 2.500 3.500 peak 2174 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 4.682 ppm2 1.800 CV 1
OR { 2174}
(( segid " " and resid 95 and name HA ))
(( segid " " and resid 94 and name HB2 ))
OR { 2174}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 94 and name HB2 ))
OR { 2174}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 94 and name HB3 ))
ASSI { 2176}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 17 and name HN ))
2.400 2.400 3.600 peak 2176 spectrum 1 weight 0.10000E+01 volume 0.35250E-02 ppm1 4.727 ppm2 7.873 CV 1
ASSI { 2178}
(( segid " " and resid 56 and name HB2 ))
( segid " " and resid 40 and name HD2%)
2.500 2.500 3.500 peak 2178 spectrum 1 weight 0.10000E+01 volume 0.24277E-02 ppm1 3.427 ppm2 0.751 CV 1
OR { 2178}
(( segid " " and resid 56 and name HB2 ))
( segid " " and resid 40 and name HD1%)
ASSI { 2179}
(( segid " " and resid 65 and name HA1 ))
(( segid " " and resid 65 and name HA2 ))
2.600 0.900 0.900 peak 2179 spectrum 1 weight 0.10000E+01 volume 0.19130E-02 ppm1 3.461 ppm2 3.167 CV 1
ASSI { 2180}
(( segid " " and resid 95 and name HD2 ))
(( segid " " and resid 95 and name HD3 ))
2.600 0.800 0.800 peak 2180 spectrum 1 weight 0.10000E+01 volume 0.19907E-02 ppm1 3.449 ppm2 3.009 CV 1
ASSI { 2185}
(( segid " " and resid 95 and name HD3 ))
(( segid " " and resid 96 and name HN ))
2.300 2.300 3.700 peak 2185 spectrum 1 weight 0.10000E+01 volume 0.40493E-02 ppm1 3.020 ppm2 8.347 CV 1
ASSI { 2186}
(( segid " " and resid 99 and name HB3 ))
(( segid " " and resid 98 and name HN ))
2.400 2.400 3.600 peak 2186 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 1.834 ppm2 8.893 CV 1
OR { 2186}
(( segid " " and resid 99 and name HB2 ))
(( segid " " and resid 98 and name HN ))
ASSI { 2191}
(( segid " " and resid 100 and name HG ))
( segid " " and resid 20 and name HZ% )
2.300 2.300 3.700 peak 2191 spectrum 1 weight 0.10000E+01 volume 0.36803E-02 ppm1 1.326 ppm2 6.913 CV 1
ASSI { 2192}
(( segid " " and resid 54 and name HB3 ))
( segid " " and resid 49 and name HD% )
2.400 2.400 3.600 peak 2192 spectrum 1 weight 0.10000E+01 volume 0.34473E-02 ppm1 1.352 ppm2 6.901 CV 1
ASSI { 2195}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 20 and name HN ))
2.300 2.300 3.700 peak 2195 spectrum 1 weight 0.10000E+01 volume 0.40493E-02 ppm1 4.503 ppm2 9.302 CV 1
ASSI { 2198}
(( segid " " and resid 57 and name HD2 ))
( segid " " and resid 60 and name HE% )
2.400 2.400 3.600 peak 2198 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 3.174 ppm2 6.575 CV 1
OR { 2198}
(( segid " " and resid 57 and name HD3 ))
( segid " " and resid 60 and name HE% )
ASSI { 2199}
(( segid " " and resid 57 and name HD3 ))
( segid " " and resid 48 and name HE% )
2.400 2.400 3.600 peak 2199 spectrum 1 weight 0.10000E+01 volume 0.31462E-02 ppm1 3.167 ppm2 6.480 CV 1
OR { 2199}
(( segid " " and resid 57 and name HD2 ))
( segid " " and resid 48 and name HE% )
ASSI { 2200}
(( segid " " and resid 57 and name HD2 ))
( segid " " and resid 60 and name HD% )
2.400 0.700 0.700 peak 2200 spectrum 1 weight 0.10000E+01 volume 0.35638E-02 ppm1 3.169 ppm2 6.426 CV 1
OR { 2200}
(( segid " " and resid 57 and name HD3 ))
( segid " " and resid 60 and name HD% )
ASSI { 2201}
(( segid " " and resid 57 and name HD3 ))
( segid " " and resid 48 and name HD% )
2.300 2.300 3.700 peak 2201 spectrum 1 weight 0.10000E+01 volume 0.37677E-02 ppm1 3.169 ppm2 6.229 CV 1
OR { 2201}
(( segid " " and resid 57 and name HD2 ))
( segid " " and resid 48 and name HD% )
ASSI { 2202}
(( segid " " and resid 106 and name HA ))
( segid " " and resid 105 and name HD% )
2.400 2.400 3.600 peak 2202 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 4.511 ppm2 7.197 CV 1
ASSI { 2203}
(( segid " " and resid 106 and name HB3 ))
( segid " " and resid 105 and name HD% )
2.200 2.200 3.800 peak 2203 spectrum 1 weight 0.10000E+01 volume 0.57778E-02 ppm1 2.545 ppm2 7.197 CV 1
ASSI { 2207}
( segid " " and resid 20 and name HZ% )
( segid " " and resid 25 and name HD% )
2.500 0.800 0.800 peak 2207 spectrum 1 weight 0.10000E+01 volume 0.24277E-02 ppm1 6.929 ppm2 7.163 CV 1
ASSI { 2209}
(( segid " " and resid 100 and name HG ))
( segid " " and resid 18 and name HD% )
2.300 2.300 3.700 peak 2209 spectrum 1 weight 0.10000E+01 volume 0.37969E-02 ppm1 1.311 ppm2 6.778 CV 1
ASSI { 2214}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 13 and name HG2%)
2.300 2.300 3.700 peak 2214 spectrum 1 weight 0.10000E+01 volume 0.44475E-02 ppm1 5.123 ppm2 0.482 CV 1
ASSI { 2217}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 26 and name HD1 ))
2.400 2.400 3.600 peak 2217 spectrum 1 weight 0.10000E+01 volume 0.29423E-02 ppm1 5.796 ppm2 6.914 CV 1
ASSI { 2219}
( segid " " and resid 55 and name HD2%)
(( segid " " and resid 53 and name HN ))
2.300 2.300 3.700 peak 2219 spectrum 1 weight 0.10000E+01 volume 0.44960E-02 ppm1 0.946 ppm2 7.616 CV 1
ASSI { 2223}
(( segid " " and resid 65 and name HA1 ))
( segid " " and resid 60 and name HD% )
2.300 2.300 3.700 peak 2223 spectrum 1 weight 0.10000E+01 volume 0.40008E-02 ppm1 3.458 ppm2 6.570 CV 1
ASSI { 2227}
( segid " " and resid 61 and name HD2%)
(( segid " " and resid 57 and name HE ))
2.400 2.400 3.600 peak 2227 spectrum 1 weight 0.10000E+01 volume 0.28938E-02 ppm1 0.822 ppm2 7.441 CV 1
OR { 2227}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 57 and name HE ))
ASSI { 2228}
(( segid " " and resid 99 and name HD2 ))
( segid " " and resid 17 and name HD% )
2.400 2.400 3.600 peak 2228 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 2.954 ppm2 7.037 CV 1
OR { 2228}
(( segid " " and resid 99 and name HD3 ))
( segid " " and resid 17 and name HD% )
ASSI { 2230}
(( segid " " and resid 102 and name HB3 ))
( segid " " and resid 18 and name HD% )
2.500 2.500 3.500 peak 2230 spectrum 1 weight 0.10000E+01 volume 0.26704E-02 ppm1 2.825 ppm2 6.784 CV 1
ASSI { 2233}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 42 and name HN ))
2.300 2.300 3.700 peak 2233 spectrum 1 weight 0.10000E+01 volume 0.38648E-02 ppm1 0.917 ppm2 7.289 CV 1
OR { 2233}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 42 and name HN ))
ASSI { 2234}
( segid " " and resid 84 and name HD1%)
( segid " " and resid 89 and name HD% )
2.300 2.300 3.700 peak 2234 spectrum 1 weight 0.10000E+01 volume 0.39134E-02 ppm1 0.917 ppm2 7.260 CV 1
OR { 2234}
( segid " " and resid 84 and name HD2%)
( segid " " and resid 89 and name HD% )
ASSI { 2235}
(( segid " " and resid 11 and name HG2 ))
(( segid " " and resid 27 and name HE1 ))
2.500 0.800 0.800 peak 2235 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 2.304 ppm2 7.228 CV 1
ASSI { 2236}
(( segid " " and resid 11 and name HB3 ))
(( segid " " and resid 27 and name HE1 ))
2.500 2.500 3.500 peak 2236 spectrum 1 weight 0.10000E+01 volume 0.26704E-02 ppm1 2.454 ppm2 7.228 CV 1
ASSI { 2237}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 27 and name HE1 ))
2.500 2.500 3.500 peak 2237 spectrum 1 weight 0.10000E+01 volume 0.27869E-02 ppm1 2.516 ppm2 7.228 CV 1
ASSI { 2238}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 27 and name HE1 ))
2.300 2.300 3.700 peak 2238 spectrum 1 weight 0.10000E+01 volume 0.37580E-02 ppm1 0.882 ppm2 7.231 CV 1
ASSI { 2239}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 62 and name HE ))
2.300 2.300 3.700 peak 2239 spectrum 1 weight 0.10000E+01 volume 0.42921E-02 ppm1 0.840 ppm2 7.234 CV 1
OR { 2239}
( segid " " and resid 61 and name HD2%)
(( segid " " and resid 62 and name HE ))
ASSI { 2242}
( segid " " and resid 61 and name HD2%)
( segid " " and resid 89 and name HD% )
2.300 2.300 3.700 peak 2242 spectrum 1 weight 0.10000E+01 volume 0.38163E-02 ppm1 0.835 ppm2 7.288 CV 1
OR { 2242}
( segid " " and resid 61 and name HD1%)
( segid " " and resid 89 and name HD% )
ASSI { 2244}
(( segid " " and resid 56 and name HB2 ))
(( segid " " and resid 58 and name HN ))
2.300 2.300 3.700 peak 2244 spectrum 1 weight 0.10000E+01 volume 0.38842E-02 ppm1 3.416 ppm2 8.183 CV 1
ASSI { 2245}
(( segid " " and resid 83 and name HA ))
( segid " " and resid 89 and name HD% )
2.300 2.300 3.700 peak 2245 spectrum 1 weight 0.10000E+01 volume 0.45737E-02 ppm1 4.303 ppm2 7.255 CV 1
ASSI { 2246}
(( segid " " and resid 91 and name HB3 ))
(( segid " " and resid 90 and name HN ))
2.400 2.400 3.600 peak 2246 spectrum 1 weight 0.10000E+01 volume 0.35929E-02 ppm1 2.757 ppm2 8.511 CV 1
ASSI { 2249}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HN ))
2.500 0.800 0.800 peak 2249 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 1.848 ppm2 6.906 CV 1
ASSI { 2250}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 31 and name HN ))
6.000 4.500 0.000 peak 2250 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.600 ppm2 6.908 CV 1
ASSI { 2251}
(( segid " " and resid 100 and name HB2 ))
( segid " " and resid 20 and name HZ% )
2.300 2.300 3.700 peak 2251 spectrum 1 weight 0.10000E+01 volume 0.36803E-02 ppm1 0.992 ppm2 6.929 CV 1
ASSI { 2253}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 59 and name HN ))
2.600 2.600 3.400 peak 2253 spectrum 1 weight 0.10000E+01 volume 0.21363E-02 ppm1 1.968 ppm2 8.857 CV 1
ASSI { 2254}
(( segid " " and resid 27 and name HE1 ))
(( segid " " and resid 10 and name HN ))
2.300 2.300 3.700 peak 2254 spectrum 1 weight 0.10000E+01 volume 0.45446E-02 ppm1 7.227 ppm2 7.843 CV 1
ASSI { 2255}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HN ))
2.400 0.700 0.700 peak 2255 spectrum 1 weight 0.10000E+01 volume 0.30394E-02 ppm1 3.518 ppm2 7.650 CV 1
ASSI { 2256}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 21 and name HN ))
2.400 2.400 3.600 peak 2256 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 5.787 ppm2 9.132 CV 1
ASSI { 2257}
( segid " " and resid 49 and name HD% )
(( segid " " and resid 52 and name HN ))
2.300 2.300 3.700 peak 2257 spectrum 1 weight 0.10000E+01 volume 0.41076E-02 ppm1 6.728 ppm2 7.844 CV 1
ASSI { 2261}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB2 ))
2.600 0.800 0.800 peak 2261 spectrum 1 weight 0.10000E+01 volume 0.21072E-02 ppm1 5.021 ppm2 3.362 CV 1
ASSI { 2262}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HB3 ))
2.600 0.800 0.800 peak 2262 spectrum 1 weight 0.10000E+01 volume 0.21072E-02 ppm1 5.021 ppm2 3.103 CV 1
ASSI { 2264}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 5 and name HA ))
2.400 0.700 0.700 peak 2264 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 4.730 ppm2 4.227 CV 1
ASSI { 2266}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 5 and name HB ))
2.400 2.400 3.600 peak 2266 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 4.741 ppm2 3.641 CV 1
ASSI { 2267}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 5 and name HG2%)
2.400 0.700 0.700 peak 2267 spectrum 1 weight 0.10000E+01 volume 0.33113E-02 ppm1 4.734 ppm2 0.880 CV 1
ASSI { 2270}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 56 and name HB3 ))
2.400 0.700 0.700 peak 2270 spectrum 1 weight 0.10000E+01 volume 0.33307E-02 ppm1 4.921 ppm2 2.791 CV 1
ASSI { 2272}
(( segid " " and resid 50 and name HG2 ))
( segid " " and resid 60 and name HE% )
2.400 2.400 3.600 peak 2272 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 1.647 ppm2 6.575 CV 1
ASSI { 2273}
(( segid " " and resid 57 and name HG2 ))
( segid " " and resid 60 and name HD% )
2.500 2.500 3.500 peak 2273 spectrum 1 weight 0.10000E+01 volume 0.26607E-02 ppm1 1.640 ppm2 6.423 CV 1
OR { 2273}
(( segid " " and resid 50 and name HG2 ))
( segid " " and resid 60 and name HD% )
ASSI { 2274}
(( segid " " and resid 50 and name HB3 ))
( segid " " and resid 60 and name HD% )
2.400 2.400 3.600 peak 2274 spectrum 1 weight 0.10000E+01 volume 0.34473E-02 ppm1 1.670 ppm2 6.576 CV 1
ASSI { 2276}
(( segid " " and resid 101 and name HG3 ))
( segid " " and resid 17 and name HE% )
2.400 0.700 0.700 peak 2276 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 1.989 ppm2 6.692 CV 1
ASSI { 2277}
(( segid " " and resid 101 and name HG3 ))
( segid " " and resid 17 and name HD% )
2.300 2.300 3.700 peak 2277 spectrum 1 weight 0.10000E+01 volume 0.37386E-02 ppm1 1.990 ppm2 7.035 CV 1
ASSI { 2282}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 57 and name HD3 ))
2.400 2.400 3.600 peak 2282 spectrum 1 weight 0.10000E+01 volume 0.31074E-02 ppm1 4.675 ppm2 3.181 CV 1
OR { 2282}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 57 and name HD2 ))
ASSI { 2283}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HG2 ))
2.500 2.500 3.500 peak 2283 spectrum 1 weight 0.10000E+01 volume 0.25927E-02 ppm1 4.547 ppm2 1.818 CV 1
OR { 2283}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HG3 ))
ASSI { 2284}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 80 and name HN ))
6.000 4.500 0.000 peak 2284 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.107 ppm2 8.409 CV 1
ASSI { 2285}
(( segid " " and resid 56 and name HB2 ))
( segid " " and resid 40 and name HD2%)
2.400 2.400 3.600 peak 2285 spectrum 1 weight 0.10000E+01 volume 0.34376E-02 ppm1 3.428 ppm2 0.393 CV 1
OR { 2285}
(( segid " " and resid 56 and name HB2 ))
( segid " " and resid 40 and name HD1%)
ASSI { 2287}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HB2 ))
2.400 0.700 0.700 peak 2287 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 4.589 ppm2 0.996 CV 1
ASSI { 2290}
(( segid " " and resid 18 and name HB2 ))
( segid " " and resid 18 and name HD% )
2.300 0.700 0.700 peak 2290 spectrum 1 weight 0.10000E+01 volume 0.42630E-02 ppm1 3.455 ppm2 6.781 CV 1
ASSI { 2293}
(( segid " " and resid 102 and name HB2 ))
( segid " " and resid 18 and name HD% )
2.200 2.200 3.800 peak 2293 spectrum 1 weight 0.10000E+01 volume 0.50689E-02 ppm1 3.221 ppm2 6.908 CV 1
ASSI { 2294}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
2.500 0.800 0.800 peak 2294 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 4.514 ppm2 3.508 CV 1
ASSI { 2295}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HD3 ))
2.500 2.500 3.500 peak 2295 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 4.469 ppm2 3.218 CV 1
OR { 2295}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HD2 ))
ASSI { 2299}
(( segid " " and resid 15 and name HB3 ))
(( segid " " and resid 15 and name HB2 ))
2.600 0.800 0.800 peak 2299 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 3.400 ppm2 2.580 CV 1
ASSI { 2300}
(( segid " " and resid 54 and name HE2 ))
(( segid " " and resid 54 and name HE3 ))
2.600 0.800 0.800 peak 2300 spectrum 1 weight 0.10000E+01 volume 0.20878E-02 ppm1 3.312 ppm2 2.965 CV 1
ASSI { 2301}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 4 and name HG ))
2.400 0.700 0.700 peak 2301 spectrum 1 weight 0.10000E+01 volume 0.30783E-02 ppm1 4.210 ppm2 1.089 CV 1
ASSI { 2302}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HG ))
2.500 0.800 0.800 peak 2302 spectrum 1 weight 0.10000E+01 volume 0.22237E-02 ppm1 4.668 ppm2 1.576 CV 1
ASSI { 2306}
(( segid " " and resid 60 and name HB2 ))
( segid " " and resid 55 and name HD2%)
2.400 0.700 0.700 peak 2306 spectrum 1 weight 0.10000E+01 volume 0.28841E-02 ppm1 2.702 ppm2 0.939 CV 1
ASSI { 2307}
(( segid " " and resid 110 and name HA1 ))
(( segid " " and resid 111 and name HB ))
2.400 2.400 3.600 peak 2307 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 3.970 ppm2 1.847 CV 1
OR { 2307}
(( segid " " and resid 110 and name HA2 ))
(( segid " " and resid 111 and name HB ))
OR { 2307}
(( segid " " and resid 87 and name HA2 ))
(( segid " " and resid 88 and name HB3 ))
OR { 2307}
(( segid " " and resid 87 and name HA1 ))
(( segid " " and resid 88 and name HB3 ))
ASSI { 2309}
(( segid " " and resid 82 and name HD3 ))
(( segid " " and resid 81 and name HG2 ))
2.400 2.400 3.600 peak 2309 spectrum 1 weight 0.10000E+01 volume 0.32919E-02 ppm1 3.741 ppm2 2.295 CV 1
OR { 2309}
(( segid " " and resid 82 and name HD3 ))
(( segid " " and resid 81 and name HG3 ))
OR { 2309}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 6 and name HB3 ))
ASSI { 2310}
(( segid " " and resid 82 and name HD2 ))
(( segid " " and resid 81 and name HG3 ))
2.400 2.400 3.600 peak 2310 spectrum 1 weight 0.10000E+01 volume 0.32628E-02 ppm1 3.815 ppm2 2.293 CV 1
ASSI { 2311}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 39 and name HD3 ))
2.600 0.800 0.800 peak 2311 spectrum 1 weight 0.10000E+01 volume 0.20587E-02 ppm1 3.187 ppm2 2.710 CV 1
ASSI { 2312}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HB3 ))
2.500 0.800 0.800 peak 2312 spectrum 1 weight 0.10000E+01 volume 0.24179E-02 ppm1 1.837 ppm2 0.602 CV 1
ASSI { 2314}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 31 and name HD2%)
2.400 2.400 3.600 peak 2314 spectrum 1 weight 0.10000E+01 volume 0.33210E-02 ppm1 1.556 ppm2 0.223 CV 1
ASSI { 2315}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 47 and name HD1%)
2.500 2.500 3.500 peak 2315 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 1.557 ppm2 0.619 CV 1
OR { 2315}
(( segid " " and resid 40 and name HG ))
( segid " " and resid 47 and name HD2%)
ASSI { 2316}
(( segid " " and resid 48 and name HB3 ))
( segid " " and resid 47 and name HD2%)
2.400 2.400 3.600 peak 2316 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 1.977 ppm2 0.623 CV 1
OR { 2316}
(( segid " " and resid 48 and name HB3 ))
( segid " " and resid 47 and name HD1%)
ASSI { 2318}
(( segid " " and resid 95 and name HG2 ))
( segid " " and resid 22 and name HG2%)
2.300 2.300 3.700 peak 2318 spectrum 1 weight 0.10000E+01 volume 0.46320E-02 ppm1 1.981 ppm2 0.495 CV 1
ASSI { 2319}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 31 and name HD1%)
2.600 0.800 0.800 peak 2319 spectrum 1 weight 0.10000E+01 volume 0.22043E-02 ppm1 0.992 ppm2 0.217 CV 1
OR { 2319}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 31 and name HD2%)
OR { 2319}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 31 and name HD1%)
ASSI { 2320}
(( segid " " and resid 54 and name HD3 ))
( segid " " and resid 40 and name HD2%)
2.500 2.500 3.500 peak 2320 spectrum 1 weight 0.10000E+01 volume 0.27772E-02 ppm1 0.990 ppm2 0.393 CV 1
OR { 2320}
(( segid " " and resid 42 and name HB2 ))
( segid " " and resid 40 and name HD2%)
OR { 2320}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 40 and name HD2%)
OR { 2320}
(( segid " " and resid 42 and name HB3 ))
( segid " " and resid 40 and name HD2%)
ASSI { 2321}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 97 and name HD1%)
2.400 2.400 3.600 peak 2321 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 0.990 ppm2 0.462 CV 1
OR { 2321}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 97 and name HD1%)
ASSI { 2323}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 40 and name HD1%)
2.500 2.500 3.500 peak 2323 spectrum 1 weight 0.10000E+01 volume 0.26413E-02 ppm1 1.337 ppm2 0.397 CV 1
OR { 2323}
(( segid " " and resid 47 and name HG ))
( segid " " and resid 40 and name HD2%)
ASSI { 2324}
(( segid " " and resid 50 and name HE3 ))
( segid " " and resid 51 and name HD1%)
2.500 2.500 3.500 peak 2324 spectrum 1 weight 0.10000E+01 volume 0.27869E-02 ppm1 2.931 ppm2 0.930 CV 1
OR { 2324}
(( segid " " and resid 50 and name HE2 ))
( segid " " and resid 51 and name HD1%)
ASSI { 2326}
(( segid " " and resid 99 and name HD2 ))
(( segid " " and resid 19 and name HG ))
2.400 0.700 0.700 peak 2326 spectrum 1 weight 0.10000E+01 volume 0.34278E-02 ppm1 2.942 ppm2 0.856 CV 1
ASSI { 2327}
(( segid " " and resid 28 and name HB3 ))
( segid " " and resid 19 and name HD2%)
2.500 2.500 3.500 peak 2327 spectrum 1 weight 0.10000E+01 volume 0.23208E-02 ppm1 2.134 ppm2 0.993 CV 1
ASSI { 2329}
(( segid " " and resid 53 and name HB2 ))
( segid " " and resid 55 and name HD1%)
2.500 2.500 3.500 peak 2329 spectrum 1 weight 0.10000E+01 volume 0.25248E-02 ppm1 1.945 ppm2 0.982 CV 1
OR { 2329}
(( segid " " and resid 53 and name HB3 ))
( segid " " and resid 55 and name HD1%)
ASSI { 2330}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 61 and name HD2%)
2.500 2.500 3.500 peak 2330 spectrum 1 weight 0.10000E+01 volume 0.26510E-02 ppm1 1.950 ppm2 0.825 CV 1
OR { 2330}
(( segid " " and resid 57 and name HB2 ))
( segid " " and resid 61 and name HD1%)
OR { 2330}
(( segid " " and resid 58 and name HB2 ))
( segid " " and resid 61 and name HD1%)
OR { 2330}
(( segid " " and resid 58 and name HB2 ))
( segid " " and resid 61 and name HD2%)
ASSI { 2331}
(( segid " " and resid 28 and name HB3 ))
(( segid " " and resid 19 and name HG ))
2.400 2.400 3.600 peak 2331 spectrum 1 weight 0.10000E+01 volume 0.34764E-02 ppm1 2.134 ppm2 0.852 CV 1
ASSI { 2332}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 9 and name HN ))
2.400 2.400 3.600 peak 2332 spectrum 1 weight 0.10000E+01 volume 0.33113E-02 ppm1 4.107 ppm2 7.995 CV 1
ASSI { 2333}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 79 and name HN ))
2.500 0.800 0.800 peak 2333 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 4.132 ppm2 8.234 CV 1
ASSI { 2334}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 5 and name HN ))
2.600 0.800 0.800 peak 2334 spectrum 1 weight 0.10000E+01 volume 0.19810E-02 ppm1 4.212 ppm2 8.148 CV 1
ASSI { 2335}
(( segid " " and resid 80 and name HA2 ))
(( segid " " and resid 81 and name HN ))
2.600 0.800 0.800 peak 2335 spectrum 1 weight 0.10000E+01 volume 0.21752E-02 ppm1 3.974 ppm2 8.167 CV 1
OR { 2335}
(( segid " " and resid 80 and name HA1 ))
(( segid " " and resid 81 and name HN ))
ASSI { 2336}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 19 and name HB3 ))
2.300 2.300 3.700 peak 2336 spectrum 1 weight 0.10000E+01 volume 0.36512E-02 ppm1 4.833 ppm2 1.310 CV 1
ASSI { 2337}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 19 and name HG ))
2.500 0.800 0.800 peak 2337 spectrum 1 weight 0.10000E+01 volume 0.27675E-02 ppm1 4.831 ppm2 0.855 CV 1
ASSI { 2338}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 99 and name HG3 ))
2.500 0.800 0.800 peak 2338 spectrum 1 weight 0.10000E+01 volume 0.25830E-02 ppm1 4.833 ppm2 1.455 CV 1
ASSI { 2341}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 3 and name HB3 ))
2.400 2.400 3.600 peak 2341 spectrum 1 weight 0.10000E+01 volume 0.28161E-02 ppm1 4.460 ppm2 1.446 CV 1
ASSI { 2342}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HG2 ))
2.500 2.500 3.500 peak 2342 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 4.465 ppm2 1.501 CV 1
ASSI { 2343}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HB2 ))
2.500 0.800 0.800 peak 2343 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 4.460 ppm2 1.876 CV 1
ASSI { 2344}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 45 and name HG2 ))
2.400 2.400 3.600 peak 2344 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 4.460 ppm2 1.764 CV 1
OR { 2344}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 45 and name HG3 ))
ASSI { 2345}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HB3 ))
2.500 0.800 0.800 peak 2345 spectrum 1 weight 0.10000E+01 volume 0.26219E-02 ppm1 4.464 ppm2 1.606 CV 1
OR { 2345}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HB2 ))
ASSI { 2346}
(( segid " " and resid 8 and name HA1 ))
(( segid " " and resid 26 and name HH2 ))
2.200 2.200 3.800 peak 2346 spectrum 1 weight 0.10000E+01 volume 0.47097E-02 ppm1 4.542 ppm2 7.103 CV 1
ASSI { 2347}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HG2 ))
2.500 0.800 0.800 peak 2347 spectrum 1 weight 0.10000E+01 volume 0.27967E-02 ppm1 4.110 ppm2 2.282 CV 1
ASSI { 2351}
(( segid " " and resid 31 and name HG ))
( segid " " and resid 40 and name HD1%)
2.500 2.500 3.500 peak 2351 spectrum 1 weight 0.10000E+01 volume 0.22529E-02 ppm1 0.888 ppm2 0.394 CV 1
OR { 2351}
(( segid " " and resid 31 and name HG ))
( segid " " and resid 40 and name HD2%)
ASSI { 2352}
( segid " " and resid 100 and name HD2%)
(( segid " " and resid 100 and name HB3 ))
2.500 0.800 0.800 peak 2352 spectrum 1 weight 0.10000E+01 volume 0.22723E-02 ppm1 0.888 ppm2 0.328 CV 1
ASSI { 2353}
(( segid " " and resid 4 and name HB3 ))
( segid " " and resid 13 and name HD1%)
2.400 0.700 0.700 peak 2353 spectrum 1 weight 0.10000E+01 volume 0.31948E-02 ppm1 0.803 ppm2 0.174 CV 1
ASSI { 2355}
(( segid " " and resid 96 and name HB3 ))
( segid " " and resid 47 and name HD2%)
2.500 2.500 3.500 peak 2355 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 1.459 ppm2 0.618 CV 1
OR { 2355}
(( segid " " and resid 96 and name HB3 ))
( segid " " and resid 47 and name HD1%)
ASSI { 2356}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 4 and name HB3 ))
2.500 0.800 0.800 peak 2356 spectrum 1 weight 0.10000E+01 volume 0.23305E-02 ppm1 1.213 ppm2 0.796 CV 1
ASSI { 2358}
( segid " " and resid 98 and name HG2%)
( segid " " and resid 100 and name HD1%)
2.500 0.800 0.800 peak 2358 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 1.210 ppm2 0.869 CV 1
ASSI { 2360}
( segid " " and resid 19 and name HD1%)
( segid " " and resid 97 and name HG2%)
2.500 0.800 0.800 peak 2360 spectrum 1 weight 0.10000E+01 volume 0.27287E-02 ppm1 0.995 ppm2 0.698 CV 1
ASSI { 2361}
( segid " " and resid 19 and name HD2%)
( segid " " and resid 40 and name HD1%)
2.300 2.300 3.700 peak 2361 spectrum 1 weight 0.10000E+01 volume 0.39716E-02 ppm1 0.995 ppm2 0.746 CV 1
OR { 2361}
(( segid " " and resid 54 and name HD3 ))
( segid " " and resid 40 and name HD1%)
OR { 2361}
(( segid " " and resid 42 and name HB2 ))
( segid " " and resid 40 and name HD1%)
ASSI { 2362}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 47 and name HD1%)
2.400 2.400 3.600 peak 2362 spectrum 1 weight 0.10000E+01 volume 0.31462E-02 ppm1 1.846 ppm2 0.459 CV 1
OR { 2362}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 47 and name HD2%)
ASSI { 2363}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 40 and name HD1%)
2.300 2.300 3.700 peak 2363 spectrum 1 weight 0.10000E+01 volume 0.37095E-02 ppm1 1.848 ppm2 0.394 CV 1
ASSI { 2367}
( segid " " and resid 47 and name HD2%)
(( segid " " and resid 47 and name HN ))
2.300 2.300 3.700 peak 2367 spectrum 1 weight 0.10000E+01 volume 0.36900E-02 ppm1 0.619 ppm2 8.848 CV 1
OR { 2367}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 47 and name HN ))
ASSI { 2368}
( segid " " and resid 22 and name HD1%)
(( segid " " and resid 54 and name HN ))
2.300 2.300 3.700 peak 2368 spectrum 1 weight 0.10000E+01 volume 0.42338E-02 ppm1 0.616 ppm2 8.820 CV 1
OR { 2368}
( segid " " and resid 47 and name HD1%)
(( segid " " and resid 54 and name HN ))
ASSI { 2371}
(( segid " " and resid 61 and name HG ))
(( segid " " and resid 61 and name HN ))
2.400 2.400 3.600 peak 2371 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 0.733 ppm2 8.234 CV 1
ASSI { 2373}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 27 and name HN ))
2.300 2.300 3.700 peak 2373 spectrum 1 weight 0.10000E+01 volume 0.45154E-02 ppm1 0.477 ppm2 9.168 CV 1
ASSI { 2376}
(( segid " " and resid 31 and name HB3 ))
(( segid " " and resid 26 and name HE3 ))
2.300 2.300 3.700 peak 2376 spectrum 1 weight 0.10000E+01 volume 0.43795E-02 ppm1 0.605 ppm2 7.202 CV 1
ASSI { 2380}
( segid " " and resid 96 and name HD2%)
(( segid " " and resid 96 and name HN ))
2.400 0.700 0.700 peak 2380 spectrum 1 weight 0.10000E+01 volume 0.30297E-02 ppm1 0.915 ppm2 8.361 CV 1
OR { 2380}
( segid " " and resid 96 and name HD1%)
(( segid " " and resid 96 and name HN ))
ASSI { 2381}
( segid " " and resid 76 and name HG1%)
(( segid " " and resid 75 and name HN ))
2.400 2.400 3.600 peak 2381 spectrum 1 weight 0.10000E+01 volume 0.29715E-02 ppm1 0.914 ppm2 8.298 CV 1
OR { 2381}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 75 and name HN ))
ASSI { 2382}
(( segid " " and resid 4 and name HB3 ))
(( segid " " and resid 5 and name HN ))
2.400 2.400 3.600 peak 2382 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 0.800 ppm2 8.152 CV 1
ASSI { 2383}
(( segid " " and resid 4 and name HB2 ))
(( segid " " and resid 5 and name HN ))
2.400 2.400 3.600 peak 2383 spectrum 1 weight 0.10000E+01 volume 0.31657E-02 ppm1 1.219 ppm2 8.147 CV 1
ASSI { 2384}
( segid " " and resid 108 and name HB% )
(( segid " " and resid 109 and name HN ))
2.500 0.800 0.800 peak 2384 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 1.385 ppm2 8.174 CV 1
ASSI { 2385}
( segid " " and resid 3 and name HD2%)
(( segid " " and resid 3 and name HN ))
2.500 0.800 0.800 peak 2385 spectrum 1 weight 0.10000E+01 volume 0.27190E-02 ppm1 0.814 ppm2 8.307 CV 1
OR { 2385}
( segid " " and resid 3 and name HD1%)
(( segid " " and resid 3 and name HN ))
ASSI { 2387}
(( segid " " and resid 19 and name HG ))
(( segid " " and resid 98 and name HN ))
2.300 2.300 3.700 peak 2387 spectrum 1 weight 0.10000E+01 volume 0.39911E-02 ppm1 0.867 ppm2 8.894 CV 1
ASSI { 2388}
( segid " " and resid 35 and name HD2%)
(( segid " " and resid 59 and name HN ))
2.300 2.300 3.700 peak 2388 spectrum 1 weight 0.10000E+01 volume 0.40105E-02 ppm1 0.974 ppm2 8.872 CV 1
ASSI { 2390}
( segid " " and resid 79 and name HG2%)
(( segid " " and resid 79 and name HN ))
2.600 0.800 0.800 peak 2390 spectrum 1 weight 0.10000E+01 volume 0.20684E-02 ppm1 0.924 ppm2 8.235 CV 1
ASSI { 2391}
( segid " " and resid 61 and name HD2%)
(( segid " " and resid 61 and name HN ))
2.500 0.800 0.800 peak 2391 spectrum 1 weight 0.10000E+01 volume 0.24374E-02 ppm1 0.839 ppm2 8.233 CV 1
OR { 2391}
( segid " " and resid 61 and name HD1%)
(( segid " " and resid 61 and name HN ))
ASSI { 2394}
(( segid " " and resid 20 and name HD2 ))
(( segid " " and resid 20 and name HN ))
2.300 2.300 3.700 peak 2394 spectrum 1 weight 0.10000E+01 volume 0.42727E-02 ppm1 1.153 ppm2 9.320 CV 1
ASSI { 2398}
(( segid " " and resid 61 and name HB3 ))
(( segid " " and resid 60 and name HN ))
2.600 2.600 3.400 peak 2398 spectrum 1 weight 0.10000E+01 volume 0.20587E-02 ppm1 1.811 ppm2 8.841 CV 1
OR { 2398}
(( segid " " and resid 62 and name HB3 ))
(( segid " " and resid 60 and name HN ))
ASSI { 2402}
(( segid " " and resid 6 and name HB3 ))
(( segid " " and resid 27 and name HN ))
2.200 2.200 3.800 peak 2402 spectrum 1 weight 0.10000E+01 volume 0.51272E-02 ppm1 2.278 ppm2 9.162 CV 1
ASSI { 2403}
(( segid " " and resid 53 and name HG3 ))
(( segid " " and resid 54 and name HN ))
2.500 2.500 3.500 peak 2403 spectrum 1 weight 0.10000E+01 volume 0.26122E-02 ppm1 1.663 ppm2 8.816 CV 1
ASSI { 2404}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 71 and name HN ))
2.400 0.700 0.700 peak 2404 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 2.093 ppm2 8.520 CV 1
ASSI { 2405}
(( segid " " and resid 85 and name HB3 ))
(( segid " " and resid 86 and name HN ))
2.300 2.300 3.700 peak 2405 spectrum 1 weight 0.10000E+01 volume 0.41853E-02 ppm1 2.005 ppm2 8.473 CV 1
ASSI { 2412}
(( segid " " and resid 59 and name HB2 ))
(( segid " " and resid 56 and name HN ))
2.300 2.300 3.700 peak 2412 spectrum 1 weight 0.10000E+01 volume 0.38940E-02 ppm1 3.102 ppm2 8.746 CV 1
ASSI { 2414}
(( segid " " and resid 65 and name HA2 ))
(( segid " " and resid 63 and name HN ))
2.400 2.400 3.600 peak 2414 spectrum 1 weight 0.10000E+01 volume 0.35541E-02 ppm1 3.170 ppm2 7.484 CV 1
ASSI { 2415}
(( segid " " and resid 62 and name HD3 ))
(( segid " " and resid 64 and name HN ))
2.300 2.300 3.700 peak 2415 spectrum 1 weight 0.10000E+01 volume 0.37871E-02 ppm1 3.203 ppm2 7.652 CV 1
OR { 2415}
(( segid " " and resid 62 and name HD2 ))
(( segid " " and resid 64 and name HN ))
OR { 2415}
(( segid " " and resid 39 and name HD2 ))
(( segid " " and resid 30 and name HN ))
ASSI { 2419}
(( segid " " and resid 68 and name HA2 ))
(( segid " " and resid 62 and name HE ))
2.200 2.200 3.800 peak 2419 spectrum 1 weight 0.10000E+01 volume 0.56807E-02 ppm1 3.949 ppm2 7.232 CV 1
OR { 2419}
(( segid " " and resid 68 and name HA1 ))
(( segid " " and resid 62 and name HE ))
ASSI { 2425}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HN ))
2.600 0.800 0.800 peak 2425 spectrum 1 weight 0.10000E+01 volume 0.21363E-02 ppm1 4.507 ppm2 8.433 CV 1
ASSI { 2426}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 85 and name HN ))
2.500 0.800 0.800 peak 2426 spectrum 1 weight 0.10000E+01 volume 0.22820E-02 ppm1 4.382 ppm2 8.367 CV 1
ASSI { 2429}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HN ))
2.400 0.700 0.700 peak 2429 spectrum 1 weight 0.10000E+01 volume 0.30200E-02 ppm1 4.112 ppm2 8.287 CV 1
ASSI { 2431}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 97 and name HN ))
2.500 0.800 0.800 peak 2431 spectrum 1 weight 0.10000E+01 volume 0.27481E-02 ppm1 4.323 ppm2 8.257 CV 1
ASSI { 2432}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 36 and name HN ))
2.500 2.500 3.500 peak 2432 spectrum 1 weight 0.10000E+01 volume 0.23791E-02 ppm1 4.205 ppm2 8.254 CV 1
OR { 2432}
(( segid " " and resid 111 and name HA ))
(( segid " " and resid 113 and name HN ))
ASSI { 2435}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 26 and name HN ))
2.300 2.300 3.700 peak 2435 spectrum 1 weight 0.10000E+01 volume 0.37095E-02 ppm1 5.562 ppm2 9.352 CV 1
ASSI { 2436}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HN ))
2.600 0.800 0.800 peak 2436 spectrum 1 weight 0.10000E+01 volume 0.20295E-02 ppm1 6.912 ppm2 7.643 CV 1
ASSI { 2437}
(( segid " " and resid 26 and name HE3 ))
(( segid " " and resid 9 and name HN ))
2.300 2.300 3.700 peak 2437 spectrum 1 weight 0.10000E+01 volume 0.40105E-02 ppm1 7.214 ppm2 7.991 CV 1
ASSI { 2438}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 88 and name HN ))
2.500 0.800 0.800 peak 2438 spectrum 1 weight 0.10000E+01 volume 0.22237E-02 ppm1 8.264 ppm2 8.438 CV 1
OR { 2438}
(( segid " " and resid 113 and name HN ))
(( segid " " and resid 112 and name HN ))
ASSI { 2439}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HN ))
2.600 0.800 0.800 peak 2439 spectrum 1 weight 0.10000E+01 volume 0.20975E-02 ppm1 8.158 ppm2 8.410 CV 1
ASSI { 2440}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 77 and name HN ))
2.400 2.400 3.600 peak 2440 spectrum 1 weight 0.10000E+01 volume 0.31560E-02 ppm1 8.033 ppm2 8.409 CV 1
ASSI { 2441}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HN ))
2.500 2.500 3.500 peak 2441 spectrum 1 weight 0.10000E+01 volume 0.26219E-02 ppm1 8.029 ppm2 8.301 CV 1
ASSI { 2442}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 113 and name HN ))
2.400 2.400 3.600 peak 2442 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 8.025 ppm2 8.274 CV 1
ASSI { 2443}
(( segid " " and resid 107 and name HN ))
(( segid " " and resid 108 and name HN ))
2.500 0.800 0.800 peak 2443 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 8.029 ppm2 8.220 CV 1
ASSI { 2444}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 75 and name HN ))
2.500 2.500 3.500 peak 2444 spectrum 1 weight 0.10000E+01 volume 0.27869E-02 ppm1 8.165 ppm2 8.300 CV 1
ASSI { 2445}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 85 and name HN ))
2.500 2.500 3.500 peak 2445 spectrum 1 weight 0.10000E+01 volume 0.26122E-02 ppm1 8.213 ppm2 8.368 CV 1
ASSI { 2446}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 110 and name HN ))
2.500 0.800 0.800 peak 2446 spectrum 1 weight 0.10000E+01 volume 0.25927E-02 ppm1 8.167 ppm2 8.335 CV 1
ASSI { 2448}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 11 and name HN ))
2.400 0.700 0.700 peak 2448 spectrum 1 weight 0.10000E+01 volume 0.31754E-02 ppm1 7.853 ppm2 8.298 CV 1
ASSI { 2449}
(( segid " " and resid 114 and name HN ))
(( segid " " and resid 113 and name HN ))
2.400 2.400 3.600 peak 2449 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 7.872 ppm2 8.275 CV 1
ASSI { 2451}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 36 and name HN ))
2.400 0.700 0.700 peak 2451 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 8.026 ppm2 8.235 CV 1
ASSI { 2452}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 59 and name HN ))
2.400 2.400 3.600 peak 2452 spectrum 1 weight 0.10000E+01 volume 0.32919E-02 ppm1 8.239 ppm2 8.866 CV 1
OR { 2452}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 38 and name HN ))
OR { 2452}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 38 and name HN ))
ASSI { 2453}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 59 and name HN ))
2.400 0.700 0.700 peak 2453 spectrum 1 weight 0.10000E+01 volume 0.34764E-02 ppm1 8.190 ppm2 8.861 CV 1
ASSI { 2454}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 38 and name HN ))
2.400 2.400 3.600 peak 2454 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 8.608 ppm2 8.876 CV 1
ASSI { 2455}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HN ))
2.400 0.700 0.700 peak 2455 spectrum 1 weight 0.10000E+01 volume 0.30103E-02 ppm1 8.295 ppm2 8.646 CV 1
ASSI { 2456}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 33 and name HN ))
2.300 2.300 3.700 peak 2456 spectrum 1 weight 0.10000E+01 volume 0.43018E-02 ppm1 8.035 ppm2 8.607 CV 1
ASSI { 2457}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 92 and name HN ))
2.200 2.200 3.800 peak 2457 spectrum 1 weight 0.10000E+01 volume 0.49233E-02 ppm1 7.568 ppm2 9.001 CV 1
ASSI { 2460}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 73 and name HN ))
2.500 0.800 0.800 peak 2460 spectrum 1 weight 0.10000E+01 volume 0.26316E-02 ppm1 8.270 ppm2 8.585 CV 1
ASSI { 2461}
(( segid " " and resid 89 and name HN ))
(( segid " " and resid 73 and name HN ))
2.400 2.400 3.600 peak 2461 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 8.384 ppm2 8.587 CV 1
ASSI { 2463}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 56 and name HN ))
2.400 2.400 3.600 peak 2463 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 8.248 ppm2 8.734 CV 1
OR { 2463}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 95 and name HN ))
ASSI { 2464}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
2.400 2.400 3.600 peak 2464 spectrum 1 weight 0.10000E+01 volume 0.33210E-02 ppm1 8.194 ppm2 8.648 CV 1
ASSI { 2466}
(( segid " " and resid 98 and name HN ))
(( segid " " and resid 20 and name HN ))
2.400 2.400 3.600 peak 2466 spectrum 1 weight 0.10000E+01 volume 0.33016E-02 ppm1 8.887 ppm2 9.315 CV 1
ASSI { 2467}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 62 and name HB2 ))
2.500 2.500 3.500 peak 2467 spectrum 1 weight 0.10000E+01 volume 0.22140E-02 ppm1 4.672 ppm2 1.977 CV 1
ASSI { 2469}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HB2 ))
2.500 0.800 0.800 peak 2469 spectrum 1 weight 0.10000E+01 volume 0.22626E-02 ppm1 4.336 ppm2 1.574 CV 1
ASSI { 2471}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 76 and name HB ))
2.400 2.400 3.600 peak 2471 spectrum 1 weight 0.10000E+01 volume 0.28549E-02 ppm1 4.639 ppm2 2.073 CV 1
ASSI { 2473}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name HB3 ))
2.400 2.400 3.600 peak 2473 spectrum 1 weight 0.10000E+01 volume 0.34473E-02 ppm1 4.666 ppm2 2.712 CV 1
OR { 2473}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 60 and name HB2 ))
ASSI { 2476}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 61 and name HB2 ))
2.400 0.700 0.700 peak 2476 spectrum 1 weight 0.10000E+01 volume 0.36026E-02 ppm1 3.902 ppm2 1.347 CV 1
ASSI { 2477}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 63 and name HD1%)
2.400 2.400 3.600 peak 2477 spectrum 1 weight 0.10000E+01 volume 0.28646E-02 ppm1 4.012 ppm2 0.821 CV 1
OR { 2477}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 61 and name HD2%)
OR { 2477}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 61 and name HD1%)
ASSI { 2478}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 19 and name HG ))
2.400 2.400 3.600 peak 2478 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 3.983 ppm2 0.858 CV 1
ASSI { 2480}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 57 and name HG3 ))
2.400 2.400 3.600 peak 2480 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 3.907 ppm2 1.408 CV 1
ASSI { 2483}
(( segid " " and resid 66 and name HB2 ))
(( segid " " and resid 61 and name HG ))
2.400 2.400 3.600 peak 2483 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 3.985 ppm2 0.711 CV 1
OR { 2483}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 97 and name HG2%)
OR { 2483}
(( segid " " and resid 67 and name HA2 ))
(( segid " " and resid 61 and name HG ))
OR { 2483}
(( segid " " and resid 67 and name HA1 ))
(( segid " " and resid 61 and name HG ))
ASSI { 2485}
(( segid " " and resid 96 and name HA ))
( segid " " and resid 96 and name HD2%)
2.400 2.400 3.600 peak 2485 spectrum 1 weight 0.10000E+01 volume 0.29035E-02 ppm1 4.331 ppm2 0.816 CV 1
OR { 2485}
(( segid " " and resid 96 and name HA ))
( segid " " and resid 96 and name HD1%)
ASSI { 2490}
(( segid " " and resid 45 and name HD2 ))
(( segid " " and resid 46 and name HG3 ))
2.600 0.800 0.800 peak 2490 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 3.021 ppm2 1.484 CV 1
OR { 2490}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 46 and name HG3 ))
OR { 2490}
(( segid " " and resid 45 and name HD3 ))
(( segid " " and resid 46 and name HG2 ))
ASSI { 2491}
(( segid " " and resid 65 and name HA2 ))
( segid " " and resid 61 and name HD1%)
2.500 0.800 0.800 peak 2491 spectrum 1 weight 0.10000E+01 volume 0.26024E-02 ppm1 3.171 ppm2 0.829 CV 1
OR { 2491}
(( segid " " and resid 65 and name HA2 ))
( segid " " and resid 61 and name HD2%)
ASSI { 2492}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 19 and name HD1%)
2.500 0.800 0.800 peak 2492 spectrum 1 weight 0.10000E+01 volume 0.23014E-02 ppm1 1.852 ppm2 0.991 CV 1
OR { 2492}
(( segid " " and resid 19 and name HB2 ))
( segid " " and resid 19 and name HD2%)
ASSI { 2493}
(( segid " " and resid 50 and name HB2 ))
( segid " " and resid 55 and name HD2%)
2.400 2.400 3.600 peak 2493 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 1.885 ppm2 0.953 CV 1
ASSI { 2494}
(( segid " " and resid 101 and name HG2 ))
(( segid " " and resid 100 and name HG ))
2.500 0.800 0.800 peak 2494 spectrum 1 weight 0.10000E+01 volume 0.22723E-02 ppm1 1.970 ppm2 1.322 CV 1
OR { 2494}
(( segid " " and resid 101 and name HG3 ))
(( segid " " and resid 100 and name HG ))
ASSI { 2495}
(( segid " " and resid 99 and name HG3 ))
( segid " " and resid 19 and name HD2%)
2.500 2.500 3.500 peak 2495 spectrum 1 weight 0.10000E+01 volume 0.23597E-02 ppm1 1.438 ppm2 0.985 CV 1
OR { 2495}
(( segid " " and resid 99 and name HG2 ))
( segid " " and resid 19 and name HD2%)
ASSI { 2497}
(( segid " " and resid 96 and name HB2 ))
( segid " " and resid 96 and name HD2%)
2.700 0.900 0.900 peak 2497 spectrum 1 weight 0.10000E+01 volume 0.17382E-02 ppm1 1.588 ppm2 0.819 CV 1
ASSI { 2498}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 22 and name HG2%)
2.600 0.800 0.800 peak 2498 spectrum 1 weight 0.10000E+01 volume 0.22043E-02 ppm1 1.717 ppm2 0.510 CV 1
ASSI { 2500}
(( segid " " and resid 51 and name HB3 ))
( segid " " and resid 51 and name HD1%)
2.600 0.800 0.800 peak 2500 spectrum 1 weight 0.10000E+01 volume 0.20781E-02 ppm1 1.675 ppm2 0.930 CV 1
OR { 2500}
(( segid " " and resid 51 and name HB3 ))
( segid " " and resid 51 and name HD2%)
ASSI { 2501}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 51 and name HD2%)
2.600 0.800 0.800 peak 2501 spectrum 1 weight 0.10000E+01 volume 0.20489E-02 ppm1 1.797 ppm2 0.931 CV 1
OR { 2501}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 51 and name HD1%)
ASSI { 2502}
(( segid " " and resid 81 and name HB3 ))
( segid " " and resid 79 and name HG1%)
2.400 2.400 3.600 peak 2502 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 1.904 ppm2 0.934 CV 1
OR { 2502}
(( segid " " and resid 54 and name HG2 ))
( segid " " and resid 55 and name HD2%)
OR { 2502}
(( segid " " and resid 81 and name HB3 ))
( segid " " and resid 79 and name HG2%)
ASSI { 2503}
(( segid " " and resid 53 and name HG2 ))
( segid " " and resid 55 and name HD2%)
2.400 2.400 3.600 peak 2503 spectrum 1 weight 0.10000E+01 volume 0.28355E-02 ppm1 1.721 ppm2 0.958 CV 1
OR { 2503}
(( segid " " and resid 53 and name HG2 ))
( segid " " and resid 55 and name HD1%)
ASSI { 2508}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 47 and name HD2%)
2.500 2.500 3.500 peak 2508 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 1.718 ppm2 0.463 CV 1
OR { 2508}
(( segid " " and resid 22 and name HG12))
( segid " " and resid 97 and name HD1%)
ASSI { 2510}
( segid " " and resid 21 and name HB% )
( segid " " and resid 97 and name HG2%)
2.500 0.800 0.800 peak 2510 spectrum 1 weight 0.10000E+01 volume 0.23694E-02 ppm1 1.141 ppm2 0.697 CV 1
ASSI { 2511}
(( segid " " and resid 22 and name HG13))
( segid " " and resid 47 and name HD1%)
2.600 2.600 3.400 peak 2511 spectrum 1 weight 0.10000E+01 volume 0.21752E-02 ppm1 1.135 ppm2 0.626 CV 1
OR { 2511}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 47 and name HD1%)
OR { 2511}
(( segid " " and resid 40 and name HB2 ))
( segid " " and resid 47 and name HD1%)
ASSI { 2513}
(( segid " " and resid 99 and name HD2 ))
(( segid " " and resid 99 and name HB2 ))
2.500 0.800 0.800 peak 2513 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 2.933 ppm2 1.815 CV 1
OR { 2513}
(( segid " " and resid 99 and name HD3 ))
(( segid " " and resid 99 and name HB2 ))
ASSI { 2514}
(( segid " " and resid 58 and name HD2 ))
(( segid " " and resid 57 and name HG2 ))
2.600 2.600 3.400 peak 2514 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 3.200 ppm2 1.615 CV 1
OR { 2514}
(( segid " " and resid 58 and name HD3 ))
(( segid " " and resid 57 and name HG2 ))
ASSI { 2515}
(( segid " " and resid 57 and name HD2 ))
(( segid " " and resid 57 and name HG2 ))
2.500 0.800 0.800 peak 2515 spectrum 1 weight 0.10000E+01 volume 0.22529E-02 ppm1 3.159 ppm2 1.640 CV 1
OR { 2515}
(( segid " " and resid 57 and name HD3 ))
(( segid " " and resid 57 and name HG2 ))
ASSI { 2516}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 24 and name HB2 ))
2.600 2.600 3.400 peak 2516 spectrum 1 weight 0.10000E+01 volume 0.20878E-02 ppm1 2.068 ppm2 1.710 CV 1
ASSI { 2517}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HB3 ))
2.600 0.800 0.800 peak 2517 spectrum 1 weight 0.10000E+01 volume 0.19421E-02 ppm1 3.378 ppm2 3.098 CV 1
ASSI { 2520}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB3 ))
2.400 0.800 0.800 peak 2520 spectrum 1 weight 0.10000E+01 volume 0.28064E-02 ppm1 4.654 ppm2 2.535 CV 1
ASSI { 2521}
(( segid " " and resid 39 and name HD3 ))
(( segid " " and resid 39 and name HG3 ))
2.400 0.700 0.700 peak 2521 spectrum 1 weight 0.10000E+01 volume 0.29909E-02 ppm1 2.721 ppm2 1.802 CV 1
OR { 2521}
(( segid " " and resid 39 and name HD3 ))
(( segid " " and resid 39 and name HG2 ))
ASSI { 2523}
(( segid " " and resid 34 and name HB3 ))
(( segid " " and resid 35 and name HB2 ))
2.400 2.400 3.600 peak 2523 spectrum 1 weight 0.10000E+01 volume 0.30200E-02 ppm1 2.621 ppm2 1.649 CV 1
ASSI { 2525}
(( segid " " and resid 95 and name HD3 ))
(( segid " " and resid 95 and name HB2 ))
2.500 2.500 3.500 peak 2525 spectrum 1 weight 0.10000E+01 volume 0.23403E-02 ppm1 3.015 ppm2 1.576 CV 1
ASSI { 2528}
(( segid " " and resid 64 and name HA1 ))
( segid " " and resid 61 and name HD2%)
2.500 2.500 3.500 peak 2528 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 3.910 ppm2 0.828 CV 1
OR { 2528}
(( segid " " and resid 64 and name HA1 ))
( segid " " and resid 61 and name HD1%)
ASSI { 2529}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 59 and name HB2 ))
2.400 0.700 0.700 peak 2529 spectrum 1 weight 0.10000E+01 volume 0.29812E-02 ppm1 4.659 ppm2 3.106 CV 1
ASSI { 2530}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 35 and name HB3 ))
2.300 2.300 3.700 peak 2530 spectrum 1 weight 0.10000E+01 volume 0.39911E-02 ppm1 2.540 ppm2 1.397 CV 1
ASSI { 2531}
(( segid " " and resid 59 and name HB3 ))
(( segid " " and resid 35 and name HB2 ))
2.400 2.400 3.600 peak 2531 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 2.541 ppm2 1.637 CV 1
ASSI { 2532}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HB3 ))
6.000 4.500 0.000 peak 2532 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.106 ppm2 2.384 CV 1
OR { 2532}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 2533}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 52 and name HN ))
2.400 2.400 3.600 peak 2533 spectrum 1 weight 0.10000E+01 volume 0.34861E-02 ppm1 4.451 ppm2 7.843 CV 1
ASSI { 2534}
(( segid " " and resid 13 and name HG12))
(( segid " " and resid 5 and name HN ))
6.000 4.500 0.000 peak 2534 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.088 ppm2 8.148 CV 1
ASSI { 2535}
(( segid " " and resid 103 and name HB ))
(( segid " " and resid 105 and name HN ))
2.300 2.300 3.700 peak 2535 spectrum 1 weight 0.10000E+01 volume 0.41464E-02 ppm1 4.228 ppm2 7.644 CV 1
ASSI { 2538}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 73 and name HN ))
2.500 0.800 0.800 peak 2538 spectrum 1 weight 0.10000E+01 volume 0.25442E-02 ppm1 4.502 ppm2 8.582 CV 1
ASSI { 2539}
(( segid " " and resid 86 and name HA1 ))
(( segid " " and resid 87 and name HN ))
2.300 2.300 3.700 peak 2539 spectrum 1 weight 0.10000E+01 volume 0.39814E-02 ppm1 4.254 ppm2 8.280 CV 1
ASSI { 2541}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HB3 ))
6.000 4.500 0.000 peak 2541 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.508 ppm2 3.329 CV 1
ASSI { 2543}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 30 and name HB2 ))
2.300 0.700 0.700 peak 2543 spectrum 1 weight 0.10000E+01 volume 0.41853E-02 ppm1 3.921 ppm2 3.509 CV 1
ASSI { 2544}
(( segid " " and resid 32 and name HB3 ))
(( segid " " and resid 33 and name HB3 ))
2.300 2.300 3.700 peak 2544 spectrum 1 weight 0.10000E+01 volume 0.46028E-02 ppm1 3.405 ppm2 1.557 CV 1
ASSI { 2545}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 33 and name HB3 ))
2.200 2.200 3.800 peak 2545 spectrum 1 weight 0.10000E+01 volume 0.52729E-02 ppm1 3.493 ppm2 1.555 CV 1
ASSI { 2547}
(( segid " " and resid 33 and name HA ))
(( segid " " and resid 33 and name HB3 ))
2.400 0.700 0.700 peak 2547 spectrum 1 weight 0.10000E+01 volume 0.30880E-02 ppm1 4.189 ppm2 1.556 CV 1
ASSI { 2548}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 27 and name HN ))
2.400 2.400 3.600 peak 2548 spectrum 1 weight 0.10000E+01 volume 0.34181E-02 ppm1 3.337 ppm2 9.168 CV 1
ASSI { 2550}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 30 and name HN ))
2.500 2.500 3.500 peak 2550 spectrum 1 weight 0.10000E+01 volume 0.26704E-02 ppm1 3.326 ppm2 7.645 CV 1
ASSI { 2551}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 26 and name HE3 ))
2.400 2.400 3.600 peak 2551 spectrum 1 weight 0.10000E+01 volume 0.29326E-02 ppm1 3.327 ppm2 7.205 CV 1
ASSI { 2552}
(( segid " " and resid 54 and name HE2 ))
(( segid " " and resid 26 and name HH2 ))
2.400 2.400 3.600 peak 2552 spectrum 1 weight 0.10000E+01 volume 0.33696E-02 ppm1 3.323 ppm2 7.105 CV 1
ASSI { 2553}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 31 and name HN ))
2.400 0.700 0.700 peak 2553 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 3.323 ppm2 6.914 CV 1
ASSI { 2554}
(( segid " " and resid 27 and name HB3 ))
(( segid " " and resid 30 and name HB3 ))
2.400 2.400 3.600 peak 2554 spectrum 1 weight 0.10000E+01 volume 0.35347E-02 ppm1 3.741 ppm2 3.332 CV 1
ASSI { 2556}
(( segid " " and resid 30 and name HB3 ))
(( segid " " and resid 31 and name HB3 ))
2.300 2.300 3.700 peak 2556 spectrum 1 weight 0.10000E+01 volume 0.42144E-02 ppm1 3.319 ppm2 0.601 CV 1
ASSI { 2557}
(( segid " " and resid 54 and name HE2 ))
( segid " " and resid 31 and name HD2%)
2.300 2.300 3.700 peak 2557 spectrum 1 weight 0.10000E+01 volume 0.38842E-02 ppm1 3.322 ppm2 -1.002 CV 1
OR { 2557}
(( segid " " and resid 54 and name HE2 ))
( segid " " and resid 31 and name HD1%)
ASSI { 2558}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB3 ))
2.400 0.700 0.700 peak 2558 spectrum 1 weight 0.10000E+01 volume 0.29617E-02 ppm1 4.514 ppm2 3.333 CV 1
ASSI { 2559}
( segid " " and resid 43 and name HG1%)
(( segid " " and resid 44 and name HN ))
2.400 0.700 0.700 peak 2559 spectrum 1 weight 0.10000E+01 volume 0.30686E-02 ppm1 0.910 ppm2 8.440 CV 1
OR { 2559}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 44 and name HN ))
ASSI { 2560}
( segid " " and resid 51 and name HD1%)
(( segid " " and resid 50 and name HN ))
6.000 4.500 0.000 peak 2560 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 0.931 ppm2 8.426 CV 1
OR { 2560}
( segid " " and resid 51 and name HD2%)
(( segid " " and resid 50 and name HN ))
ASSI { 2566}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 20 and name HZ% )
2.300 2.300 3.700 peak 2566 spectrum 1 weight 0.10000E+01 volume 0.39619E-02 ppm1 2.810 ppm2 6.930 CV 1
ASSI { 2567}
( segid " " and resid 21 and name HB% )
(( segid " " and resid 26 and name HD1 ))
2.500 2.500 3.500 peak 2567 spectrum 1 weight 0.10000E+01 volume 0.26996E-02 ppm1 1.148 ppm2 6.913 CV 1
ASSI { 2570}
(( segid " " and resid 48 and name HB3 ))
(( segid " " and resid 48 and name HN ))
2.400 2.400 3.600 peak 2570 spectrum 1 weight 0.10000E+01 volume 0.32725E-02 ppm1 1.971 ppm2 7.438 CV 1
ASSI { 2572}
(( segid " " and resid 91 and name HB3 ))
( segid " " and resid 48 and name HD% )
2.300 2.300 3.700 peak 2572 spectrum 1 weight 0.10000E+01 volume 0.39814E-02 ppm1 2.773 ppm2 6.480 CV 1
ASSI { 2576}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 19 and name HB2 ))
2.400 2.400 3.600 peak 2576 spectrum 1 weight 0.10000E+01 volume 0.32239E-02 ppm1 2.633 ppm2 1.857 CV 1
ASSI { 2577}
(( segid " " and resid 26 and name HB3 ))
(( segid " " and resid 19 and name HB3 ))
2.300 2.300 3.700 peak 2577 spectrum 1 weight 0.10000E+01 volume 0.38357E-02 ppm1 3.477 ppm2 1.300 CV 1
ASSI { 2578}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 47 and name HD2%)
2.400 0.700 0.700 peak 2578 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 4.648 ppm2 0.459 CV 1
OR { 2578}
(( segid " " and resid 47 and name HA ))
( segid " " and resid 47 and name HD1%)
ASSI { 2579}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 47 and name HD2%)
2.400 2.400 3.600 peak 2579 spectrum 1 weight 0.10000E+01 volume 0.32433E-02 ppm1 4.693 ppm2 0.619 CV 1
OR { 2579}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 47 and name HD1%)
ASSI { 2581}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 76 and name HB ))
2.400 2.400 3.600 peak 2581 spectrum 1 weight 0.10000E+01 volume 0.31268E-02 ppm1 4.507 ppm2 2.075 CV 1
OR { 2581}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 45 and name HB2 ))
ASSI { 2582}
( segid " " and resid 21 and name HB% )
( segid " " and resid 97 and name HD1%)
2.400 0.700 0.700 peak 2582 spectrum 1 weight 0.10000E+01 volume 0.28161E-02 ppm1 1.140 ppm2 0.463 CV 1
OR { 2582}
(( segid " " and resid 22 and name HG13))
( segid " " and resid 97 and name HD1%)
OR { 2582}
(( segid " " and resid 22 and name HG13))
( segid " " and resid 47 and name HD2%)
OR { 2582}
(( segid " " and resid 40 and name HB3 ))
( segid " " and resid 47 and name HD2%)
ASSI { 2588}
(( segid " " and resid 94 and name HB3 ))
(( segid " " and resid 95 and name HN ))
2.500 0.800 0.800 peak 2588 spectrum 1 weight 0.10000E+01 volume 0.25053E-02 ppm1 1.796 ppm2 8.735 CV 1
OR { 2588}
(( segid " " and resid 94 and name HB2 ))
(( segid " " and resid 95 and name HN ))
ASSI { 2589}
(( segid " " and resid 94 and name HB2 ))
(( segid " " and resid 93 and name HN ))
2.400 2.400 3.600 peak 2589 spectrum 1 weight 0.10000E+01 volume 0.34667E-02 ppm1 1.795 ppm2 8.489 CV 1
OR { 2589}
(( segid " " and resid 94 and name HB3 ))
(( segid " " and resid 93 and name HN ))
ASSI { 2590}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB2 ))
6.000 4.500 0.000 peak 2590 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.046 ppm2 1.966 CV 1
ASSI { 2594}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 43 and name HG2%)
2.400 0.700 0.700 peak 2594 spectrum 1 weight 0.10000E+01 volume 0.28258E-02 ppm1 4.492 ppm2 0.910 CV 1
OR { 2594}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 43 and name HG1%)
ASSI { 2595}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HG12))
2.300 0.700 0.700 peak 2595 spectrum 1 weight 0.10000E+01 volume 0.43018E-02 ppm1 4.513 ppm2 0.419 CV 1
OR { 2595}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HG13))
ASSI { 2596}
(( segid " " and resid 97 and name HB ))
( segid " " and resid 31 and name HD1%)
2.400 2.400 3.600 peak 2596 spectrum 1 weight 0.10000E+01 volume 0.28452E-02 ppm1 1.463 ppm2 0.221 CV 1
OR { 2596}
(( segid " " and resid 97 and name HB ))
( segid " " and resid 31 and name HD2%)
ASSI { 2597}
( segid " " and resid 97 and name HG2%)
( segid " " and resid 31 and name HD1%)
2.500 0.800 0.800 peak 2597 spectrum 1 weight 0.10000E+01 volume 0.25053E-02 ppm1 0.698 ppm2 0.218 CV 1
OR { 2597}
( segid " " and resid 97 and name HG2%)
( segid " " and resid 31 and name HD2%)
ASSI { 2599}
(( segid " " and resid 20 and name HG2 ))
( segid " " and resid 25 and name HD% )
2.400 0.700 0.700 peak 2599 spectrum 1 weight 0.10000E+01 volume 0.34958E-02 ppm1 1.244 ppm2 6.778 CV 1
ASSI { 2602}
(( segid " " and resid 14 and name HA2 ))
(( segid " " and resid 102 and name HD22))
2.000 2.000 4.000 peak 2602 spectrum 1 weight 0.10000E+01 volume 0.92736E-02 ppm1 3.644 ppm2 6.592 CV 1
ASSI { 2604}
(( segid " " and resid 95 and name HD3 ))
(( segid " " and resid 95 and name HH12))
2.400 2.400 3.600 peak 2604 spectrum 1 weight 0.10000E+01 volume 0.34084E-02 ppm1 3.015 ppm2 6.804 CV 1
ASSI { 2606}
(( segid " " and resid 22 and name HG12))
(( segid " " and resid 26 and name HD1 ))
6.000 4.500 0.000 peak 2606 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 1.724 ppm2 6.907 CV 1
ASSI { 2607}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HB3 ))
6.000 4.500 0.000 peak 2607 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.452 ppm2 1.682 CV 1
ASSI { 2608}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HG2 ))
6.000 4.500 0.000 peak 2608 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.454 ppm2 1.626 CV 1
ASSI { 2609}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HG3 ))
6.000 4.500 0.000 peak 2609 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 4.465 ppm2 1.477 CV 1
ASSI { 2610}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HB3 ))
2.400 0.700 0.700 peak 2610 spectrum 1 weight 0.10000E+01 volume 0.34570E-02 ppm1 2.965 ppm2 2.613 CV 1
ASSI { 2611}
(( segid " " and resid 54 and name HE2 ))
(( segid " " and resid 54 and name HD3 ))
2.300 0.700 0.700 peak 2611 spectrum 1 weight 0.10000E+01 volume 0.40396E-02 ppm1 3.316 ppm2 0.990 CV 1
ASSI { 2612}
(( segid " " and resid 95 and name HD2 ))
(( segid " " and resid 95 and name HE ))
6.000 4.500 0.000 peak 2612 spectrum 1 weight 0.10000E+01 volume 0.00000E+00 ppm1 3.461 ppm2 7.430 CV 1
ASSI { 2613}
(( segid " " and resid 95 and name HD3 ))
(( segid " " and resid 95 and name HB3 ))
2.300 2.300 3.700 peak 2613 spectrum 1 weight 0.10000E+01 volume 0.43115E-02 ppm1 3.014 ppm2 1.326 CV 1
ASSI { 2614}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HD3 ))
2.300 0.700 0.700 peak 2614 spectrum 1 weight 0.10000E+01 volume 0.36512E-02 ppm1 4.046 ppm2 3.202 CV 1
OR { 2614}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HD2 ))
ASSI { 2617}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 71 and name HN ))
2.500 2.500 3.500 peak 2617 spectrum 1 weight 0.10000E+01 volume 0.27578E-02 ppm1 4.506 ppm2 8.521 CV 1
ASSI { 2618}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 63 and name HN ))
2.300 2.300 3.700 peak 2618 spectrum 1 weight 0.10000E+01 volume 0.46125E-02 ppm1 4.666 ppm2 7.482 CV 1
ASSI { 2622}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 87 and name HN ))
2.400 0.700 0.700 peak 2622 spectrum 1 weight 0.10000E+01 volume 0.31171E-02 ppm1 4.491 ppm2 8.262 CV 1