NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
580131 |
4ch0   |
19652 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
!Unambiguous restraints
!
ASSI { 4}
( segid "SUPF" and resid 66 and name HG2%)
(( segid "SUPF" and resid 51 and name HB1 ))
3.400 1.400 1.400 peak 4 spectrum 1 weight 0.10000E+01 volume 0.10405E-02 ppm1 0.629 ppm2 1.737 CV 1
ASSI { 18}
(( segid "SUPF" and resid 33 and name HG1 ))
( segid "SUPF" and resid 111 and name HD% )
4.100 2.100 1.900 peak 18 spectrum 1 weight 0.10000E+01 volume 0.45752E-03 ppm1 1.539 ppm2 7.071 CV 1
ASSI { 25}
(( segid "SUPF" and resid 76 and name HA ))
(( segid "SUPF" and resid 76 and name HB1 ))
2.600 0.900 0.900 peak 25 spectrum 1 weight 0.10000E+01 volume 0.28543E-02 ppm1 4.514 ppm2 1.220 CV 1
ASSI { 29}
(( segid "SUPF" and resid 57 and name HA ))
(( segid "SUPF" and resid 57 and name HG2 ))
3.700 1.700 1.700 peak 29 spectrum 1 weight 0.10000E+01 volume 0.10597E-02 ppm1 4.079 ppm2 0.205 CV 1
ASSI { 30}
(( segid "SUPF" and resid 101 and name HA ))
( segid "SUPF" and resid 100 and name HG2%)
4.200 2.200 1.800 peak 30 spectrum 1 weight 0.10000E+01 volume 0.77643E-03 ppm1 4.244 ppm2 0.470 CV 1
ASSI { 37}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HB1 ))
3.300 1.400 1.400 peak 37 spectrum 1 weight 0.10000E+01 volume 0.28021E-02 ppm1 4.515 ppm2 1.691 CV 1
ASSI { 38}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HB2 ))
2.900 1.000 1.000 peak 38 spectrum 1 weight 0.10000E+01 volume 0.14449E-02 ppm1 4.519 ppm2 1.975 CV 1
ASSI { 40}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HD1 ))
3.400 1.400 1.400 peak 40 spectrum 1 weight 0.10000E+01 volume 0.15077E-02 ppm1 4.520 ppm2 1.397 CV 1
OR { 40}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HD2 ))
OR { 40}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HG2 ))
ASSI { 42}
(( segid "SUPF" and resid 50 and name HB ))
( segid "SUPF" and resid 46 and name HG2%)
2.300 0.700 0.700 peak 42 spectrum 1 weight 0.10000E+01 volume 0.53638E-02 ppm1 4.450 ppm2 1.131 CV 1
ASSI { 44}
( segid "SUPF" and resid 72 and name HG2%)
(( segid "SUPF" and resid 69 and name HB1 ))
3.900 1.900 1.900 peak 44 spectrum 1 weight 0.10000E+01 volume 0.75782E-03 ppm1 1.189 ppm2 2.482 CV 1
ASSI { 46}
( segid "SUPF" and resid 72 and name HG2%)
(( segid "SUPF" and resid 69 and name HB2 ))
4.200 2.200 1.800 peak 46 spectrum 1 weight 0.10000E+01 volume 0.70536E-03 ppm1 1.195 ppm2 3.105 CV 1
ASSI { 51}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 48 and name HB1 ))
4.000 2.000 2.000 peak 51 spectrum 1 weight 0.10000E+01 volume 0.67138E-03 ppm1 0.960 ppm2 2.968 CV 1
OR { 51}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 48 and name HB1 ))
ASSI { 52}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 63 and name HG2 ))
2.900 1.000 1.000 peak 52 spectrum 1 weight 0.10000E+01 volume 0.27429E-02 ppm1 0.958 ppm2 2.052 CV 1
OR { 52}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 63 and name HG2 ))
OR { 52}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 63 and name HB1 ))
ASSI { 56}
(( segid "SUPF" and resid 86 and name HA ))
(( segid "SUPF" and resid 86 and name HG1 ))
2.900 1.100 1.100 peak 56 spectrum 1 weight 0.10000E+01 volume 0.20128E-02 ppm1 4.024 ppm2 1.778 CV 1
ASSI { 59}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HB1 ))
2.900 1.100 1.100 peak 59 spectrum 1 weight 0.10000E+01 volume 0.37991E-02 ppm1 4.184 ppm2 1.693 CV 1
OR { 59}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HD2 ))
OR { 59}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HD1 ))
ASSI { 61}
(( segid "SUPF" and resid 86 and name HA ))
( segid "SUPF" and resid 89 and name HB% )
2.500 0.800 0.800 peak 61 spectrum 1 weight 0.10000E+01 volume 0.48387E-02 ppm1 4.031 ppm2 1.552 CV 1
ASSI { 63}
(( segid "SUPF" and resid 39 and name HB ))
( segid "SUPF" and resid 42 and name HD1%)
2.900 1.000 1.000 peak 63 spectrum 1 weight 0.10000E+01 volume 0.16882E-02 ppm1 1.584 ppm2 0.499 CV 1
ASSI { 66}
(( segid "SUPF" and resid 84 and name HB2 ))
(( segid "SUPF" and resid 60 and name HB2 ))
3.500 3.500 2.500 peak 66 spectrum 1 weight 0.10000E+01 volume 0.13469E-02 ppm1 1.902 ppm2 2.604 CV 1
ASSI { 68}
(( segid "SUPF" and resid 84 and name HB1 ))
(( segid "SUPF" and resid 60 and name HB2 ))
2.800 1.000 1.000 peak 68 spectrum 1 weight 0.10000E+01 volume 0.20316E-02 ppm1 1.733 ppm2 2.602 CV 1
ASSI { 74}
(( segid "SUPF" and resid 103 and name HB1 ))
(( segid "SUPF" and resid 43 and name HD1 ))
2.800 1.000 1.000 peak 74 spectrum 1 weight 0.10000E+01 volume 0.11452E-02 ppm1 1.828 ppm2 3.610 CV 1
ASSI { 75}
(( segid "SUPF" and resid 104 and name HB1 ))
(( segid "SUPF" and resid 104 and name HA ))
2.800 1.000 1.000 peak 75 spectrum 1 weight 0.10000E+01 volume 0.38454E-02 ppm1 1.697 ppm2 4.186 CV 1
ASSI { 76}
(( segid "SUPF" and resid 104 and name HB2 ))
(( segid "SUPF" and resid 104 and name HA ))
2.400 0.700 0.700 peak 76 spectrum 1 weight 0.10000E+01 volume 0.45076E-02 ppm1 1.598 ppm2 4.185 CV 1
ASSI { 77}
(( segid "SUPF" and resid 76 and name HB2 ))
(( segid "SUPF" and resid 76 and name HB1 ))
2.000 0.500 0.500 peak 77 spectrum 1 weight 0.10000E+01 volume 0.56993E-02 ppm1 2.217 ppm2 1.222 CV 1
ASSI { 81}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 61 and name HA ))
3.600 1.600 1.600 peak 81 spectrum 1 weight 0.10000E+01 volume 0.16223E-02 ppm1 0.590 ppm2 4.161 CV 1
ASSI { 82}
( segid "SUPF" and resid 109 and name HD2%)
(( segid "SUPF" and resid 37 and name HA ))
3.100 1.200 1.200 peak 82 spectrum 1 weight 0.10000E+01 volume 0.29197E-02 ppm1 0.851 ppm2 4.255 CV 1
ASSI { 83}
( segid "SUPF" and resid 50 and name HG2%)
(( segid "SUPF" and resid 50 and name HB ))
2.100 0.500 0.500 peak 83 spectrum 1 weight 0.10000E+01 volume 0.12957E-01 ppm1 1.288 ppm2 4.452 CV 1
ASSI { 85}
( segid "SUPF" and resid 32 and name HG2%)
(( segid "SUPF" and resid 32 and name HB ))
2.200 0.600 0.600 peak 85 spectrum 1 weight 0.10000E+01 volume 0.11495E-01 ppm1 1.092 ppm2 4.514 CV 1
ASSI { 89}
(( segid "SUPF" and resid 90 and name HB1 ))
(( segid "SUPF" and resid 90 and name HA ))
2.500 0.800 0.800 peak 89 spectrum 1 weight 0.10000E+01 volume 0.44555E-02 ppm1 2.220 ppm2 3.998 CV 1
ASSI { 90}
(( segid "SUPF" and resid 90 and name HB2 ))
(( segid "SUPF" and resid 87 and name HA ))
3.300 1.400 1.400 peak 90 spectrum 1 weight 0.10000E+01 volume 0.22987E-02 ppm1 2.080 ppm2 4.228 CV 1
ASSI { 94}
(( segid "SUPF" and resid 43 and name HG1 ))
(( segid "SUPF" and resid 43 and name HD2 ))
3.100 1.200 1.200 peak 94 spectrum 1 weight 0.10000E+01 volume 0.23483E-02 ppm1 1.932 ppm2 3.826 CV 1
ASSI { 95}
(( segid "SUPF" and resid 43 and name HG2 ))
(( segid "SUPF" and resid 43 and name HD2 ))
2.600 0.800 0.800 peak 95 spectrum 1 weight 0.10000E+01 volume 0.20749E-02 ppm1 1.818 ppm2 3.827 CV 1
ASSI { 100}
( segid "SUPF" and resid 51 and name HD2%)
(( segid "SUPF" and resid 48 and name HA ))
3.200 1.300 1.300 peak 100 spectrum 1 weight 0.10000E+01 volume 0.17688E-02 ppm1 0.649 ppm2 4.012 CV 1
ASSI { 102}
(( segid "SUPF" and resid 100 and name HG11))
(( segid "SUPF" and resid 100 and name HA ))
3.000 1.100 1.100 peak 102 spectrum 1 weight 0.10000E+01 volume 0.21532E-02 ppm1 0.785 ppm2 3.789 CV 1
ASSI { 104}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 35 and name HB ))
2.200 0.600 0.600 peak 104 spectrum 1 weight 0.10000E+01 volume 0.12307E-01 ppm1 0.804 ppm2 4.528 CV 1
ASSI { 106}
( segid "SUPF" and resid 32 and name HG2%)
(( segid "SUPF" and resid 32 and name HA ))
2.300 0.600 0.600 peak 106 spectrum 1 weight 0.10000E+01 volume 0.10595E-01 ppm1 1.086 ppm2 4.594 CV 1
ASSI { 107}
( segid "SUPF" and resid 82 and name HG2%)
(( segid "SUPF" and resid 36 and name HA ))
2.800 1.000 1.000 peak 107 spectrum 1 weight 0.10000E+01 volume 0.38394E-02 ppm1 1.159 ppm2 5.017 CV 1
ASSI { 108}
( segid "SUPF" and resid 82 and name HG2%)
(( segid "SUPF" and resid 82 and name HA ))
2.300 0.700 0.700 peak 108 spectrum 1 weight 0.10000E+01 volume 0.74981E-02 ppm1 1.155 ppm2 5.096 CV 1
ASSI { 109}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 109 and name HA ))
3.100 1.200 1.200 peak 109 spectrum 1 weight 0.10000E+01 volume 0.13775E-02 ppm1 0.725 ppm2 4.472 CV 1
ASSI { 110}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 37 and name HB ))
2.300 0.700 0.700 peak 110 spectrum 1 weight 0.10000E+01 volume 0.65380E-02 ppm1 0.722 ppm2 1.786 CV 1
ASSI { 111}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 37 and name HG11))
3.400 1.500 1.500 peak 111 spectrum 1 weight 0.10000E+01 volume 0.26801E-02 ppm1 0.722 ppm2 1.639 CV 1
ASSI { 115}
( segid "SUPF" and resid 89 and name HB% )
( segid "SUPF" and resid 37 and name HD1%)
2.600 0.800 0.800 peak 115 spectrum 1 weight 0.10000E+01 volume 0.52794E-02 ppm1 1.554 ppm2 0.683 CV 1
OR { 115}
( segid "SUPF" and resid 89 and name HB% )
( segid "SUPF" and resid 37 and name HG2%)
ASSI { 118}
( segid "SUPF" and resid 66 and name HG2%)
(( segid "SUPF" and resid 47 and name HA ))
2.500 0.800 0.800 peak 118 spectrum 1 weight 0.10000E+01 volume 0.51613E-02 ppm1 0.633 ppm2 4.862 CV 1
ASSI { 119}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 106 and name HA ))
3.800 1.800 1.800 peak 119 spectrum 1 weight 0.10000E+01 volume 0.13434E-02 ppm1 1.052 ppm2 5.497 CV 1
OR { 119}
( segid "SUPF" and resid 107 and name HG1%)
(( segid "SUPF" and resid 106 and name HA ))
ASSI { 121}
(( segid "SUPF" and resid 76 and name HD2 ))
(( segid "SUPF" and resid 76 and name HB2 ))
3.000 1.100 1.100 peak 121 spectrum 1 weight 0.10000E+01 volume 0.16784E-02 ppm1 3.240 ppm2 2.211 CV 1
ASSI { 122}
(( segid "SUPF" and resid 80 and name HB2 ))
(( segid "SUPF" and resid 36 and name HG2 ))
4.300 2.300 1.700 peak 122 spectrum 1 weight 0.10000E+01 volume 0.12045E-02 ppm1 2.874 ppm2 1.394 CV 1
OR { 122}
(( segid "SUPF" and resid 80 and name HB2 ))
(( segid "SUPF" and resid 36 and name HD1 ))
OR { 122}
(( segid "SUPF" and resid 80 and name HB2 ))
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 133}
(( segid "SUPF" and resid 60 and name HB1 ))
(( segid "SUPF" and resid 84 and name HD2 ))
2.500 0.800 0.800 peak 133 spectrum 1 weight 0.10000E+01 volume 0.49723E-02 ppm1 2.566 ppm2 1.721 CV 1
OR { 133}
(( segid "SUPF" and resid 60 and name HB1 ))
(( segid "SUPF" and resid 84 and name HB1 ))
OR { 133}
(( segid "SUPF" and resid 60 and name HB2 ))
(( segid "SUPF" and resid 84 and name HB1 ))
OR { 133}
(( segid "SUPF" and resid 60 and name HB2 ))
(( segid "SUPF" and resid 84 and name HD2 ))
OR { 133}
(( segid "SUPF" and resid 60 and name HB1 ))
(( segid "SUPF" and resid 84 and name HD1 ))
OR { 133}
(( segid "SUPF" and resid 60 and name HB2 ))
(( segid "SUPF" and resid 84 and name HD1 ))
ASSI { 135}
(( segid "SUPF" and resid 97 and name HB2 ))
(( segid "SUPF" and resid 104 and name HD1 ))
3.700 1.700 1.700 peak 135 spectrum 1 weight 0.10000E+01 volume 0.19794E-02 ppm1 2.788 ppm2 1.677 CV 1
OR { 135}
(( segid "SUPF" and resid 97 and name HB2 ))
(( segid "SUPF" and resid 104 and name HD2 ))
OR { 135}
(( segid "SUPF" and resid 97 and name HB2 ))
(( segid "SUPF" and resid 104 and name HB1 ))
ASSI { 137}
(( segid "SUPF" and resid 35 and name HA ))
( segid "SUPF" and resid 89 and name HB% )
2.300 0.600 0.600 peak 137 spectrum 1 weight 0.10000E+01 volume 0.80017E-02 ppm1 4.399 ppm2 1.552 CV 1
ASSI { 140}
(( segid "SUPF" and resid 43 and name HA ))
(( segid "SUPF" and resid 43 and name HB1 ))
2.300 0.600 0.600 peak 140 spectrum 1 weight 0.10000E+01 volume 0.63199E-02 ppm1 4.380 ppm2 2.055 CV 1
ASSI { 144}
(( segid "SUPF" and resid 26 and name HA ))
( segid "SUPF" and resid 26 and name HB% )
2.800 1.000 1.000 peak 144 spectrum 1 weight 0.10000E+01 volume 0.30612E-02 ppm1 4.357 ppm2 1.407 CV 1
ASSI { 150}
(( segid "SUPF" and resid 29 and name HA ))
(( segid "SUPF" and resid 29 and name HB1 ))
2.800 1.000 1.000 peak 150 spectrum 1 weight 0.10000E+01 volume 0.39604E-02 ppm1 4.434 ppm2 3.899 CV 1
ASSI { 151}
(( segid "SUPF" and resid 29 and name HA ))
(( segid "SUPF" and resid 29 and name HB2 ))
2.700 0.900 0.900 peak 151 spectrum 1 weight 0.10000E+01 volume 0.33197E-02 ppm1 4.428 ppm2 3.859 CV 1
ASSI { 152}
(( segid "SUPF" and resid 29 and name HB2 ))
(( segid "SUPF" and resid 29 and name HA ))
2.300 0.700 0.700 peak 152 spectrum 1 weight 0.10000E+01 volume 0.94281E-02 ppm1 3.884 ppm2 4.431 CV 1
OR { 152}
(( segid "SUPF" and resid 29 and name HB1 ))
(( segid "SUPF" and resid 29 and name HA ))
ASSI { 153}
(( segid "SUPF" and resid 30 and name HA ))
(( segid "SUPF" and resid 30 and name HB1 ))
2.500 0.800 0.800 peak 153 spectrum 1 weight 0.10000E+01 volume 0.49475E-02 ppm1 4.314 ppm2 1.876 CV 1
ASSI { 154}
(( segid "SUPF" and resid 30 and name HA ))
(( segid "SUPF" and resid 30 and name HB2 ))
2.600 0.800 0.800 peak 154 spectrum 1 weight 0.10000E+01 volume 0.44266E-02 ppm1 4.322 ppm2 1.792 CV 1
ASSI { 155}
(( segid "SUPF" and resid 30 and name HA ))
(( segid "SUPF" and resid 30 and name HD1 ))
3.700 1.700 1.700 peak 155 spectrum 1 weight 0.10000E+01 volume 0.16723E-02 ppm1 4.322 ppm2 3.200 CV 1
OR { 155}
(( segid "SUPF" and resid 30 and name HA ))
(( segid "SUPF" and resid 30 and name HD2 ))
ASSI { 157}
(( segid "SUPF" and resid 30 and name HB1 ))
(( segid "SUPF" and resid 30 and name HD1 ))
2.500 0.800 0.800 peak 157 spectrum 1 weight 0.10000E+01 volume 0.58826E-02 ppm1 1.851 ppm2 3.197 CV 1
OR { 157}
(( segid "SUPF" and resid 30 and name HB1 ))
(( segid "SUPF" and resid 30 and name HD2 ))
ASSI { 159}
(( segid "SUPF" and resid 30 and name HB2 ))
(( segid "SUPF" and resid 30 and name HD1 ))
2.600 0.900 0.900 peak 159 spectrum 1 weight 0.10000E+01 volume 0.53113E-02 ppm1 1.805 ppm2 3.195 CV 1
OR { 159}
(( segid "SUPF" and resid 30 and name HB2 ))
(( segid "SUPF" and resid 30 and name HD2 ))
ASSI { 160}
(( segid "SUPF" and resid 31 and name HA ))
(( segid "SUPF" and resid 31 and name HB1 ))
2.500 0.800 0.800 peak 160 spectrum 1 weight 0.10000E+01 volume 0.58769E-02 ppm1 4.633 ppm2 2.661 CV 1
ASSI { 161}
(( segid "SUPF" and resid 31 and name HA ))
(( segid "SUPF" and resid 31 and name HB2 ))
2.700 0.900 0.900 peak 161 spectrum 1 weight 0.10000E+01 volume 0.47682E-02 ppm1 4.633 ppm2 2.795 CV 1
ASSI { 163}
(( segid "SUPF" and resid 31 and name HB1 ))
(( segid "SUPF" and resid 31 and name HB2 ))
1.700 0.400 0.500 peak 163 spectrum 1 weight 0.10000E+01 volume 0.24787E-01 ppm1 2.662 ppm2 2.792 CV 1
ASSI { 168}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 32 and name HA ))
2.400 0.700 0.700 peak 168 spectrum 1 weight 0.10000E+01 volume 0.60928E-02 ppm1 4.514 ppm2 4.597 CV 1
ASSI { 170}
(( segid "SUPF" and resid 33 and name HA ))
(( segid "SUPF" and resid 33 and name HB1 ))
3.200 1.300 1.300 peak 170 spectrum 1 weight 0.10000E+01 volume 0.18469E-02 ppm1 3.861 ppm2 1.403 CV 1
ASSI { 171}
(( segid "SUPF" and resid 33 and name HA ))
(( segid "SUPF" and resid 111 and name HB1 ))
3.600 1.600 1.600 peak 171 spectrum 1 weight 0.10000E+01 volume 0.58973E-03 ppm1 3.871 ppm2 2.858 CV 1
ASSI { 172}
(( segid "SUPF" and resid 33 and name HA ))
( segid "SUPF" and resid 111 and name HD% )
4.100 2.100 1.900 peak 172 spectrum 1 weight 0.10000E+01 volume 0.51194E-03 ppm1 3.861 ppm2 7.071 CV 1
ASSI { 174}
(( segid "SUPF" and resid 33 and name HB1 ))
(( segid "SUPF" and resid 33 and name HB2 ))
1.900 0.400 0.400 peak 174 spectrum 1 weight 0.10000E+01 volume 0.97280E-02 ppm1 1.398 ppm2 1.819 CV 1
ASSI { 175}
(( segid "SUPF" and resid 33 and name HB1 ))
( segid "SUPF" and resid 34 and name HD% )
3.400 1.400 1.400 peak 175 spectrum 1 weight 0.10000E+01 volume 0.86787E-03 ppm1 1.397 ppm2 7.199 CV 1
ASSI { 176}
(( segid "SUPF" and resid 33 and name HB2 ))
(( segid "SUPF" and resid 33 and name HA ))
2.600 0.900 0.900 peak 176 spectrum 1 weight 0.10000E+01 volume 0.36470E-02 ppm1 1.822 ppm2 3.861 CV 1
ASSI { 177}
(( segid "SUPF" and resid 33 and name HB2 ))
( segid "SUPF" and resid 34 and name HD% )
4.000 2.000 2.000 peak 177 spectrum 1 weight 0.10000E+01 volume 0.71542E-03 ppm1 1.824 ppm2 7.201 CV 1
ASSI { 178}
( segid "SUPF" and resid 33 and name HE% )
( segid "SUPF" and resid 34 and name HD% )
3.400 1.400 1.400 peak 178 spectrum 1 weight 0.10000E+01 volume 0.16026E-02 ppm1 1.587 ppm2 7.204 CV 1
ASSI { 179}
( segid "SUPF" and resid 33 and name HE% )
( segid "SUPF" and resid 34 and name HE% )
3.300 1.400 1.400 peak 179 spectrum 1 weight 0.10000E+01 volume 0.12839E-02 ppm1 1.587 ppm2 7.284 CV 1
ASSI { 180}
( segid "SUPF" and resid 33 and name HE% )
( segid "SUPF" and resid 111 and name HD% )
3.200 1.300 1.300 peak 180 spectrum 1 weight 0.10000E+01 volume 0.13904E-02 ppm1 1.588 ppm2 7.075 CV 1
ASSI { 181}
( segid "SUPF" and resid 33 and name HE% )
( segid "SUPF" and resid 111 and name HE% )
3.400 1.400 1.400 peak 181 spectrum 1 weight 0.10000E+01 volume 0.14806E-02 ppm1 1.587 ppm2 6.752 CV 1
ASSI { 182}
(( segid "SUPF" and resid 33 and name HG2 ))
( segid "SUPF" and resid 34 and name HD% )
3.900 1.900 1.900 peak 182 spectrum 1 weight 0.10000E+01 volume 0.45761E-03 ppm1 1.242 ppm2 7.201 CV 1
ASSI { 183}
(( segid "SUPF" and resid 33 and name HG2 ))
( segid "SUPF" and resid 111 and name HD% )
4.000 2.000 2.000 peak 183 spectrum 1 weight 0.10000E+01 volume 0.43507E-03 ppm1 1.247 ppm2 7.076 CV 1
ASSI { 184}
(( segid "SUPF" and resid 34 and name HA ))
(( segid "SUPF" and resid 86 and name HD2 ))
4.400 2.400 1.600 peak 184 spectrum 1 weight 0.10000E+01 volume 0.60020E-03 ppm1 4.888 ppm2 3.002 CV 1
OR { 184}
(( segid "SUPF" and resid 34 and name HA ))
(( segid "SUPF" and resid 86 and name HD1 ))
ASSI { 185}
(( segid "SUPF" and resid 34 and name HA ))
(( segid "SUPF" and resid 34 and name HB1 ))
2.800 1.000 1.000 peak 185 spectrum 1 weight 0.10000E+01 volume 0.23524E-02 ppm1 4.894 ppm2 2.794 CV 1
ASSI { 186}
(( segid "SUPF" and resid 34 and name HA ))
(( segid "SUPF" and resid 34 and name HB2 ))
3.100 1.200 1.200 peak 186 spectrum 1 weight 0.10000E+01 volume 0.25704E-02 ppm1 4.882 ppm2 3.461 CV 1
ASSI { 187}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 34 and name HD% )
2.600 0.800 0.800 peak 187 spectrum 1 weight 0.10000E+01 volume 0.48604E-02 ppm1 4.882 ppm2 7.199 CV 1
ASSI { 188}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 34 and name HE% )
4.300 2.300 1.700 peak 188 spectrum 1 weight 0.10000E+01 volume 0.85119E-03 ppm1 4.883 ppm2 7.284 CV 1
ASSI { 189}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 109 and name HD1%)
3.100 1.200 1.200 peak 189 spectrum 1 weight 0.10000E+01 volume 0.18760E-02 ppm1 4.884 ppm2 1.267 CV 1
ASSI { 190}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 109 and name HD2%)
2.900 1.100 1.100 peak 190 spectrum 1 weight 0.10000E+01 volume 0.20585E-02 ppm1 4.885 ppm2 0.847 CV 1
ASSI { 191}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 111 and name HD% )
3.800 1.800 1.800 peak 191 spectrum 1 weight 0.10000E+01 volume 0.47412E-03 ppm1 4.883 ppm2 7.072 CV 1
ASSI { 192}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 111 and name HE% )
4.000 2.000 2.000 peak 192 spectrum 1 weight 0.10000E+01 volume 0.48545E-03 ppm1 4.878 ppm2 6.750 CV 1
ASSI { 193}
(( segid "SUPF" and resid 34 and name HB1 ))
(( segid "SUPF" and resid 34 and name HB2 ))
2.000 0.500 0.500 peak 193 spectrum 1 weight 0.10000E+01 volume 0.64344E-02 ppm1 2.797 ppm2 3.459 CV 1
ASSI { 194}
(( segid "SUPF" and resid 34 and name HB1 ))
( segid "SUPF" and resid 34 and name HD% )
2.700 0.900 0.900 peak 194 spectrum 1 weight 0.10000E+01 volume 0.37497E-02 ppm1 2.797 ppm2 7.199 CV 1
ASSI { 195}
(( segid "SUPF" and resid 34 and name HB1 ))
( segid "SUPF" and resid 34 and name HE% )
4.600 2.700 1.400 peak 195 spectrum 1 weight 0.10000E+01 volume 0.57048E-03 ppm1 2.794 ppm2 7.283 CV 1
ASSI { 196}
(( segid "SUPF" and resid 34 and name HB1 ))
( segid "SUPF" and resid 35 and name HG2%)
4.000 2.000 2.000 peak 196 spectrum 1 weight 0.10000E+01 volume 0.69518E-03 ppm1 2.797 ppm2 0.815 CV 1
ASSI { 200}
(( segid "SUPF" and resid 34 and name HB2 ))
( segid "SUPF" and resid 34 and name HD% )
2.600 0.800 0.800 peak 200 spectrum 1 weight 0.10000E+01 volume 0.35351E-02 ppm1 3.461 ppm2 7.199 CV 1
ASSI { 201}
(( segid "SUPF" and resid 34 and name HB2 ))
( segid "SUPF" and resid 34 and name HE% )
4.700 2.800 1.300 peak 201 spectrum 1 weight 0.10000E+01 volume 0.54535E-03 ppm1 3.457 ppm2 7.286 CV 1
ASSI { 202}
(( segid "SUPF" and resid 34 and name HB2 ))
( segid "SUPF" and resid 35 and name HG2%)
3.400 1.500 1.500 peak 202 spectrum 1 weight 0.10000E+01 volume 0.68464E-03 ppm1 3.464 ppm2 0.811 CV 1
ASSI { 203}
(( segid "SUPF" and resid 34 and name HB2 ))
(( segid "SUPF" and resid 86 and name HB1 ))
3.700 1.700 1.700 peak 203 spectrum 1 weight 0.10000E+01 volume 0.89420E-03 ppm1 3.463 ppm2 1.879 CV 1
OR { 203}
(( segid "SUPF" and resid 34 and name HB2 ))
(( segid "SUPF" and resid 86 and name HB2 ))
ASSI { 208}
( segid "SUPF" and resid 34 and name HD% )
( segid "SUPF" and resid 34 and name HE% )
1.900 0.500 0.500 peak 208 spectrum 1 weight 0.10000E+01 volume 0.22869E-01 ppm1 7.201 ppm2 7.283 CV 1
ASSI { 212}
(( segid "SUPF" and resid 35 and name HA ))
( segid "SUPF" and resid 35 and name HG2%)
2.300 0.700 0.700 peak 212 spectrum 1 weight 0.10000E+01 volume 0.95937E-02 ppm1 4.402 ppm2 0.812 CV 1
ASSI { 213}
(( segid "SUPF" and resid 35 and name HB ))
(( segid "SUPF" and resid 35 and name HA ))
2.400 0.700 0.700 peak 213 spectrum 1 weight 0.10000E+01 volume 0.50598E-02 ppm1 4.533 ppm2 4.399 CV 1
ASSI { 215}
(( segid "SUPF" and resid 35 and name HB ))
(( segid "SUPF" and resid 83 and name HB1 ))
4.200 2.200 1.800 peak 215 spectrum 1 weight 0.10000E+01 volume 0.77975E-03 ppm1 4.528 ppm2 2.548 CV 1
ASSI { 216}
(( segid "SUPF" and resid 35 and name HB ))
( segid "SUPF" and resid 89 and name HB% )
3.500 1.500 1.500 peak 216 spectrum 1 weight 0.10000E+01 volume 0.18263E-02 ppm1 4.526 ppm2 1.553 CV 1
ASSI { 218}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 82 and name HA ))
4.400 2.400 1.600 peak 218 spectrum 1 weight 0.10000E+01 volume 0.70747E-03 ppm1 0.817 ppm2 5.098 CV 1
ASSI { 219}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 86 and name HA ))
2.400 0.700 0.700 peak 219 spectrum 1 weight 0.10000E+01 volume 0.63988E-02 ppm1 0.813 ppm2 4.029 CV 1
ASSI { 220}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 86 and name HD2 ))
3.500 1.500 1.500 peak 220 spectrum 1 weight 0.10000E+01 volume 0.13461E-02 ppm1 0.812 ppm2 2.983 CV 1
OR { 220}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 86 and name HD1 ))
ASSI { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HB2 ))
2.600 0.800 0.800 peak 221 spectrum 1 weight 0.10000E+01 volume 0.38343E-02 ppm1 5.019 ppm2 1.394 CV 1
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HG2 ))
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HB1 ))
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HG1 ))
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HD1 ))
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 222}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HB1 ))
3.000 1.100 1.100 peak 222 spectrum 1 weight 0.10000E+01 volume 0.25489E-02 ppm1 5.017 ppm2 1.691 CV 1
ASSI { 223}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HB2 ))
2.800 1.000 1.000 peak 223 spectrum 1 weight 0.10000E+01 volume 0.15611E-02 ppm1 5.019 ppm2 1.975 CV 1
ASSI { 224}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HG1 ))
2.900 1.000 1.000 peak 224 spectrum 1 weight 0.10000E+01 volume 0.15243E-02 ppm1 5.017 ppm2 1.117 CV 1
ASSI { 225}
(( segid "SUPF" and resid 36 and name HA ))
( segid "SUPF" and resid 80 and name HD% )
4.800 2.800 1.200 peak 225 spectrum 1 weight 0.10000E+01 volume 0.24425E-03 ppm1 5.022 ppm2 7.166 CV 1
ASSI { 226}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 82 and name HA ))
2.300 0.600 0.600 peak 226 spectrum 1 weight 0.10000E+01 volume 0.64711E-02 ppm1 5.022 ppm2 5.100 CV 1
ASSI { 230}
(( segid "SUPF" and resid 36 and name HB1 ))
(( segid "SUPF" and resid 36 and name HG1 ))
3.200 1.300 1.300 peak 230 spectrum 1 weight 0.10000E+01 volume 0.16962E-02 ppm1 1.691 ppm2 1.092 CV 1
ASSI { 231}
(( segid "SUPF" and resid 36 and name HB1 ))
(( segid "SUPF" and resid 82 and name HA ))
4.400 2.400 1.600 peak 231 spectrum 1 weight 0.10000E+01 volume 0.89197E-03 ppm1 1.689 ppm2 5.099 CV 1
ASSI { 232}
(( segid "SUPF" and resid 36 and name HB1 ))
( segid "SUPF" and resid 82 and name HG2%)
3.800 1.800 1.800 peak 232 spectrum 1 weight 0.10000E+01 volume 0.17556E-02 ppm1 1.699 ppm2 1.147 CV 1
ASSI { 234}
(( segid "SUPF" and resid 36 and name HB2 ))
( segid "SUPF" and resid 32 and name HG2%)
3.900 1.900 1.900 peak 234 spectrum 1 weight 0.10000E+01 volume 0.96931E-03 ppm1 1.967 ppm2 1.095 CV 1
ASSI { 237}
(( segid "SUPF" and resid 36 and name HB2 ))
( segid "SUPF" and resid 82 and name HG2%)
2.900 1.100 1.100 peak 237 spectrum 1 weight 0.10000E+01 volume 0.21768E-02 ppm1 1.987 ppm2 1.149 CV 1
ASSI { 238}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 36 and name HA ))
3.200 1.300 1.300 peak 238 spectrum 1 weight 0.10000E+01 volume 0.22837E-02 ppm1 1.403 ppm2 5.018 CV 1
OR { 238}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 36 and name HA ))
ASSI { 241}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 36 and name HG1 ))
2.400 0.700 0.700 peak 241 spectrum 1 weight 0.10000E+01 volume 0.64578E-02 ppm1 1.401 ppm2 1.114 CV 1
OR { 241}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 36 and name HG1 ))
ASSI { 242}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 80 and name HB1 ))
3.900 1.900 1.900 peak 242 spectrum 1 weight 0.10000E+01 volume 0.69765E-03 ppm1 1.405 ppm2 2.671 CV 1
OR { 242}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 80 and name HB1 ))
ASSI { 243}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 80 and name HB2 ))
4.300 2.400 1.700 peak 243 spectrum 1 weight 0.10000E+01 volume 0.10358E-02 ppm1 1.402 ppm2 2.872 CV 1
OR { 243}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 80 and name HB2 ))
ASSI { 244}
(( segid "SUPF" and resid 36 and name HD1 ))
( segid "SUPF" and resid 80 and name HD% )
3.800 1.800 1.800 peak 244 spectrum 1 weight 0.10000E+01 volume 0.12624E-02 ppm1 1.413 ppm2 7.159 CV 1
OR { 244}
(( segid "SUPF" and resid 36 and name HD2 ))
( segid "SUPF" and resid 80 and name HD% )
ASSI { 245}
(( segid "SUPF" and resid 36 and name HD2 ))
( segid "SUPF" and resid 80 and name HE% )
4.500 2.600 1.500 peak 245 spectrum 1 weight 0.10000E+01 volume 0.45619E-03 ppm1 1.409 ppm2 7.560 CV 1
OR { 245}
(( segid "SUPF" and resid 36 and name HD1 ))
( segid "SUPF" and resid 80 and name HE% )
ASSI { 246}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 82 and name HA ))
4.000 2.000 2.000 peak 246 spectrum 1 weight 0.10000E+01 volume 0.77324E-03 ppm1 1.404 ppm2 5.095 CV 1
OR { 246}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 82 and name HA ))
ASSI { 248}
(( segid "SUPF" and resid 36 and name HE1 ))
(( segid "SUPF" and resid 36 and name HD1 ))
2.500 0.800 0.800 peak 248 spectrum 1 weight 0.10000E+01 volume 0.45004E-02 ppm1 2.476 ppm2 1.396 CV 1
OR { 248}
(( segid "SUPF" and resid 36 and name HE1 ))
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 249}
(( segid "SUPF" and resid 36 and name HE1 ))
(( segid "SUPF" and resid 36 and name HG1 ))
3.300 1.300 1.300 peak 249 spectrum 1 weight 0.10000E+01 volume 0.98166E-03 ppm1 2.468 ppm2 1.101 CV 1
ASSI { 250}
(( segid "SUPF" and resid 36 and name HE1 ))
( segid "SUPF" and resid 80 and name HD% )
3.400 1.500 1.500 peak 250 spectrum 1 weight 0.10000E+01 volume 0.93160E-03 ppm1 2.472 ppm2 7.166 CV 1
ASSI { 251}
(( segid "SUPF" and resid 36 and name HE1 ))
( segid "SUPF" and resid 80 and name HE% )
4.300 2.300 1.700 peak 251 spectrum 1 weight 0.10000E+01 volume 0.38631E-03 ppm1 2.473 ppm2 7.560 CV 1
ASSI { 252}
(( segid "SUPF" and resid 36 and name HE1 ))
( segid "SUPF" and resid 110 and name HB% )
4.500 2.500 1.500 peak 252 spectrum 1 weight 0.10000E+01 volume 0.53993E-03 ppm1 2.460 ppm2 1.487 CV 1
ASSI { 253}
(( segid "SUPF" and resid 36 and name HE2 ))
(( segid "SUPF" and resid 36 and name HD2 ))
2.600 0.800 0.800 peak 253 spectrum 1 weight 0.10000E+01 volume 0.40769E-02 ppm1 2.329 ppm2 1.397 CV 1
OR { 253}
(( segid "SUPF" and resid 36 and name HE2 ))
(( segid "SUPF" and resid 36 and name HD1 ))
ASSI { 254}
(( segid "SUPF" and resid 36 and name HE2 ))
(( segid "SUPF" and resid 36 and name HG1 ))
3.200 1.300 1.300 peak 254 spectrum 1 weight 0.10000E+01 volume 0.12283E-02 ppm1 2.327 ppm2 1.107 CV 1
ASSI { 255}
(( segid "SUPF" and resid 36 and name HE2 ))
( segid "SUPF" and resid 80 and name HD% )
3.000 1.100 1.100 peak 255 spectrum 1 weight 0.10000E+01 volume 0.11882E-02 ppm1 2.331 ppm2 7.165 CV 1
ASSI { 256}
(( segid "SUPF" and resid 36 and name HE2 ))
( segid "SUPF" and resid 80 and name HE% )
3.500 1.600 1.600 peak 256 spectrum 1 weight 0.10000E+01 volume 0.48367E-03 ppm1 2.332 ppm2 7.557 CV 1
ASSI { 257}
(( segid "SUPF" and resid 36 and name HE2 ))
( segid "SUPF" and resid 110 and name HB% )
3.400 1.500 1.500 peak 257 spectrum 1 weight 0.10000E+01 volume 0.82697E-03 ppm1 2.337 ppm2 1.487 CV 1
ASSI { 258}
(( segid "SUPF" and resid 36 and name HG1 ))
( segid "SUPF" and resid 80 and name HD% )
3.000 1.100 1.100 peak 258 spectrum 1 weight 0.10000E+01 volume 0.13374E-02 ppm1 1.114 ppm2 7.168 CV 1
ASSI { 259}
(( segid "SUPF" and resid 36 and name HG2 ))
( segid "SUPF" and resid 80 and name HD% )
3.400 1.500 1.500 peak 259 spectrum 1 weight 0.10000E+01 volume 0.77890E-03 ppm1 1.396 ppm2 7.166 CV 1
ASSI { 260}
(( segid "SUPF" and resid 37 and name HA ))
(( segid "SUPF" and resid 37 and name HB ))
2.800 1.000 1.000 peak 260 spectrum 1 weight 0.10000E+01 volume 0.23926E-02 ppm1 4.262 ppm2 1.786 CV 1
ASSI { 261}
(( segid "SUPF" and resid 37 and name HA ))
( segid "SUPF" and resid 37 and name HD1%)
3.800 1.800 1.800 peak 261 spectrum 1 weight 0.10000E+01 volume 0.19773E-02 ppm1 4.258 ppm2 0.686 CV 1
ASSI { 262}
(( segid "SUPF" and resid 37 and name HA ))
(( segid "SUPF" and resid 37 and name HG11))
3.000 1.100 1.100 peak 262 spectrum 1 weight 0.10000E+01 volume 0.19288E-02 ppm1 4.260 ppm2 1.638 CV 1
ASSI { 264}
(( segid "SUPF" and resid 37 and name HA ))
( segid "SUPF" and resid 37 and name HG2%)
2.400 0.700 0.700 peak 264 spectrum 1 weight 0.10000E+01 volume 0.54812E-02 ppm1 4.256 ppm2 0.720 CV 1
ASSI { 265}
(( segid "SUPF" and resid 37 and name HA ))
(( segid "SUPF" and resid 109 and name HA ))
2.300 0.700 0.700 peak 265 spectrum 1 weight 0.10000E+01 volume 0.56841E-02 ppm1 4.255 ppm2 4.474 CV 1
ASSI { 269}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 37 and name HB ))
2.600 0.900 0.900 peak 269 spectrum 1 weight 0.10000E+01 volume 0.34729E-02 ppm1 0.681 ppm2 1.786 CV 1
ASSI { 270}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 37 and name HG11))
2.400 0.700 0.700 peak 270 spectrum 1 weight 0.10000E+01 volume 0.54947E-02 ppm1 0.683 ppm2 1.637 CV 1
ASSI { 271}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 55 and name HD% )
3.200 1.200 1.200 peak 271 spectrum 1 weight 0.10000E+01 volume 0.13999E-02 ppm1 0.685 ppm2 7.831 CV 1
ASSI { 272}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 55 and name HE% )
2.800 1.000 1.000 peak 272 spectrum 1 weight 0.10000E+01 volume 0.21144E-02 ppm1 0.680 ppm2 7.323 CV 1
ASSI { 273}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 55 and name HZ ))
4.700 2.700 1.300 peak 273 spectrum 1 weight 0.10000E+01 volume 0.30435E-03 ppm1 0.674 ppm2 7.201 CV 1
ASSI { 274}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 58 and name HD% )
5.000 3.100 1.000 peak 274 spectrum 1 weight 0.10000E+01 volume 0.22482E-03 ppm1 0.680 ppm2 7.380 CV 1
ASSI { 275}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 81 and name HB ))
3.100 1.200 1.200 peak 275 spectrum 1 weight 0.10000E+01 volume 0.17185E-02 ppm1 0.689 ppm2 1.178 CV 1
ASSI { 277}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 83 and name HB2 ))
3.700 1.700 1.700 peak 277 spectrum 1 weight 0.10000E+01 volume 0.15748E-02 ppm1 0.679 ppm2 2.018 CV 1
ASSI { 278}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 83 and name HE% )
3.400 1.500 1.500 peak 278 spectrum 1 weight 0.10000E+01 volume 0.16304E-02 ppm1 0.684 ppm2 1.938 CV 1
ASSI { 279}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 83 and name HG1 ))
2.900 1.100 1.100 peak 279 spectrum 1 weight 0.10000E+01 volume 0.20938E-02 ppm1 0.684 ppm2 2.260 CV 1
ASSI { 280}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 89 and name HA ))
2.400 0.700 0.700 peak 280 spectrum 1 weight 0.10000E+01 volume 0.49011E-02 ppm1 0.684 ppm2 4.099 CV 1
ASSI { 281}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 89 and name HB% )
2.600 0.800 0.800 peak 281 spectrum 1 weight 0.10000E+01 volume 0.45271E-02 ppm1 0.683 ppm2 1.549 CV 1
ASSI { 282}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 92 and name HB% )
2.200 0.600 0.600 peak 282 spectrum 1 weight 0.10000E+01 volume 0.88070E-02 ppm1 0.683 ppm2 1.436 CV 1
ASSI { 285}
(( segid "SUPF" and resid 37 and name HG11))
(( segid "SUPF" and resid 37 and name HG12))
2.000 0.500 0.500 peak 285 spectrum 1 weight 0.10000E+01 volume 0.55514E-02 ppm1 1.640 ppm2 0.602 CV 1
ASSI { 286}
(( segid "SUPF" and resid 37 and name HG11))
( segid "SUPF" and resid 39 and name HG2%)
3.600 3.600 2.400 peak 286 spectrum 1 weight 0.10000E+01 volume 0.20066E-02 ppm1 1.631 ppm2 0.718 CV 1
ASSI { 287}
(( segid "SUPF" and resid 37 and name HG12))
(( segid "SUPF" and resid 37 and name HA ))
2.700 0.900 0.900 peak 287 spectrum 1 weight 0.10000E+01 volume 0.19678E-02 ppm1 0.610 ppm2 4.255 CV 1
ASSI { 288}
(( segid "SUPF" and resid 37 and name HG12))
(( segid "SUPF" and resid 37 and name HB ))
3.400 1.400 1.400 peak 288 spectrum 1 weight 0.10000E+01 volume 0.12420E-02 ppm1 0.609 ppm2 1.786 CV 1
ASSI { 290}
(( segid "SUPF" and resid 37 and name HG12))
( segid "SUPF" and resid 39 and name HG2%)
3.400 3.400 2.600 peak 290 spectrum 1 weight 0.10000E+01 volume 0.32729E-02 ppm1 0.617 ppm2 0.716 CV 1
ASSI { 291}
(( segid "SUPF" and resid 37 and name HG12))
(( segid "SUPF" and resid 109 and name HA ))
3.500 1.500 1.500 peak 291 spectrum 1 weight 0.10000E+01 volume 0.55914E-03 ppm1 0.616 ppm2 4.477 CV 1
ASSI { 292}
(( segid "SUPF" and resid 37 and name HG12))
( segid "SUPF" and resid 109 and name HD2%)
2.600 0.800 0.800 peak 292 spectrum 1 weight 0.10000E+01 volume 0.25647E-02 ppm1 0.615 ppm2 0.846 CV 1
ASSI { 294}
( segid "SUPF" and resid 37 and name HG2%)
( segid "SUPF" and resid 55 and name HD% )
4.300 2.300 1.700 peak 294 spectrum 1 weight 0.10000E+01 volume 0.51717E-03 ppm1 0.721 ppm2 7.834 CV 1
ASSI { 295}
( segid "SUPF" and resid 37 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
2.900 1.100 1.100 peak 295 spectrum 1 weight 0.10000E+01 volume 0.20705E-02 ppm1 0.723 ppm2 7.323 CV 1
ASSI { 296}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 55 and name HZ ))
3.400 1.400 1.400 peak 296 spectrum 1 weight 0.10000E+01 volume 0.13074E-02 ppm1 0.722 ppm2 7.199 CV 1
ASSI { 297}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 107 and name HA ))
3.600 1.600 1.600 peak 297 spectrum 1 weight 0.10000E+01 volume 0.12951E-02 ppm1 0.723 ppm2 5.364 CV 1
ASSI { 298}
(( segid "SUPF" and resid 38 and name HA ))
(( segid "SUPF" and resid 38 and name HB2 ))
2.600 0.800 0.800 peak 298 spectrum 1 weight 0.10000E+01 volume 0.34037E-02 ppm1 4.742 ppm2 3.009 CV 1
OR { 298}
(( segid "SUPF" and resid 38 and name HA ))
(( segid "SUPF" and resid 38 and name HB1 ))
ASSI { 299}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
2.700 0.900 0.900 peak 299 spectrum 1 weight 0.10000E+01 volume 0.33767E-02 ppm1 4.739 ppm2 6.993 CV 1
ASSI { 300}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 38 and name HE% )
4.600 2.600 1.400 peak 300 spectrum 1 weight 0.10000E+01 volume 0.44381E-03 ppm1 4.740 ppm2 6.919 CV 1
ASSI { 301}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 39 and name HG2%)
3.700 1.700 1.700 peak 301 spectrum 1 weight 0.10000E+01 volume 0.87751E-03 ppm1 4.737 ppm2 0.711 CV 1
ASSI { 302}
(( segid "SUPF" and resid 38 and name HA ))
(( segid "SUPF" and resid 80 and name HA ))
2.800 1.000 1.000 peak 302 spectrum 1 weight 0.10000E+01 volume 0.23609E-02 ppm1 4.740 ppm2 5.847 CV 1
ASSI { 303}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 80 and name HD% )
2.600 0.800 0.800 peak 303 spectrum 1 weight 0.10000E+01 volume 0.30510E-02 ppm1 4.741 ppm2 7.166 CV 1
ASSI { 304}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 80 and name HE% )
3.400 1.400 1.400 peak 304 spectrum 1 weight 0.10000E+01 volume 0.11428E-02 ppm1 4.742 ppm2 7.558 CV 1
ASSI { 305}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 110 and name HB% )
3.900 1.900 1.900 peak 305 spectrum 1 weight 0.10000E+01 volume 0.71012E-03 ppm1 4.740 ppm2 1.484 CV 1
ASSI { 306}
(( segid "SUPF" and resid 38 and name HB2 ))
( segid "SUPF" and resid 80 and name HD% )
3.500 1.600 1.600 peak 306 spectrum 1 weight 0.10000E+01 volume 0.10759E-02 ppm1 3.004 ppm2 7.164 CV 1
OR { 306}
(( segid "SUPF" and resid 38 and name HB1 ))
( segid "SUPF" and resid 80 and name HD% )
ASSI { 307}
(( segid "SUPF" and resid 38 and name HB2 ))
(( segid "SUPF" and resid 110 and name HA ))
2.600 0.800 0.800 peak 307 spectrum 1 weight 0.10000E+01 volume 0.41746E-02 ppm1 3.006 ppm2 4.142 CV 1
OR { 307}
(( segid "SUPF" and resid 38 and name HB1 ))
(( segid "SUPF" and resid 110 and name HA ))
ASSI { 308}
(( segid "SUPF" and resid 38 and name HB1 ))
( segid "SUPF" and resid 38 and name HD% )
2.400 0.700 0.700 peak 308 spectrum 1 weight 0.10000E+01 volume 0.51297E-02 ppm1 3.041 ppm2 6.994 CV 1
ASSI { 310}
(( segid "SUPF" and resid 38 and name HB2 ))
( segid "SUPF" and resid 38 and name HD% )
2.500 0.800 0.800 peak 310 spectrum 1 weight 0.10000E+01 volume 0.52090E-02 ppm1 2.983 ppm2 6.994 CV 1
ASSI { 313}
( segid "SUPF" and resid 38 and name HD% )
( segid "SUPF" and resid 80 and name HE% )
2.600 0.900 0.900 peak 313 spectrum 1 weight 0.10000E+01 volume 0.25997E-02 ppm1 6.999 ppm2 7.557 CV 1
ASSI { 317}
( segid "SUPF" and resid 38 and name HE% )
(( segid "SUPF" and resid 38 and name HB1 ))
4.400 2.400 1.600 peak 317 spectrum 1 weight 0.10000E+01 volume 0.71457E-03 ppm1 6.942 ppm2 3.004 CV 1
OR { 317}
( segid "SUPF" and resid 38 and name HE% )
(( segid "SUPF" and resid 38 and name HB2 ))
ASSI { 324}
(( segid "SUPF" and resid 39 and name HA ))
(( segid "SUPF" and resid 39 and name HB ))
2.900 1.000 1.000 peak 324 spectrum 1 weight 0.10000E+01 volume 0.20475E-02 ppm1 4.531 ppm2 1.584 CV 1
ASSI { 325}
(( segid "SUPF" and resid 39 and name HA ))
( segid "SUPF" and resid 39 and name HG1%)
2.400 0.700 0.700 peak 325 spectrum 1 weight 0.10000E+01 volume 0.50944E-02 ppm1 4.530 ppm2 0.744 CV 1
ASSI { 326}
(( segid "SUPF" and resid 39 and name HA ))
( segid "SUPF" and resid 39 and name HG2%)
2.400 0.700 0.700 peak 326 spectrum 1 weight 0.10000E+01 volume 0.48875E-02 ppm1 4.528 ppm2 0.711 CV 1
ASSI { 327}
(( segid "SUPF" and resid 39 and name HA ))
( segid "SUPF" and resid 107 and name HG1%)
3.400 1.500 1.500 peak 327 spectrum 1 weight 0.10000E+01 volume 0.15024E-02 ppm1 4.521 ppm2 1.089 CV 1
ASSI { 328}
(( segid "SUPF" and resid 39 and name HA ))
( segid "SUPF" and resid 107 and name HG2%)
3.000 1.100 1.100 peak 328 spectrum 1 weight 0.10000E+01 volume 0.20726E-02 ppm1 4.530 ppm2 1.035 CV 1
ASSI { 330}
(( segid "SUPF" and resid 39 and name HB ))
( segid "SUPF" and resid 39 and name HG1%)
2.200 0.600 0.600 peak 330 spectrum 1 weight 0.10000E+01 volume 0.84649E-02 ppm1 1.586 ppm2 0.743 CV 1
ASSI { 331}
(( segid "SUPF" and resid 39 and name HB ))
( segid "SUPF" and resid 39 and name HG2%)
2.100 0.600 0.600 peak 331 spectrum 1 weight 0.10000E+01 volume 0.87745E-02 ppm1 1.586 ppm2 0.713 CV 1
ASSI { 332}
( segid "SUPF" and resid 39 and name HG2%)
( segid "SUPF" and resid 55 and name HD% )
3.700 1.700 1.700 peak 332 spectrum 1 weight 0.10000E+01 volume 0.14253E-02 ppm1 0.719 ppm2 7.831 CV 1
OR { 332}
( segid "SUPF" and resid 39 and name HG1%)
( segid "SUPF" and resid 55 and name HD% )
ASSI { 333}
( segid "SUPF" and resid 39 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
2.400 0.700 0.700 peak 333 spectrum 1 weight 0.10000E+01 volume 0.71006E-02 ppm1 0.724 ppm2 7.323 CV 1
OR { 333}
( segid "SUPF" and resid 39 and name HG1%)
( segid "SUPF" and resid 55 and name HE% )
ASSI { 334}
( segid "SUPF" and resid 39 and name HG2%)
(( segid "SUPF" and resid 55 and name HZ ))
2.400 0.700 0.700 peak 334 spectrum 1 weight 0.10000E+01 volume 0.50942E-02 ppm1 0.721 ppm2 7.199 CV 1
OR { 334}
( segid "SUPF" and resid 39 and name HG1%)
(( segid "SUPF" and resid 55 and name HZ ))
ASSI { 335}
( segid "SUPF" and resid 39 and name HG1%)
(( segid "SUPF" and resid 78 and name HA ))
4.100 2.100 1.900 peak 335 spectrum 1 weight 0.10000E+01 volume 0.11859E-02 ppm1 0.736 ppm2 5.193 CV 1
OR { 335}
( segid "SUPF" and resid 39 and name HG2%)
(( segid "SUPF" and resid 78 and name HA ))
ASSI { 336}
( segid "SUPF" and resid 39 and name HG2%)
(( segid "SUPF" and resid 80 and name HA ))
3.100 1.200 1.200 peak 336 spectrum 1 weight 0.10000E+01 volume 0.15340E-02 ppm1 0.716 ppm2 5.846 CV 1
OR { 336}
( segid "SUPF" and resid 39 and name HG1%)
(( segid "SUPF" and resid 80 and name HA ))
ASSI { 337}
( segid "SUPF" and resid 39 and name HG2%)
(( segid "SUPF" and resid 107 and name HA ))
3.000 1.100 1.100 peak 337 spectrum 1 weight 0.10000E+01 volume 0.24268E-02 ppm1 0.727 ppm2 5.364 CV 1
OR { 337}
( segid "SUPF" and resid 39 and name HG1%)
(( segid "SUPF" and resid 107 and name HA ))
ASSI { 338}
( segid "SUPF" and resid 39 and name HG1%)
( segid "SUPF" and resid 100 and name HD1%)
2.300 0.600 0.600 peak 338 spectrum 1 weight 0.10000E+01 volume 0.74258E-02 ppm1 0.737 ppm2 0.222 CV 1
ASSI { 339}
( segid "SUPF" and resid 39 and name HG2%)
( segid "SUPF" and resid 81 and name HG2%)
2.100 0.600 0.600 peak 339 spectrum 1 weight 0.10000E+01 volume 0.10219E-01 ppm1 0.726 ppm2 0.403 CV 1
ASSI { 340}
(( segid "SUPF" and resid 40 and name HA1 ))
( segid "SUPF" and resid 38 and name HD% )
4.000 2.000 2.000 peak 340 spectrum 1 weight 0.10000E+01 volume 0.53866E-03 ppm1 3.756 ppm2 6.991 CV 1
ASSI { 341}
(( segid "SUPF" and resid 40 and name HA1 ))
( segid "SUPF" and resid 38 and name HE% )
2.800 1.000 1.000 peak 341 spectrum 1 weight 0.10000E+01 volume 0.19993E-02 ppm1 3.749 ppm2 6.918 CV 1
ASSI { 344}
(( segid "SUPF" and resid 40 and name HA2 ))
( segid "SUPF" and resid 38 and name HE% )
3.700 1.700 1.700 peak 344 spectrum 1 weight 0.10000E+01 volume 0.12260E-02 ppm1 4.601 ppm2 6.917 CV 1
ASSI { 345}
(( segid "SUPF" and resid 40 and name HA2 ))
(( segid "SUPF" and resid 40 and name HA1 ))
2.100 0.500 0.500 peak 345 spectrum 1 weight 0.10000E+01 volume 0.50717E-02 ppm1 4.606 ppm2 3.751 CV 1
ASSI { 347}
(( segid "SUPF" and resid 40 and name HA2 ))
(( segid "SUPF" and resid 78 and name HB1 ))
2.900 1.100 1.100 peak 347 spectrum 1 weight 0.10000E+01 volume 0.10834E-02 ppm1 4.615 ppm2 2.952 CV 1
ASSI { 348}
(( segid "SUPF" and resid 40 and name HA2 ))
(( segid "SUPF" and resid 78 and name HB2 ))
2.700 0.900 0.900 peak 348 spectrum 1 weight 0.10000E+01 volume 0.19470E-02 ppm1 4.607 ppm2 3.239 CV 1
ASSI { 349}
(( segid "SUPF" and resid 40 and name HA2 ))
( segid "SUPF" and resid 78 and name HD% )
5.000 3.100 1.000 peak 349 spectrum 1 weight 0.10000E+01 volume 0.37625E-03 ppm1 4.597 ppm2 6.737 CV 1
ASSI { 350}
(( segid "SUPF" and resid 41 and name HA1 ))
(( segid "SUPF" and resid 41 and name HA2 ))
2.000 0.500 0.500 peak 350 spectrum 1 weight 0.10000E+01 volume 0.83131E-02 ppm1 4.021 ppm2 3.733 CV 1
ASSI { 352}
(( segid "SUPF" and resid 41 and name HA2 ))
( segid "SUPF" and resid 105 and name HB% )
5.200 3.300 0.800 peak 352 spectrum 1 weight 0.10000E+01 volume 0.41893E-03 ppm1 3.722 ppm2 1.279 CV 1
ASSI { 354}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 42 and name HB2 ))
3.300 1.300 1.300 peak 354 spectrum 1 weight 0.10000E+01 volume 0.13492E-02 ppm1 4.305 ppm2 1.012 CV 1
ASSI { 356}
(( segid "SUPF" and resid 42 and name HA ))
( segid "SUPF" and resid 42 and name HD2%)
2.200 0.600 0.600 peak 356 spectrum 1 weight 0.10000E+01 volume 0.73325E-02 ppm1 4.302 ppm2 0.645 CV 1
ASSI { 357}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 43 and name HD1 ))
2.200 0.600 0.600 peak 357 spectrum 1 weight 0.10000E+01 volume 0.41671E-02 ppm1 4.301 ppm2 3.610 CV 1
ASSI { 358}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 43 and name HD2 ))
2.600 0.900 0.900 peak 358 spectrum 1 weight 0.10000E+01 volume 0.35590E-02 ppm1 4.297 ppm2 3.824 CV 1
ASSI { 359}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 43 and name HG1 ))
4.500 2.500 1.500 peak 359 spectrum 1 weight 0.10000E+01 volume 0.87474E-03 ppm1 4.300 ppm2 1.936 CV 1
ASSI { 360}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 43 and name HG2 ))
4.400 2.400 1.600 peak 360 spectrum 1 weight 0.10000E+01 volume 0.12621E-02 ppm1 4.302 ppm2 1.824 CV 1
ASSI { 361}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 103 and name HB2 ))
4.600 2.700 1.400 peak 361 spectrum 1 weight 0.10000E+01 volume 0.66120E-03 ppm1 4.301 ppm2 1.646 CV 1
ASSI { 362}
(( segid "SUPF" and resid 42 and name HB1 ))
(( segid "SUPF" and resid 42 and name HA ))
2.800 1.000 1.000 peak 362 spectrum 1 weight 0.10000E+01 volume 0.15434E-02 ppm1 1.262 ppm2 4.302 CV 1
ASSI { 363}
(( segid "SUPF" and resid 42 and name HB1 ))
(( segid "SUPF" and resid 42 and name HB2 ))
2.100 0.500 0.500 peak 363 spectrum 1 weight 0.10000E+01 volume 0.37155E-02 ppm1 1.259 ppm2 1.008 CV 1
ASSI { 364}
(( segid "SUPF" and resid 42 and name HB1 ))
( segid "SUPF" and resid 42 and name HD1%)
2.500 0.800 0.800 peak 364 spectrum 1 weight 0.10000E+01 volume 0.39107E-02 ppm1 1.262 ppm2 0.499 CV 1
ASSI { 365}
(( segid "SUPF" and resid 42 and name HB1 ))
( segid "SUPF" and resid 42 and name HD2%)
2.500 0.800 0.800 peak 365 spectrum 1 weight 0.10000E+01 volume 0.36524E-02 ppm1 1.265 ppm2 0.645 CV 1
ASSI { 372}
(( segid "SUPF" and resid 42 and name HB2 ))
( segid "SUPF" and resid 42 and name HD1%)
2.500 0.800 0.800 peak 372 spectrum 1 weight 0.10000E+01 volume 0.41917E-02 ppm1 1.010 ppm2 0.499 CV 1
ASSI { 373}
(( segid "SUPF" and resid 42 and name HB2 ))
( segid "SUPF" and resid 42 and name HD2%)
3.400 1.400 1.400 peak 373 spectrum 1 weight 0.10000E+01 volume 0.28535E-02 ppm1 1.008 ppm2 0.645 CV 1
ASSI { 374}
(( segid "SUPF" and resid 42 and name HB2 ))
(( segid "SUPF" and resid 43 and name HD1 ))
5.300 3.500 0.700 peak 374 spectrum 1 weight 0.10000E+01 volume 0.38410E-03 ppm1 1.008 ppm2 3.604 CV 1
ASSI { 377}
(( segid "SUPF" and resid 42 and name HB2 ))
(( segid "SUPF" and resid 77 and name HA1 ))
3.900 1.900 1.900 peak 377 spectrum 1 weight 0.10000E+01 volume 0.75083E-03 ppm1 1.007 ppm2 3.286 CV 1
ASSI { 378}
(( segid "SUPF" and resid 42 and name HB2 ))
(( segid "SUPF" and resid 77 and name HA2 ))
3.100 1.200 1.200 peak 378 spectrum 1 weight 0.10000E+01 volume 0.78143E-03 ppm1 1.011 ppm2 4.077 CV 1
ASSI { 379}
(( segid "SUPF" and resid 42 and name HB2 ))
(( segid "SUPF" and resid 78 and name HA ))
3.200 1.300 1.300 peak 379 spectrum 1 weight 0.10000E+01 volume 0.50911E-03 ppm1 1.003 ppm2 5.197 CV 1
ASSI { 381}
( segid "SUPF" and resid 42 and name HD1%)
(( segid "SUPF" and resid 42 and name HA ))
3.800 1.800 1.800 peak 381 spectrum 1 weight 0.10000E+01 volume 0.17634E-02 ppm1 0.504 ppm2 4.300 CV 1
ASSI { 382}
( segid "SUPF" and resid 42 and name HD1%)
(( segid "SUPF" and resid 43 and name HD2 ))
4.200 2.200 1.800 peak 382 spectrum 1 weight 0.10000E+01 volume 0.69445E-03 ppm1 0.503 ppm2 3.822 CV 1
ASSI { 384}
( segid "SUPF" and resid 42 and name HD1%)
(( segid "SUPF" and resid 78 and name HA ))
2.400 0.700 0.700 peak 384 spectrum 1 weight 0.10000E+01 volume 0.36714E-02 ppm1 0.506 ppm2 5.196 CV 1
ASSI { 386}
( segid "SUPF" and resid 42 and name HD2%)
(( segid "SUPF" and resid 43 and name HD2 ))
3.000 1.100 1.100 peak 386 spectrum 1 weight 0.10000E+01 volume 0.24036E-02 ppm1 0.643 ppm2 3.825 CV 1
ASSI { 387}
( segid "SUPF" and resid 42 and name HD2%)
(( segid "SUPF" and resid 46 and name HB ))
3.400 1.400 1.400 peak 387 spectrum 1 weight 0.10000E+01 volume 0.23330E-02 ppm1 0.641 ppm2 3.685 CV 1
ASSI { 388}
(( segid "SUPF" and resid 43 and name HA ))
(( segid "SUPF" and resid 43 and name HB2 ))
2.800 1.000 1.000 peak 388 spectrum 1 weight 0.10000E+01 volume 0.47138E-02 ppm1 4.384 ppm2 1.651 CV 1
ASSI { 393}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 42 and name HB1 ))
3.300 1.400 1.400 peak 393 spectrum 1 weight 0.10000E+01 volume 0.21990E-02 ppm1 3.601 ppm2 1.275 CV 1
ASSI { 394}
(( segid "SUPF" and resid 43 and name HD1 ))
( segid "SUPF" and resid 42 and name HD1%)
5.200 3.300 0.800 peak 394 spectrum 1 weight 0.10000E+01 volume 0.47310E-03 ppm1 3.603 ppm2 0.484 CV 1
ASSI { 395}
(( segid "SUPF" and resid 43 and name HD1 ))
( segid "SUPF" and resid 42 and name HD2%)
3.400 1.400 1.400 peak 395 spectrum 1 weight 0.10000E+01 volume 0.21564E-02 ppm1 3.609 ppm2 0.644 CV 1
ASSI { 396}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HA ))
3.700 1.700 1.700 peak 396 spectrum 1 weight 0.10000E+01 volume 0.53738E-03 ppm1 3.610 ppm2 4.387 CV 1
ASSI { 397}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HB2 ))
3.600 1.600 1.600 peak 397 spectrum 1 weight 0.10000E+01 volume 0.18209E-02 ppm1 3.608 ppm2 1.649 CV 1
ASSI { 398}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HD2 ))
2.000 0.500 0.500 peak 398 spectrum 1 weight 0.10000E+01 volume 0.50628E-02 ppm1 3.607 ppm2 3.825 CV 1
ASSI { 399}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HG1 ))
2.400 0.700 0.700 peak 399 spectrum 1 weight 0.10000E+01 volume 0.34372E-02 ppm1 3.601 ppm2 1.933 CV 1
ASSI { 400}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HG2 ))
2.900 1.000 1.000 peak 400 spectrum 1 weight 0.10000E+01 volume 0.29979E-02 ppm1 3.614 ppm2 1.820 CV 1
ASSI { 401}
(( segid "SUPF" and resid 43 and name HD1 ))
( segid "SUPF" and resid 46 and name HG2%)
4.900 3.100 1.100 peak 401 spectrum 1 weight 0.10000E+01 volume 0.48285E-03 ppm1 3.597 ppm2 1.129 CV 1
ASSI { 402}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 101 and name HB1 ))
3.800 1.800 1.800 peak 402 spectrum 1 weight 0.10000E+01 volume 0.48222E-03 ppm1 3.601 ppm2 2.197 CV 1
ASSI { 404}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 42 and name HB1 ))
2.600 0.800 0.800 peak 404 spectrum 1 weight 0.10000E+01 volume 0.18604E-02 ppm1 3.826 ppm2 1.270 CV 1
ASSI { 405}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 42 and name HB2 ))
4.400 2.400 1.600 peak 405 spectrum 1 weight 0.10000E+01 volume 0.70716E-03 ppm1 3.822 ppm2 1.012 CV 1
ASSI { 408}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 43 and name HA ))
4.000 2.000 2.000 peak 408 spectrum 1 weight 0.10000E+01 volume 0.55014E-03 ppm1 3.819 ppm2 4.381 CV 1
ASSI { 409}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 43 and name HB1 ))
4.200 2.200 1.800 peak 409 spectrum 1 weight 0.10000E+01 volume 0.75174E-03 ppm1 3.827 ppm2 2.050 CV 1
ASSI { 410}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 43 and name HB2 ))
3.200 1.300 1.300 peak 410 spectrum 1 weight 0.10000E+01 volume 0.13081E-02 ppm1 3.824 ppm2 1.649 CV 1
ASSI { 414}
(( segid "SUPF" and resid 43 and name HD2 ))
( segid "SUPF" and resid 46 and name HG2%)
3.700 1.700 1.700 peak 414 spectrum 1 weight 0.10000E+01 volume 0.68638E-03 ppm1 3.819 ppm2 1.127 CV 1
ASSI { 415}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 101 and name HB1 ))
3.700 1.700 1.700 peak 415 spectrum 1 weight 0.10000E+01 volume 0.52037E-03 ppm1 3.824 ppm2 2.197 CV 1
ASSI { 417}
(( segid "SUPF" and resid 44 and name HA ))
(( segid "SUPF" and resid 44 and name HB2 ))
2.900 1.100 1.100 peak 417 spectrum 1 weight 0.10000E+01 volume 0.35276E-02 ppm1 4.159 ppm2 3.014 CV 1
ASSI { 419}
(( segid "SUPF" and resid 44 and name HA ))
( segid "SUPF" and resid 44 and name HE% )
4.500 2.500 1.500 peak 419 spectrum 1 weight 0.10000E+01 volume 0.61549E-03 ppm1 4.157 ppm2 6.821 CV 1
ASSI { 420}
(( segid "SUPF" and resid 44 and name HB1 ))
(( segid "SUPF" and resid 44 and name HA ))
2.400 0.700 0.700 peak 420 spectrum 1 weight 0.10000E+01 volume 0.51104E-02 ppm1 3.234 ppm2 4.150 CV 1
ASSI { 421}
(( segid "SUPF" and resid 44 and name HB1 ))
(( segid "SUPF" and resid 44 and name HB2 ))
1.900 0.400 0.400 peak 421 spectrum 1 weight 0.10000E+01 volume 0.10648E-01 ppm1 3.238 ppm2 3.015 CV 1
ASSI { 422}
(( segid "SUPF" and resid 44 and name HB1 ))
( segid "SUPF" and resid 44 and name HD% )
2.800 1.000 1.000 peak 422 spectrum 1 weight 0.10000E+01 volume 0.27307E-02 ppm1 3.239 ppm2 7.160 CV 1
ASSI { 423}
(( segid "SUPF" and resid 44 and name HB1 ))
(( segid "SUPF" and resid 75 and name HB1 ))
4.300 2.300 1.700 peak 423 spectrum 1 weight 0.10000E+01 volume 0.57304E-03 ppm1 3.243 ppm2 3.947 CV 1
ASSI { 426}
(( segid "SUPF" and resid 44 and name HB2 ))
( segid "SUPF" and resid 44 and name HD% )
2.700 0.900 0.900 peak 426 spectrum 1 weight 0.10000E+01 volume 0.30128E-02 ppm1 3.014 ppm2 7.160 CV 1
ASSI { 427}
(( segid "SUPF" and resid 44 and name HB2 ))
( segid "SUPF" and resid 44 and name HE% )
4.800 2.900 1.200 peak 427 spectrum 1 weight 0.10000E+01 volume 0.50571E-03 ppm1 3.012 ppm2 6.822 CV 1
ASSI { 429}
( segid "SUPF" and resid 44 and name HD% )
(( segid "SUPF" and resid 44 and name HA ))
2.600 0.800 0.800 peak 429 spectrum 1 weight 0.10000E+01 volume 0.50009E-02 ppm1 7.160 ppm2 4.156 CV 1
ASSI { 432}
( segid "SUPF" and resid 44 and name HD% )
( segid "SUPF" and resid 44 and name HE% )
1.900 0.400 0.400 peak 432 spectrum 1 weight 0.10000E+01 volume 0.26640E-01 ppm1 7.158 ppm2 6.822 CV 1
ASSI { 433}
( segid "SUPF" and resid 44 and name HD% )
(( segid "SUPF" and resid 75 and name HB1 ))
3.700 1.700 1.700 peak 433 spectrum 1 weight 0.10000E+01 volume 0.12839E-02 ppm1 7.160 ppm2 3.948 CV 1
ASSI { 435}
( segid "SUPF" and resid 44 and name HE% )
(( segid "SUPF" and resid 45 and name HD2 ))
2.800 2.800 3.200 peak 435 spectrum 1 weight 0.10000E+01 volume 0.13171E-02 ppm1 6.831 ppm2 6.979 CV 1
ASSI { 436}
(( segid "SUPF" and resid 45 and name HA ))
(( segid "SUPF" and resid 45 and name HB1 ))
2.500 0.800 0.800 peak 436 spectrum 1 weight 0.10000E+01 volume 0.53782E-02 ppm1 4.669 ppm2 2.912 CV 1
ASSI { 437}
(( segid "SUPF" and resid 45 and name HA ))
(( segid "SUPF" and resid 45 and name HB2 ))
2.700 0.900 0.900 peak 437 spectrum 1 weight 0.10000E+01 volume 0.53721E-02 ppm1 4.671 ppm2 3.350 CV 1
ASSI { 438}
(( segid "SUPF" and resid 45 and name HA ))
(( segid "SUPF" and resid 45 and name HD2 ))
6.000 6.000 0.000 peak 438 spectrum 1 weight 0.10000E+01 volume 0.19404E-04 ppm1 4.699 ppm2 6.977 CV 1
ASSI { 440}
(( segid "SUPF" and resid 45 and name HB1 ))
(( segid "SUPF" and resid 45 and name HB2 ))
2.000 0.500 0.500 peak 440 spectrum 1 weight 0.10000E+01 volume 0.93305E-02 ppm1 2.914 ppm2 3.349 CV 1
ASSI { 441}
(( segid "SUPF" and resid 45 and name HB1 ))
(( segid "SUPF" and resid 45 and name HD2 ))
3.400 1.400 1.400 peak 441 spectrum 1 weight 0.10000E+01 volume 0.10362E-02 ppm1 2.908 ppm2 6.975 CV 1
ASSI { 442}
(( segid "SUPF" and resid 45 and name HB2 ))
( segid "SUPF" and resid 44 and name HD% )
5.200 3.400 0.800 peak 442 spectrum 1 weight 0.10000E+01 volume 0.23865E-03 ppm1 3.352 ppm2 7.170 CV 1
ASSI { 445}
(( segid "SUPF" and resid 45 and name HB2 ))
(( segid "SUPF" and resid 45 and name HD2 ))
3.400 1.400 1.400 peak 445 spectrum 1 weight 0.10000E+01 volume 0.13704E-02 ppm1 3.351 ppm2 6.976 CV 1
ASSI { 448}
(( segid "SUPF" and resid 45 and name HE1 ))
(( segid "SUPF" and resid 43 and name HB1 ))
4.300 2.300 1.700 peak 448 spectrum 1 weight 0.10000E+01 volume 0.42009E-03 ppm1 7.963 ppm2 2.049 CV 1
ASSI { 449}
(( segid "SUPF" and resid 45 and name HE1 ))
(( segid "SUPF" and resid 43 and name HB2 ))
4.000 2.000 2.000 peak 449 spectrum 1 weight 0.10000E+01 volume 0.53686E-03 ppm1 7.960 ppm2 1.657 CV 1
ASSI { 450}
(( segid "SUPF" and resid 46 and name HA ))
(( segid "SUPF" and resid 45 and name HD2 ))
3.000 3.000 3.000 peak 450 spectrum 1 weight 0.10000E+01 volume 0.89353E-03 ppm1 4.054 ppm2 6.974 CV 1
ASSI { 451}
(( segid "SUPF" and resid 46 and name HA ))
(( segid "SUPF" and resid 46 and name HB ))
2.800 1.000 1.000 peak 451 spectrum 1 weight 0.10000E+01 volume 0.27354E-02 ppm1 4.050 ppm2 3.687 CV 1
ASSI { 453}
(( segid "SUPF" and resid 46 and name HA ))
( segid "SUPF" and resid 50 and name HG2%)
3.300 1.300 1.300 peak 453 spectrum 1 weight 0.10000E+01 volume 0.17927E-02 ppm1 4.050 ppm2 1.288 CV 1
ASSI { 454}
(( segid "SUPF" and resid 46 and name HB ))
( segid "SUPF" and resid 66 and name HG1%)
3.600 1.600 1.600 peak 454 spectrum 1 weight 0.10000E+01 volume 0.61344E-03 ppm1 3.690 ppm2 0.756 CV 1
ASSI { 455}
(( segid "SUPF" and resid 46 and name HB ))
(( segid "SUPF" and resid 42 and name HB1 ))
2.600 0.900 0.900 peak 455 spectrum 1 weight 0.10000E+01 volume 0.25616E-02 ppm1 3.689 ppm2 1.269 CV 1
ASSI { 456}
(( segid "SUPF" and resid 46 and name HB ))
(( segid "SUPF" and resid 42 and name HB2 ))
3.600 1.600 1.600 peak 456 spectrum 1 weight 0.10000E+01 volume 0.12002E-02 ppm1 3.685 ppm2 1.012 CV 1
ASSI { 457}
(( segid "SUPF" and resid 46 and name HB ))
( segid "SUPF" and resid 42 and name HD1%)
3.000 1.100 1.100 peak 457 spectrum 1 weight 0.10000E+01 volume 0.26017E-02 ppm1 3.687 ppm2 0.499 CV 1
ASSI { 460}
(( segid "SUPF" and resid 46 and name HB ))
( segid "SUPF" and resid 46 and name HG2%)
2.200 0.600 0.600 peak 460 spectrum 1 weight 0.10000E+01 volume 0.97328E-02 ppm1 3.686 ppm2 1.132 CV 1
ASSI { 462}
( segid "SUPF" and resid 46 and name HG2%)
(( segid "SUPF" and resid 46 and name HA ))
2.200 0.600 0.600 peak 462 spectrum 1 weight 0.10000E+01 volume 0.90684E-02 ppm1 1.136 ppm2 4.053 CV 1
ASSI { 464}
( segid "SUPF" and resid 46 and name HG2%)
(( segid "SUPF" and resid 101 and name HB1 ))
3.800 1.800 1.800 peak 464 spectrum 1 weight 0.10000E+01 volume 0.10496E-02 ppm1 1.138 ppm2 2.199 CV 1
ASSI { 465}
( segid "SUPF" and resid 46 and name HG2%)
(( segid "SUPF" and resid 101 and name HB2 ))
3.500 1.600 1.600 peak 465 spectrum 1 weight 0.10000E+01 volume 0.77144E-03 ppm1 1.134 ppm2 2.998 CV 1
ASSI { 466}
(( segid "SUPF" and resid 47 and name HA ))
( segid "SUPF" and resid 46 and name HG2%)
3.900 1.900 1.900 peak 466 spectrum 1 weight 0.10000E+01 volume 0.60031E-03 ppm1 4.869 ppm2 1.134 CV 1
ASSI { 467}
(( segid "SUPF" and resid 47 and name HA ))
(( segid "SUPF" and resid 47 and name HB1 ))
2.200 0.600 0.600 peak 467 spectrum 1 weight 0.10000E+01 volume 0.82101E-02 ppm1 4.862 ppm2 3.982 CV 1
ASSI { 468}
(( segid "SUPF" and resid 47 and name HA ))
(( segid "SUPF" and resid 47 and name HB2 ))
2.500 0.800 0.800 peak 468 spectrum 1 weight 0.10000E+01 volume 0.88793E-02 ppm1 4.861 ppm2 4.422 CV 1
ASSI { 469}
(( segid "SUPF" and resid 47 and name HA ))
(( segid "SUPF" and resid 66 and name HB ))
3.500 1.500 1.500 peak 469 spectrum 1 weight 0.10000E+01 volume 0.66669E-03 ppm1 4.861 ppm2 1.876 CV 1
ASSI { 470}
(( segid "SUPF" and resid 47 and name HA ))
( segid "SUPF" and resid 66 and name HG1%)
3.700 1.700 1.700 peak 470 spectrum 1 weight 0.10000E+01 volume 0.93028E-03 ppm1 4.866 ppm2 0.759 CV 1
ASSI { 473}
(( segid "SUPF" and resid 47 and name HB1 ))
(( segid "SUPF" and resid 47 and name HB2 ))
1.700 0.400 0.500 peak 473 spectrum 1 weight 0.10000E+01 volume 0.13924E-01 ppm1 3.982 ppm2 4.421 CV 1
ASSI { 474}
(( segid "SUPF" and resid 47 and name HB1 ))
( segid "SUPF" and resid 66 and name HG2%)
4.400 2.400 1.600 peak 474 spectrum 1 weight 0.10000E+01 volume 0.54059E-03 ppm1 3.966 ppm2 0.630 CV 1
ASSI { 477}
(( segid "SUPF" and resid 47 and name HB2 ))
( segid "SUPF" and resid 66 and name HG2%)
3.900 1.900 1.900 peak 477 spectrum 1 weight 0.10000E+01 volume 0.83251E-03 ppm1 4.433 ppm2 0.635 CV 1
ASSI { 478}
(( segid "SUPF" and resid 48 and name HA ))
(( segid "SUPF" and resid 48 and name HB1 ))
2.300 0.700 0.700 peak 478 spectrum 1 weight 0.10000E+01 volume 0.55243E-02 ppm1 4.017 ppm2 2.965 CV 1
ASSI { 479}
(( segid "SUPF" and resid 48 and name HA ))
(( segid "SUPF" and resid 48 and name HB2 ))
2.600 0.800 0.800 peak 479 spectrum 1 weight 0.10000E+01 volume 0.38634E-02 ppm1 4.017 ppm2 2.762 CV 1
ASSI { 481}
(( segid "SUPF" and resid 48 and name HA ))
( segid "SUPF" and resid 66 and name HG2%)
2.400 0.700 0.700 peak 481 spectrum 1 weight 0.10000E+01 volume 0.45053E-02 ppm1 4.016 ppm2 0.629 CV 1
ASSI { 483}
(( segid "SUPF" and resid 48 and name HB1 ))
(( segid "SUPF" and resid 48 and name HB2 ))
1.800 0.400 0.400 peak 483 spectrum 1 weight 0.10000E+01 volume 0.11013E-01 ppm1 2.970 ppm2 2.763 CV 1
ASSI { 484}
(( segid "SUPF" and resid 48 and name HB1 ))
( segid "SUPF" and resid 66 and name HG2%)
4.000 2.000 2.000 peak 484 spectrum 1 weight 0.10000E+01 volume 0.10783E-02 ppm1 2.975 ppm2 0.632 CV 1
ASSI { 487}
(( segid "SUPF" and resid 48 and name HB2 ))
( segid "SUPF" and resid 66 and name HG2%)
5.100 3.300 0.900 peak 487 spectrum 1 weight 0.10000E+01 volume 0.48638E-03 ppm1 2.763 ppm2 0.629 CV 1
ASSI { 488}
(( segid "SUPF" and resid 49 and name HA ))
(( segid "SUPF" and resid 52 and name HB1 ))
2.700 0.900 0.900 peak 488 spectrum 1 weight 0.10000E+01 volume 0.22704E-02 ppm1 4.147 ppm2 3.507 CV 1
ASSI { 489}
(( segid "SUPF" and resid 49 and name HA ))
(( segid "SUPF" and resid 52 and name HB2 ))
3.500 1.500 1.500 peak 489 spectrum 1 weight 0.10000E+01 volume 0.25461E-02 ppm1 4.147 ppm2 3.571 CV 1
ASSI { 490}
(( segid "SUPF" and resid 49 and name HB1 ))
(( segid "SUPF" and resid 49 and name HA ))
2.300 0.700 0.700 peak 490 spectrum 1 weight 0.10000E+01 volume 0.72427E-02 ppm1 1.908 ppm2 4.140 CV 1
ASSI { 491}
(( segid "SUPF" and resid 49 and name HB2 ))
(( segid "SUPF" and resid 49 and name HA ))
2.400 0.700 0.700 peak 491 spectrum 1 weight 0.10000E+01 volume 0.56871E-02 ppm1 1.828 ppm2 4.144 CV 1
ASSI { 492}
(( segid "SUPF" and resid 50 and name HA ))
( segid "SUPF" and resid 46 and name HG2%)
4.300 2.300 1.700 peak 492 spectrum 1 weight 0.10000E+01 volume 0.11573E-02 ppm1 4.163 ppm2 1.131 CV 1
ASSI { 493}
(( segid "SUPF" and resid 50 and name HA ))
(( segid "SUPF" and resid 50 and name HB ))
2.400 0.700 0.700 peak 493 spectrum 1 weight 0.10000E+01 volume 0.76535E-02 ppm1 4.156 ppm2 4.453 CV 1
ASSI { 494}
(( segid "SUPF" and resid 50 and name HA ))
( segid "SUPF" and resid 50 and name HG2%)
2.300 0.700 0.700 peak 494 spectrum 1 weight 0.10000E+01 volume 0.92781E-02 ppm1 4.156 ppm2 1.287 CV 1
ASSI { 495}
(( segid "SUPF" and resid 50 and name HA ))
(( segid "SUPF" and resid 53 and name HB1 ))
2.700 0.900 0.900 peak 495 spectrum 1 weight 0.10000E+01 volume 0.23259E-02 ppm1 4.152 ppm2 2.088 CV 1
ASSI { 500}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 42 and name HD2%)
2.900 2.900 3.100 peak 500 spectrum 1 weight 0.10000E+01 volume 0.41469E-02 ppm1 4.173 ppm2 0.654 CV 1
ASSI { 501}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 50 and name HG2%)
3.200 1.300 1.300 peak 501 spectrum 1 weight 0.10000E+01 volume 0.12898E-02 ppm1 4.181 ppm2 1.287 CV 1
ASSI { 502}
(( segid "SUPF" and resid 51 and name HA ))
(( segid "SUPF" and resid 51 and name HB2 ))
2.200 0.600 0.600 peak 502 spectrum 1 weight 0.10000E+01 volume 0.67331E-02 ppm1 4.177 ppm2 1.582 CV 1
ASSI { 504}
(( segid "SUPF" and resid 51 and name HA ))
(( segid "SUPF" and resid 54 and name HB1 ))
3.100 1.200 1.200 peak 504 spectrum 1 weight 0.10000E+01 volume 0.87576E-03 ppm1 4.180 ppm2 2.840 CV 1
ASSI { 505}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 55 and name HD% )
3.400 1.500 1.500 peak 505 spectrum 1 weight 0.10000E+01 volume 0.94208E-03 ppm1 4.176 ppm2 7.831 CV 1
ASSI { 507}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 100 and name HD1%)
3.700 1.700 1.700 peak 507 spectrum 1 weight 0.10000E+01 volume 0.71024E-03 ppm1 4.179 ppm2 0.224 CV 1
ASSI { 508}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 100 and name HG2%)
3.100 1.200 1.200 peak 508 spectrum 1 weight 0.10000E+01 volume 0.13265E-02 ppm1 4.176 ppm2 0.473 CV 1
ASSI { 509}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 46 and name HG2%)
3.900 1.900 1.900 peak 509 spectrum 1 weight 0.10000E+01 volume 0.13150E-02 ppm1 1.742 ppm2 1.133 CV 1
ASSI { 510}
(( segid "SUPF" and resid 51 and name HB1 ))
(( segid "SUPF" and resid 48 and name HA ))
2.800 1.000 1.000 peak 510 spectrum 1 weight 0.10000E+01 volume 0.16235E-02 ppm1 1.742 ppm2 4.015 CV 1
ASSI { 511}
(( segid "SUPF" and resid 51 and name HB1 ))
(( segid "SUPF" and resid 51 and name HA ))
3.000 1.100 1.100 peak 511 spectrum 1 weight 0.10000E+01 volume 0.27667E-02 ppm1 1.738 ppm2 4.173 CV 1
ASSI { 512}
(( segid "SUPF" and resid 51 and name HB1 ))
(( segid "SUPF" and resid 51 and name HB2 ))
1.700 0.300 0.500 peak 512 spectrum 1 weight 0.10000E+01 volume 0.14132E-01 ppm1 1.736 ppm2 1.576 CV 1
ASSI { 513}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 51 and name HD1%)
2.900 1.100 1.100 peak 513 spectrum 1 weight 0.10000E+01 volume 0.55961E-02 ppm1 1.749 ppm2 0.837 CV 1
ASSI { 514}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 51 and name HD2%)
2.400 0.700 0.700 peak 514 spectrum 1 weight 0.10000E+01 volume 0.49501E-02 ppm1 1.744 ppm2 0.654 CV 1
ASSI { 515}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 55 and name HD% )
4.200 2.300 1.800 peak 515 spectrum 1 weight 0.10000E+01 volume 0.58087E-03 ppm1 1.741 ppm2 7.833 CV 1
ASSI { 516}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 64 and name HB% )
2.900 1.100 1.100 peak 516 spectrum 1 weight 0.10000E+01 volume 0.18481E-02 ppm1 1.745 ppm2 1.342 CV 1
ASSI { 517}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 81 and name HG2%)
3.600 1.600 1.600 peak 517 spectrum 1 weight 0.10000E+01 volume 0.18265E-02 ppm1 1.745 ppm2 0.403 CV 1
ASSI { 518}
(( segid "SUPF" and resid 51 and name HB2 ))
( segid "SUPF" and resid 46 and name HG2%)
2.800 1.000 1.000 peak 518 spectrum 1 weight 0.10000E+01 volume 0.19202E-02 ppm1 1.583 ppm2 1.132 CV 1
ASSI { 521}
(( segid "SUPF" and resid 51 and name HB2 ))
( segid "SUPF" and resid 51 and name HD1%)
2.400 0.700 0.700 peak 521 spectrum 1 weight 0.10000E+01 volume 0.37397E-02 ppm1 1.580 ppm2 0.835 CV 1
ASSI { 522}
(( segid "SUPF" and resid 51 and name HB2 ))
( segid "SUPF" and resid 51 and name HD2%)
2.300 0.600 0.600 peak 522 spectrum 1 weight 0.10000E+01 volume 0.74698E-02 ppm1 1.565 ppm2 0.653 CV 1
ASSI { 524}
(( segid "SUPF" and resid 51 and name HG ))
(( segid "SUPF" and resid 48 and name HA ))
3.600 3.600 2.400 peak 524 spectrum 1 weight 0.10000E+01 volume 0.14456E-02 ppm1 1.573 ppm2 4.010 CV 1
ASSI { 525}
(( segid "SUPF" and resid 51 and name HG ))
( segid "SUPF" and resid 64 and name HB% )
3.000 1.100 1.100 peak 525 spectrum 1 weight 0.10000E+01 volume 0.17366E-02 ppm1 1.577 ppm2 1.342 CV 1
ASSI { 526}
( segid "SUPF" and resid 51 and name HD1%)
(( segid "SUPF" and resid 51 and name HA ))
2.300 0.600 0.600 peak 526 spectrum 1 weight 0.10000E+01 volume 0.61127E-02 ppm1 0.836 ppm2 4.173 CV 1
ASSI { 527}
( segid "SUPF" and resid 51 and name HD1%)
( segid "SUPF" and resid 55 and name HD% )
2.800 1.000 1.000 peak 527 spectrum 1 weight 0.10000E+01 volume 0.24695E-02 ppm1 0.837 ppm2 7.832 CV 1
ASSI { 528}
( segid "SUPF" and resid 51 and name HD1%)
( segid "SUPF" and resid 55 and name HE% )
2.400 0.700 0.700 peak 528 spectrum 1 weight 0.10000E+01 volume 0.46537E-02 ppm1 0.837 ppm2 7.323 CV 1
ASSI { 529}
( segid "SUPF" and resid 51 and name HD1%)
(( segid "SUPF" and resid 55 and name HZ ))
4.100 2.100 1.900 peak 529 spectrum 1 weight 0.10000E+01 volume 0.94028E-03 ppm1 0.838 ppm2 7.198 CV 1
ASSI { 530}
( segid "SUPF" and resid 51 and name HD2%)
(( segid "SUPF" and resid 51 and name HA ))
3.300 1.400 1.400 peak 530 spectrum 1 weight 0.10000E+01 volume 0.41855E-02 ppm1 0.649 ppm2 4.172 CV 1
ASSI { 531}
( segid "SUPF" and resid 51 and name HD2%)
( segid "SUPF" and resid 55 and name HD% )
4.100 2.100 1.900 peak 531 spectrum 1 weight 0.10000E+01 volume 0.10048E-02 ppm1 0.662 ppm2 7.833 CV 1
ASSI { 532}
( segid "SUPF" and resid 51 and name HD2%)
( segid "SUPF" and resid 55 and name HE% )
3.600 1.700 1.700 peak 532 spectrum 1 weight 0.10000E+01 volume 0.19486E-02 ppm1 0.664 ppm2 7.324 CV 1
ASSI { 534}
(( segid "SUPF" and resid 51 and name HG ))
( segid "SUPF" and resid 55 and name HD% )
3.400 1.400 1.400 peak 534 spectrum 1 weight 0.10000E+01 volume 0.63699E-03 ppm1 1.582 ppm2 7.831 CV 1
ASSI { 535}
(( segid "SUPF" and resid 52 and name HA ))
(( segid "SUPF" and resid 52 and name HB1 ))
2.800 1.000 1.000 peak 535 spectrum 1 weight 0.10000E+01 volume 0.43692E-02 ppm1 3.823 ppm2 3.508 CV 1
ASSI { 536}
(( segid "SUPF" and resid 52 and name HA ))
(( segid "SUPF" and resid 52 and name HB2 ))
2.400 0.700 0.700 peak 536 spectrum 1 weight 0.10000E+01 volume 0.44231E-02 ppm1 3.825 ppm2 3.573 CV 1
ASSI { 537}
(( segid "SUPF" and resid 52 and name HA ))
(( segid "SUPF" and resid 52 and name HD2 ))
3.400 1.400 1.400 peak 537 spectrum 1 weight 0.10000E+01 volume 0.10108E-02 ppm1 3.825 ppm2 7.247 CV 1
ASSI { 538}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 55 and name HD% )
4.100 2.100 1.900 peak 538 spectrum 1 weight 0.10000E+01 volume 0.45195E-03 ppm1 3.814 ppm2 7.833 CV 1
ASSI { 539}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
3.400 1.500 1.500 peak 539 spectrum 1 weight 0.10000E+01 volume 0.78228E-03 ppm1 3.827 ppm2 1.493 CV 1
OR { 539}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 61 and name HG2%)
OR { 539}
(( segid "SUPF" and resid 52 and name HA ))
(( segid "SUPF" and resid 61 and name HG11))
ASSI { 540}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
2.400 0.700 0.700 peak 540 spectrum 1 weight 0.10000E+01 volume 0.54897E-02 ppm1 3.821 ppm2 0.413 CV 1
ASSI { 541}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 61 and name HG2%)
3.300 1.400 1.400 peak 541 spectrum 1 weight 0.10000E+01 volume 0.19611E-02 ppm1 3.815 ppm2 0.580 CV 1
ASSI { 542}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 64 and name HB% )
2.500 0.800 0.800 peak 542 spectrum 1 weight 0.10000E+01 volume 0.38284E-02 ppm1 3.822 ppm2 1.343 CV 1
ASSI { 543}
(( segid "SUPF" and resid 52 and name HB1 ))
(( segid "SUPF" and resid 49 and name HA ))
2.700 0.900 0.900 peak 543 spectrum 1 weight 0.10000E+01 volume 0.33201E-02 ppm1 3.544 ppm2 4.144 CV 1
OR { 543}
(( segid "SUPF" and resid 52 and name HB2 ))
(( segid "SUPF" and resid 49 and name HA ))
ASSI { 544}
(( segid "SUPF" and resid 52 and name HB2 ))
(( segid "SUPF" and resid 52 and name HA ))
2.400 0.700 0.700 peak 544 spectrum 1 weight 0.10000E+01 volume 0.64344E-02 ppm1 3.547 ppm2 3.819 CV 1
OR { 544}
(( segid "SUPF" and resid 52 and name HB1 ))
(( segid "SUPF" and resid 52 and name HA ))
ASSI { 545}
(( segid "SUPF" and resid 52 and name HB2 ))
( segid "SUPF" and resid 61 and name HD1%)
3.800 1.800 1.800 peak 545 spectrum 1 weight 0.10000E+01 volume 0.99750E-03 ppm1 3.546 ppm2 0.412 CV 1
OR { 545}
(( segid "SUPF" and resid 52 and name HB1 ))
( segid "SUPF" and resid 61 and name HD1%)
ASSI { 546}
(( segid "SUPF" and resid 52 and name HB2 ))
( segid "SUPF" and resid 64 and name HB% )
2.600 0.800 0.800 peak 546 spectrum 1 weight 0.10000E+01 volume 0.32595E-02 ppm1 3.524 ppm2 1.343 CV 1
OR { 546}
(( segid "SUPF" and resid 52 and name HB1 ))
( segid "SUPF" and resid 64 and name HB% )
ASSI { 547}
(( segid "SUPF" and resid 52 and name HB1 ))
(( segid "SUPF" and resid 52 and name HD2 ))
3.400 1.400 1.400 peak 547 spectrum 1 weight 0.10000E+01 volume 0.24585E-02 ppm1 3.521 ppm2 7.246 CV 1
ASSI { 550}
(( segid "SUPF" and resid 52 and name HD2 ))
(( segid "SUPF" and resid 52 and name HB2 ))
3.300 1.400 1.400 peak 550 spectrum 1 weight 0.10000E+01 volume 0.62139E-03 ppm1 7.246 ppm2 3.564 CV 1
ASSI { 555}
(( segid "SUPF" and resid 52 and name HE1 ))
( segid "SUPF" and resid 61 and name HD1%)
4.000 2.000 2.000 peak 555 spectrum 1 weight 0.10000E+01 volume 0.43750E-03 ppm1 8.485 ppm2 0.415 CV 1
ASSI { 556}
(( segid "SUPF" and resid 53 and name HA ))
(( segid "SUPF" and resid 53 and name HB1 ))
2.500 0.800 0.800 peak 556 spectrum 1 weight 0.10000E+01 volume 0.87835E-02 ppm1 4.090 ppm2 2.086 CV 1
ASSI { 557}
(( segid "SUPF" and resid 53 and name HA ))
(( segid "SUPF" and resid 53 and name HB2 ))
2.500 0.800 0.800 peak 557 spectrum 1 weight 0.10000E+01 volume 0.36841E-02 ppm1 4.078 ppm2 2.254 CV 1
ASSI { 559}
(( segid "SUPF" and resid 53 and name HA ))
(( segid "SUPF" and resid 53 and name HG2 ))
2.800 1.000 1.000 peak 559 spectrum 1 weight 0.10000E+01 volume 0.40547E-02 ppm1 4.089 ppm2 2.613 CV 1
ASSI { 562}
(( segid "SUPF" and resid 53 and name HB1 ))
(( segid "SUPF" and resid 53 and name HG2 ))
2.600 0.800 0.800 peak 562 spectrum 1 weight 0.10000E+01 volume 0.38509E-02 ppm1 2.101 ppm2 2.616 CV 1
ASSI { 563}
(( segid "SUPF" and resid 53 and name HB2 ))
(( segid "SUPF" and resid 50 and name HA ))
2.900 1.000 1.000 peak 563 spectrum 1 weight 0.10000E+01 volume 0.46567E-02 ppm1 2.259 ppm2 4.155 CV 1
ASSI { 565}
(( segid "SUPF" and resid 53 and name HB2 ))
(( segid "SUPF" and resid 53 and name HG2 ))
2.800 1.000 1.000 peak 565 spectrum 1 weight 0.10000E+01 volume 0.38438E-02 ppm1 2.263 ppm2 2.620 CV 1
ASSI { 566}
(( segid "SUPF" and resid 53 and name HG1 ))
(( segid "SUPF" and resid 50 and name HA ))
4.000 2.000 2.000 peak 566 spectrum 1 weight 0.10000E+01 volume 0.11896E-02 ppm1 2.328 ppm2 4.155 CV 1
ASSI { 567}
(( segid "SUPF" and resid 53 and name HG1 ))
(( segid "SUPF" and resid 53 and name HA ))
2.600 0.800 0.800 peak 567 spectrum 1 weight 0.10000E+01 volume 0.49401E-02 ppm1 2.331 ppm2 4.089 CV 1
ASSI { 568}
(( segid "SUPF" and resid 53 and name HG1 ))
(( segid "SUPF" and resid 53 and name HG2 ))
1.800 0.400 0.400 peak 568 spectrum 1 weight 0.10000E+01 volume 0.15748E-01 ppm1 2.340 ppm2 2.621 CV 1
ASSI { 569}
(( segid "SUPF" and resid 53 and name HG2 ))
(( segid "SUPF" and resid 50 and name HA ))
3.900 1.900 1.900 peak 569 spectrum 1 weight 0.10000E+01 volume 0.12328E-02 ppm1 2.622 ppm2 4.151 CV 1
ASSI { 571}
(( segid "SUPF" and resid 54 and name HA ))
(( segid "SUPF" and resid 54 and name HB1 ))
3.200 1.300 1.300 peak 571 spectrum 1 weight 0.10000E+01 volume 0.22458E-02 ppm1 4.126 ppm2 2.837 CV 1
ASSI { 572}
(( segid "SUPF" and resid 54 and name HA ))
(( segid "SUPF" and resid 54 and name HB2 ))
2.600 0.800 0.800 peak 572 spectrum 1 weight 0.10000E+01 volume 0.35378E-02 ppm1 4.127 ppm2 3.221 CV 1
ASSI { 573}
(( segid "SUPF" and resid 54 and name HA ))
( segid "SUPF" and resid 54 and name HD% )
2.900 1.000 1.000 peak 573 spectrum 1 weight 0.10000E+01 volume 0.26147E-02 ppm1 4.127 ppm2 6.274 CV 1
ASSI { 574}
(( segid "SUPF" and resid 54 and name HA ))
( segid "SUPF" and resid 54 and name HE% )
4.100 2.100 1.900 peak 574 spectrum 1 weight 0.10000E+01 volume 0.87185E-03 ppm1 4.121 ppm2 6.477 CV 1
ASSI { 577}
(( segid "SUPF" and resid 54 and name HB1 ))
( segid "SUPF" and resid 54 and name HD% )
2.700 0.900 0.900 peak 577 spectrum 1 weight 0.10000E+01 volume 0.22824E-02 ppm1 2.841 ppm2 6.275 CV 1
ASSI { 579}
(( segid "SUPF" and resid 54 and name HB1 ))
( segid "SUPF" and resid 55 and name HD% )
3.200 1.300 1.300 peak 579 spectrum 1 weight 0.10000E+01 volume 0.77065E-03 ppm1 2.833 ppm2 7.832 CV 1
ASSI { 583}
(( segid "SUPF" and resid 54 and name HB2 ))
(( segid "SUPF" and resid 54 and name HB1 ))
1.900 0.400 0.400 peak 583 spectrum 1 weight 0.10000E+01 volume 0.86462E-02 ppm1 3.220 ppm2 2.847 CV 1
ASSI { 584}
(( segid "SUPF" and resid 54 and name HB2 ))
( segid "SUPF" and resid 54 and name HD% )
2.800 1.000 1.000 peak 584 spectrum 1 weight 0.10000E+01 volume 0.23615E-02 ppm1 3.223 ppm2 6.274 CV 1
ASSI { 586}
(( segid "SUPF" and resid 54 and name HB2 ))
( segid "SUPF" and resid 55 and name HD% )
5.300 3.600 0.700 peak 586 spectrum 1 weight 0.10000E+01 volume 0.38686E-03 ppm1 3.209 ppm2 7.832 CV 1
ASSI { 592}
( segid "SUPF" and resid 54 and name HD% )
( segid "SUPF" and resid 54 and name HE% )
2.200 0.600 0.600 peak 592 spectrum 1 weight 0.10000E+01 volume 0.95220E-02 ppm1 6.272 ppm2 6.478 CV 1
ASSI { 593}
( segid "SUPF" and resid 54 and name HD% )
( segid "SUPF" and resid 55 and name HD% )
3.300 1.300 1.300 peak 593 spectrum 1 weight 0.10000E+01 volume 0.87239E-03 ppm1 6.276 ppm2 7.833 CV 1
ASSI { 594}
( segid "SUPF" and resid 54 and name HD% )
( segid "SUPF" and resid 55 and name HE% )
3.400 1.400 1.400 peak 594 spectrum 1 weight 0.10000E+01 volume 0.76475E-03 ppm1 6.270 ppm2 7.326 CV 1
ASSI { 595}
( segid "SUPF" and resid 54 and name HD% )
( segid "SUPF" and resid 58 and name HE% )
3.500 1.500 1.500 peak 595 spectrum 1 weight 0.10000E+01 volume 0.75698E-03 ppm1 6.256 ppm2 7.001 CV 1
ASSI { 599}
( segid "SUPF" and resid 54 and name HE% )
(( segid "SUPF" and resid 54 and name HB1 ))
4.400 2.400 1.600 peak 599 spectrum 1 weight 0.10000E+01 volume 0.77963E-03 ppm1 6.475 ppm2 2.840 CV 1
ASSI { 600}
( segid "SUPF" and resid 54 and name HE% )
(( segid "SUPF" and resid 54 and name HB2 ))
4.300 2.300 1.700 peak 600 spectrum 1 weight 0.10000E+01 volume 0.84462E-03 ppm1 6.479 ppm2 3.223 CV 1
ASSI { 603}
( segid "SUPF" and resid 54 and name HE% )
( segid "SUPF" and resid 55 and name HD% )
4.300 2.300 1.700 peak 603 spectrum 1 weight 0.10000E+01 volume 0.61404E-03 ppm1 6.479 ppm2 7.834 CV 1
ASSI { 604}
( segid "SUPF" and resid 54 and name HE% )
( segid "SUPF" and resid 55 and name HE% )
3.500 1.600 1.600 peak 604 spectrum 1 weight 0.10000E+01 volume 0.92805E-03 ppm1 6.497 ppm2 7.321 CV 1
ASSI { 605}
( segid "SUPF" and resid 54 and name HE% )
( segid "SUPF" and resid 58 and name HE% )
2.800 1.000 1.000 peak 605 spectrum 1 weight 0.10000E+01 volume 0.26405E-02 ppm1 6.479 ppm2 7.005 CV 1
ASSI { 606}
( segid "SUPF" and resid 54 and name HE% )
(( segid "SUPF" and resid 58 and name HZ ))
3.400 1.400 1.400 peak 606 spectrum 1 weight 0.10000E+01 volume 0.11339E-02 ppm1 6.481 ppm2 7.283 CV 1
ASSI { 608}
( segid "SUPF" and resid 54 and name HE% )
(( segid "SUPF" and resid 98 and name HB2 ))
3.500 1.600 1.600 peak 608 spectrum 1 weight 0.10000E+01 volume 0.81896E-03 ppm1 6.481 ppm2 1.550 CV 1
ASSI { 613}
(( segid "SUPF" and resid 88 and name HA ))
(( segid "SUPF" and resid 91 and name HB1 ))
3.100 1.200 1.200 peak 613 spectrum 1 weight 0.10000E+01 volume 0.12469E-02 ppm1 4.328 ppm2 2.333 CV 1
ASSI { 614}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 54 and name HD% )
3.400 1.500 1.500 peak 614 spectrum 1 weight 0.10000E+01 volume 0.70409E-03 ppm1 4.327 ppm2 6.275 CV 1
ASSI { 615}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 54 and name HE% )
4.300 2.300 1.700 peak 615 spectrum 1 weight 0.10000E+01 volume 0.34496E-03 ppm1 4.312 ppm2 6.480 CV 1
ASSI { 618}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 55 and name HD% )
2.900 1.000 1.000 peak 618 spectrum 1 weight 0.10000E+01 volume 0.24334E-02 ppm1 4.317 ppm2 7.832 CV 1
ASSI { 619}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 58 and name HD% )
2.300 0.700 0.700 peak 619 spectrum 1 weight 0.10000E+01 volume 0.59797E-02 ppm1 4.321 ppm2 7.373 CV 1
ASSI { 620}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 58 and name HE% )
2.800 1.000 1.000 peak 620 spectrum 1 weight 0.10000E+01 volume 0.25078E-02 ppm1 4.318 ppm2 7.003 CV 1
ASSI { 621}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
3.900 1.900 1.900 peak 621 spectrum 1 weight 0.10000E+01 volume 0.84595E-03 ppm1 4.317 ppm2 0.412 CV 1
ASSI { 622}
(( segid "SUPF" and resid 55 and name HB1 ))
(( segid "SUPF" and resid 55 and name HA ))
2.700 0.900 0.900 peak 622 spectrum 1 weight 0.10000E+01 volume 0.18661E-02 ppm1 2.914 ppm2 4.319 CV 1
ASSI { 623}
(( segid "SUPF" and resid 55 and name HB1 ))
(( segid "SUPF" and resid 55 and name HB2 ))
2.000 0.500 0.500 peak 623 spectrum 1 weight 0.10000E+01 volume 0.53182E-02 ppm1 2.931 ppm2 3.286 CV 1
ASSI { 624}
(( segid "SUPF" and resid 55 and name HB1 ))
( segid "SUPF" and resid 55 and name HD% )
2.500 0.800 0.800 peak 624 spectrum 1 weight 0.10000E+01 volume 0.34435E-02 ppm1 2.923 ppm2 7.831 CV 1
ASSI { 626}
(( segid "SUPF" and resid 55 and name HB1 ))
( segid "SUPF" and resid 81 and name HG2%)
3.100 1.200 1.200 peak 626 spectrum 1 weight 0.10000E+01 volume 0.35709E-02 ppm1 2.927 ppm2 0.411 CV 1
ASSI { 627}
(( segid "SUPF" and resid 55 and name HB2 ))
(( segid "SUPF" and resid 55 and name HA ))
3.000 1.100 1.100 peak 627 spectrum 1 weight 0.10000E+01 volume 0.19196E-02 ppm1 3.290 ppm2 4.320 CV 1
ASSI { 628}
(( segid "SUPF" and resid 55 and name HB2 ))
( segid "SUPF" and resid 55 and name HD% )
2.600 0.900 0.900 peak 628 spectrum 1 weight 0.10000E+01 volume 0.33243E-02 ppm1 3.288 ppm2 7.832 CV 1
ASSI { 629}
(( segid "SUPF" and resid 55 and name HB2 ))
( segid "SUPF" and resid 58 and name HD% )
4.300 2.300 1.700 peak 629 spectrum 1 weight 0.10000E+01 volume 0.85884E-03 ppm1 3.291 ppm2 7.373 CV 1
ASSI { 630}
(( segid "SUPF" and resid 55 and name HB2 ))
( segid "SUPF" and resid 81 and name HG1%)
2.800 1.000 1.000 peak 630 spectrum 1 weight 0.10000E+01 volume 0.19397E-02 ppm1 3.285 ppm2 0.572 CV 1
ASSI { 631}
(( segid "SUPF" and resid 55 and name HB2 ))
( segid "SUPF" and resid 81 and name HG2%)
2.600 0.900 0.900 peak 631 spectrum 1 weight 0.10000E+01 volume 0.31665E-02 ppm1 3.287 ppm2 0.412 CV 1
ASSI { 635}
( segid "SUPF" and resid 55 and name HD% )
( segid "SUPF" and resid 39 and name HG2%)
4.200 2.200 1.800 peak 635 spectrum 1 weight 0.10000E+01 volume 0.61994E-03 ppm1 7.822 ppm2 0.716 CV 1
ASSI { 645}
( segid "SUPF" and resid 55 and name HD% )
( segid "SUPF" and resid 55 and name HE% )
2.300 0.600 0.600 peak 645 spectrum 1 weight 0.10000E+01 volume 0.57900E-02 ppm1 7.829 ppm2 7.323 CV 1
ASSI { 646}
( segid "SUPF" and resid 55 and name HD% )
(( segid "SUPF" and resid 57 and name HB2 ))
4.000 2.000 2.000 peak 646 spectrum 1 weight 0.10000E+01 volume 0.68650E-03 ppm1 7.828 ppm2 1.575 CV 1
OR { 646}
( segid "SUPF" and resid 55 and name HD% )
(( segid "SUPF" and resid 57 and name HB1 ))
ASSI { 647}
( segid "SUPF" and resid 55 and name HD% )
( segid "SUPF" and resid 58 and name HD% )
2.800 1.000 1.000 peak 647 spectrum 1 weight 0.10000E+01 volume 0.25752E-02 ppm1 7.827 ppm2 7.372 CV 1
ASSI { 648}
( segid "SUPF" and resid 55 and name HD% )
( segid "SUPF" and resid 58 and name HE% )
3.500 1.500 1.500 peak 648 spectrum 1 weight 0.10000E+01 volume 0.98292E-03 ppm1 7.834 ppm2 7.005 CV 1
ASSI { 654}
( segid "SUPF" and resid 55 and name HE% )
( segid "SUPF" and resid 39 and name HG1%)
3.000 1.100 1.100 peak 654 spectrum 1 weight 0.10000E+01 volume 0.16396E-02 ppm1 7.327 ppm2 0.747 CV 1
ASSI { 655}
( segid "SUPF" and resid 55 and name HE% )
( segid "SUPF" and resid 39 and name HG2%)
2.700 0.900 0.900 peak 655 spectrum 1 weight 0.10000E+01 volume 0.34200E-02 ppm1 7.326 ppm2 0.708 CV 1
ASSI { 665}
( segid "SUPF" and resid 55 and name HE% )
( segid "SUPF" and resid 107 and name HG1%)
2.900 1.100 1.100 peak 665 spectrum 1 weight 0.10000E+01 volume 0.17512E-02 ppm1 7.324 ppm2 1.089 CV 1
ASSI { 666}
( segid "SUPF" and resid 55 and name HE% )
( segid "SUPF" and resid 107 and name HG2%)
3.700 1.700 1.700 peak 666 spectrum 1 weight 0.10000E+01 volume 0.94877E-03 ppm1 7.329 ppm2 1.038 CV 1
ASSI { 667}
(( segid "SUPF" and resid 55 and name HZ ))
(( segid "SUPF" and resid 39 and name HB ))
4.200 2.200 1.800 peak 667 spectrum 1 weight 0.10000E+01 volume 0.11505E-02 ppm1 7.202 ppm2 1.581 CV 1
ASSI { 668}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 39 and name HG1%)
3.400 1.400 1.400 peak 668 spectrum 1 weight 0.10000E+01 volume 0.11172E-02 ppm1 7.204 ppm2 0.749 CV 1
ASSI { 669}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 39 and name HG2%)
2.600 0.800 0.800 peak 669 spectrum 1 weight 0.10000E+01 volume 0.29227E-02 ppm1 7.206 ppm2 0.719 CV 1
ASSI { 670}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 54 and name HE% )
3.500 1.600 1.600 peak 670 spectrum 1 weight 0.10000E+01 volume 0.75909E-03 ppm1 7.200 ppm2 6.476 CV 1
ASSI { 671}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 55 and name HD% )
3.600 1.600 1.600 peak 671 spectrum 1 weight 0.10000E+01 volume 0.12768E-02 ppm1 7.199 ppm2 7.831 CV 1
ASSI { 672}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 81 and name HG2%)
4.000 2.000 2.000 peak 672 spectrum 1 weight 0.10000E+01 volume 0.51402E-03 ppm1 7.191 ppm2 0.403 CV 1
ASSI { 675}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 107 and name HG2%)
2.700 0.900 0.900 peak 675 spectrum 1 weight 0.10000E+01 volume 0.20761E-02 ppm1 7.200 ppm2 1.036 CV 1
ASSI { 676}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 56 and name HB1 ))
2.800 1.000 1.000 peak 676 spectrum 1 weight 0.10000E+01 volume 0.40760E-02 ppm1 4.501 ppm2 2.083 CV 1
ASSI { 677}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 56 and name HB2 ))
2.500 0.800 0.800 peak 677 spectrum 1 weight 0.10000E+01 volume 0.36095E-02 ppm1 4.493 ppm2 2.173 CV 1
ASSI { 679}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 56 and name HG2 ))
3.100 1.200 1.200 peak 679 spectrum 1 weight 0.10000E+01 volume 0.15511E-02 ppm1 4.498 ppm2 2.602 CV 1
ASSI { 680}
(( segid "SUPF" and resid 56 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
2.400 0.700 0.700 peak 680 spectrum 1 weight 0.10000E+01 volume 0.57916E-02 ppm1 4.490 ppm2 0.414 CV 1
ASSI { 681}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 61 and name HG11))
2.800 0.900 0.900 peak 681 spectrum 1 weight 0.10000E+01 volume 0.17359E-02 ppm1 4.483 ppm2 1.483 CV 1
ASSI { 682}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 61 and name HG12))
4.100 2.100 1.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.79932E-03 ppm1 4.488 ppm2 0.985 CV 1
ASSI { 683}
(( segid "SUPF" and resid 56 and name HA ))
( segid "SUPF" and resid 83 and name HE% )
3.400 1.500 1.500 peak 683 spectrum 1 weight 0.10000E+01 volume 0.13424E-02 ppm1 4.491 ppm2 1.937 CV 1
ASSI { 685}
(( segid "SUPF" and resid 56 and name HB1 ))
(( segid "SUPF" and resid 56 and name HG1 ))
3.100 1.200 1.200 peak 685 spectrum 1 weight 0.10000E+01 volume 0.26207E-02 ppm1 2.088 ppm2 2.424 CV 1
ASSI { 686}
(( segid "SUPF" and resid 56 and name HB1 ))
(( segid "SUPF" and resid 56 and name HG2 ))
2.700 0.900 0.900 peak 686 spectrum 1 weight 0.10000E+01 volume 0.28218E-02 ppm1 2.088 ppm2 2.606 CV 1
ASSI { 687}
(( segid "SUPF" and resid 56 and name HB1 ))
( segid "SUPF" and resid 61 and name HD1%)
3.800 1.800 1.800 peak 687 spectrum 1 weight 0.10000E+01 volume 0.18447E-02 ppm1 2.090 ppm2 0.415 CV 1
ASSI { 689}
(( segid "SUPF" and resid 56 and name HB2 ))
(( segid "SUPF" and resid 56 and name HG1 ))
2.600 0.800 0.800 peak 689 spectrum 1 weight 0.10000E+01 volume 0.29500E-02 ppm1 2.160 ppm2 2.430 CV 1
ASSI { 690}
(( segid "SUPF" and resid 56 and name HB2 ))
(( segid "SUPF" and resid 56 and name HG2 ))
3.100 1.200 1.200 peak 690 spectrum 1 weight 0.10000E+01 volume 0.23975E-02 ppm1 2.172 ppm2 2.608 CV 1
ASSI { 692}
(( segid "SUPF" and resid 56 and name HG1 ))
(( segid "SUPF" and resid 56 and name HA ))
3.100 1.200 1.200 peak 692 spectrum 1 weight 0.10000E+01 volume 0.13936E-02 ppm1 2.426 ppm2 4.492 CV 1
ASSI { 693}
(( segid "SUPF" and resid 56 and name HG1 ))
(( segid "SUPF" and resid 56 and name HG2 ))
1.800 0.400 0.400 peak 693 spectrum 1 weight 0.10000E+01 volume 0.13490E-01 ppm1 2.417 ppm2 2.606 CV 1
ASSI { 694}
(( segid "SUPF" and resid 56 and name HG1 ))
( segid "SUPF" and resid 61 and name HD1%)
3.300 1.300 1.300 peak 694 spectrum 1 weight 0.10000E+01 volume 0.16445E-02 ppm1 2.427 ppm2 0.412 CV 1
ASSI { 699}
(( segid "SUPF" and resid 57 and name HG1 ))
(( segid "SUPF" and resid 57 and name HA ))
3.200 1.200 1.200 peak 699 spectrum 1 weight 0.10000E+01 volume 0.22845E-02 ppm1 1.539 ppm2 4.080 CV 1
ASSI { 700}
(( segid "SUPF" and resid 57 and name HG1 ))
(( segid "SUPF" and resid 57 and name HG2 ))
2.000 0.500 0.500 peak 700 spectrum 1 weight 0.10000E+01 volume 0.70807E-02 ppm1 1.528 ppm2 0.203 CV 1
ASSI { 701}
(( segid "SUPF" and resid 57 and name HG1 ))
( segid "SUPF" and resid 58 and name HD% )
3.900 1.900 1.900 peak 701 spectrum 1 weight 0.10000E+01 volume 0.66271E-03 ppm1 1.522 ppm2 7.375 CV 1
ASSI { 702}
(( segid "SUPF" and resid 57 and name HG1 ))
( segid "SUPF" and resid 58 and name HE% )
4.000 2.000 2.000 peak 702 spectrum 1 weight 0.10000E+01 volume 0.56416E-03 ppm1 1.530 ppm2 7.005 CV 1
ASSI { 703}
(( segid "SUPF" and resid 57 and name HG1 ))
(( segid "SUPF" and resid 58 and name HZ ))
4.200 2.200 1.800 peak 703 spectrum 1 weight 0.10000E+01 volume 0.41122E-03 ppm1 1.524 ppm2 7.284 CV 1
ASSI { 705}
(( segid "SUPF" and resid 57 and name HG2 ))
(( segid "SUPF" and resid 57 and name HB2 ))
2.900 1.100 1.100 peak 705 spectrum 1 weight 0.10000E+01 volume 0.22483E-02 ppm1 0.209 ppm2 1.581 CV 1
OR { 705}
(( segid "SUPF" and resid 57 and name HG2 ))
(( segid "SUPF" and resid 57 and name HB1 ))
ASSI { 707}
(( segid "SUPF" and resid 57 and name HG2 ))
( segid "SUPF" and resid 58 and name HD% )
3.600 1.600 1.600 peak 707 spectrum 1 weight 0.10000E+01 volume 0.66235E-03 ppm1 0.204 ppm2 7.372 CV 1
ASSI { 708}
(( segid "SUPF" and resid 57 and name HG2 ))
( segid "SUPF" and resid 58 and name HE% )
3.600 1.600 1.600 peak 708 spectrum 1 weight 0.10000E+01 volume 0.64337E-03 ppm1 0.210 ppm2 7.005 CV 1
ASSI { 709}
(( segid "SUPF" and resid 57 and name HG2 ))
(( segid "SUPF" and resid 58 and name HZ ))
4.400 2.500 1.600 peak 709 spectrum 1 weight 0.10000E+01 volume 0.24774E-03 ppm1 0.211 ppm2 7.286 CV 1
ASSI { 710}
(( segid "SUPF" and resid 58 and name HA ))
(( segid "SUPF" and resid 58 and name HB1 ))
2.700 0.900 0.900 peak 710 spectrum 1 weight 0.10000E+01 volume 0.23009E-02 ppm1 4.708 ppm2 2.900 CV 1
ASSI { 711}
(( segid "SUPF" and resid 58 and name HA ))
(( segid "SUPF" and resid 58 and name HB2 ))
3.100 1.200 1.200 peak 711 spectrum 1 weight 0.10000E+01 volume 0.25076E-02 ppm1 4.708 ppm2 3.647 CV 1
ASSI { 712}
(( segid "SUPF" and resid 58 and name HA ))
( segid "SUPF" and resid 58 and name HD% )
2.500 0.800 0.800 peak 712 spectrum 1 weight 0.10000E+01 volume 0.50828E-02 ppm1 4.708 ppm2 7.375 CV 1
ASSI { 714}
(( segid "SUPF" and resid 58 and name HB1 ))
( segid "SUPF" and resid 58 and name HD% )
2.600 0.800 0.800 peak 714 spectrum 1 weight 0.10000E+01 volume 0.36251E-02 ppm1 2.907 ppm2 7.373 CV 1
ASSI { 717}
(( segid "SUPF" and resid 58 and name HB2 ))
(( segid "SUPF" and resid 58 and name HB1 ))
2.100 0.500 0.500 peak 717 spectrum 1 weight 0.10000E+01 volume 0.45013E-02 ppm1 3.645 ppm2 2.902 CV 1
ASSI { 718}
(( segid "SUPF" and resid 58 and name HB2 ))
( segid "SUPF" and resid 58 and name HD% )
2.600 0.800 0.800 peak 718 spectrum 1 weight 0.10000E+01 volume 0.30340E-02 ppm1 3.647 ppm2 7.374 CV 1
ASSI { 719}
(( segid "SUPF" and resid 58 and name HB2 ))
( segid "SUPF" and resid 83 and name HE% )
2.700 0.900 0.900 peak 719 spectrum 1 weight 0.10000E+01 volume 0.18675E-02 ppm1 3.648 ppm2 1.939 CV 1
ASSI { 720}
(( segid "SUPF" and resid 58 and name HB2 ))
(( segid "SUPF" and resid 91 and name HB1 ))
4.200 2.200 1.800 peak 720 spectrum 1 weight 0.10000E+01 volume 0.76373E-03 ppm1 3.653 ppm2 2.331 CV 1
ASSI { 732}
( segid "SUPF" and resid 58 and name HE% )
( segid "SUPF" and resid 58 and name HD% )
2.500 0.800 0.800 peak 732 spectrum 1 weight 0.10000E+01 volume 0.36034E-02 ppm1 6.999 ppm2 7.375 CV 1
ASSI { 736}
(( segid "SUPF" and resid 58 and name HZ ))
( segid "SUPF" and resid 58 and name HE% )
2.300 0.700 0.700 peak 736 spectrum 1 weight 0.10000E+01 volume 0.76240E-02 ppm1 7.283 ppm2 7.004 CV 1
ASSI { 738}
(( segid "SUPF" and resid 59 and name HA1 ))
(( segid "SUPF" and resid 59 and name HA2 ))
2.000 0.500 0.500 peak 738 spectrum 1 weight 0.10000E+01 volume 0.98340E-02 ppm1 4.534 ppm2 3.855 CV 1
ASSI { 742}
(( segid "SUPF" and resid 59 and name HA2 ))
( segid "SUPF" and resid 83 and name HE% )
4.100 2.100 1.900 peak 742 spectrum 1 weight 0.10000E+01 volume 0.85902E-03 ppm1 3.862 ppm2 1.939 CV 1
ASSI { 743}
(( segid "SUPF" and resid 60 and name HA ))
(( segid "SUPF" and resid 60 and name HB1 ))
2.600 0.900 0.900 peak 743 spectrum 1 weight 0.10000E+01 volume 0.36511E-02 ppm1 4.723 ppm2 2.528 CV 1
ASSI { 744}
(( segid "SUPF" and resid 60 and name HA ))
(( segid "SUPF" and resid 60 and name HB2 ))
2.700 0.900 0.900 peak 744 spectrum 1 weight 0.10000E+01 volume 0.52681E-02 ppm1 4.724 ppm2 2.602 CV 1
ASSI { 745}
(( segid "SUPF" and resid 60 and name HA ))
(( segid "SUPF" and resid 61 and name HG11))
3.400 1.400 1.400 peak 745 spectrum 1 weight 0.10000E+01 volume 0.92401E-03 ppm1 4.717 ppm2 1.483 CV 1
ASSI { 746}
(( segid "SUPF" and resid 60 and name HB1 ))
(( segid "SUPF" and resid 60 and name HB2 ))
1.700 0.400 0.500 peak 746 spectrum 1 weight 0.10000E+01 volume 0.19916E-01 ppm1 2.528 ppm2 2.598 CV 1
ASSI { 749}
(( segid "SUPF" and resid 61 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
3.600 1.600 1.600 peak 749 spectrum 1 weight 0.10000E+01 volume 0.23198E-02 ppm1 4.161 ppm2 0.413 CV 1
ASSI { 750}
(( segid "SUPF" and resid 61 and name HA ))
(( segid "SUPF" and resid 61 and name HG12))
2.500 0.800 0.800 peak 750 spectrum 1 weight 0.10000E+01 volume 0.27243E-02 ppm1 4.149 ppm2 0.989 CV 1
ASSI { 751}
(( segid "SUPF" and resid 61 and name HA ))
( segid "SUPF" and resid 61 and name HG2%)
2.300 0.600 0.600 peak 751 spectrum 1 weight 0.10000E+01 volume 0.61892E-02 ppm1 4.162 ppm2 0.588 CV 1
ASSI { 753}
(( segid "SUPF" and resid 61 and name HA ))
(( segid "SUPF" and resid 83 and name HA ))
2.100 0.500 0.500 peak 753 spectrum 1 weight 0.10000E+01 volume 0.80944E-02 ppm1 4.160 ppm2 5.112 CV 1
ASSI { 754}
(( segid "SUPF" and resid 61 and name HB ))
(( segid "SUPF" and resid 52 and name HD2 ))
3.400 1.400 1.400 peak 754 spectrum 1 weight 0.10000E+01 volume 0.62681E-03 ppm1 1.494 ppm2 7.246 CV 1
ASSI { 755}
(( segid "SUPF" and resid 61 and name HB ))
(( segid "SUPF" and resid 61 and name HA ))
2.700 0.900 0.900 peak 755 spectrum 1 weight 0.10000E+01 volume 0.22886E-02 ppm1 1.497 ppm2 4.161 CV 1
ASSI { 756}
(( segid "SUPF" and resid 61 and name HB ))
( segid "SUPF" and resid 61 and name HD1%)
2.400 0.700 0.700 peak 756 spectrum 1 weight 0.10000E+01 volume 0.54310E-02 ppm1 1.497 ppm2 0.414 CV 1
ASSI { 757}
(( segid "SUPF" and resid 61 and name HB ))
(( segid "SUPF" and resid 61 and name HG12))
2.900 1.100 1.100 peak 757 spectrum 1 weight 0.10000E+01 volume 0.23083E-02 ppm1 1.498 ppm2 0.992 CV 1
ASSI { 758}
(( segid "SUPF" and resid 61 and name HB ))
( segid "SUPF" and resid 61 and name HG2%)
2.100 0.500 0.500 peak 758 spectrum 1 weight 0.10000E+01 volume 0.90305E-02 ppm1 1.496 ppm2 0.589 CV 1
ASSI { 759}
(( segid "SUPF" and resid 61 and name HB ))
(( segid "SUPF" and resid 83 and name HA ))
4.900 3.000 1.100 peak 759 spectrum 1 weight 0.10000E+01 volume 0.38342E-03 ppm1 1.493 ppm2 5.111 CV 1
ASSI { 763}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 52 and name HB1 ))
4.000 2.000 2.000 peak 763 spectrum 1 weight 0.10000E+01 volume 0.74626E-03 ppm1 0.420 ppm2 3.508 CV 1
ASSI { 764}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 52 and name HB2 ))
3.900 1.900 1.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.72728E-03 ppm1 0.413 ppm2 3.569 CV 1
ASSI { 765}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 52 and name HD2 ))
3.200 1.300 1.300 peak 765 spectrum 1 weight 0.10000E+01 volume 0.13737E-02 ppm1 0.414 ppm2 7.248 CV 1
ASSI { 767}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 55 and name HB1 ))
2.600 0.800 0.800 peak 767 spectrum 1 weight 0.10000E+01 volume 0.40806E-02 ppm1 0.418 ppm2 2.923 CV 1
ASSI { 768}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 55 and name HB2 ))
2.400 0.700 0.700 peak 768 spectrum 1 weight 0.10000E+01 volume 0.33737E-02 ppm1 0.418 ppm2 3.288 CV 1
ASSI { 769}
( segid "SUPF" and resid 61 and name HD1%)
( segid "SUPF" and resid 55 and name HD% )
3.900 1.900 1.900 peak 769 spectrum 1 weight 0.10000E+01 volume 0.14770E-02 ppm1 0.418 ppm2 7.833 CV 1
ASSI { 772}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 56 and name HB2 ))
2.900 1.100 1.100 peak 772 spectrum 1 weight 0.10000E+01 volume 0.13795E-02 ppm1 0.418 ppm2 2.169 CV 1
ASSI { 774}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 56 and name HG2 ))
2.700 0.900 0.900 peak 774 spectrum 1 weight 0.10000E+01 volume 0.16465E-02 ppm1 0.417 ppm2 2.603 CV 1
ASSI { 775}
( segid "SUPF" and resid 61 and name HD1%)
( segid "SUPF" and resid 58 and name HD% )
4.500 2.500 1.500 peak 775 spectrum 1 weight 0.10000E+01 volume 0.40476E-03 ppm1 0.415 ppm2 7.378 CV 1
ASSI { 778}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 61 and name HG12))
2.300 0.600 0.600 peak 778 spectrum 1 weight 0.10000E+01 volume 0.57202E-02 ppm1 0.418 ppm2 0.987 CV 1
ASSI { 780}
( segid "SUPF" and resid 61 and name HD1%)
( segid "SUPF" and resid 83 and name HE% )
3.000 1.100 1.100 peak 780 spectrum 1 weight 0.10000E+01 volume 0.44900E-02 ppm1 0.418 ppm2 1.938 CV 1
ASSI { 782}
( segid "SUPF" and resid 61 and name HG2%)
(( segid "SUPF" and resid 52 and name HD2 ))
2.600 0.900 0.900 peak 782 spectrum 1 weight 0.10000E+01 volume 0.34118E-02 ppm1 0.593 ppm2 7.247 CV 1
ASSI { 785}
( segid "SUPF" and resid 61 and name HG2%)
(( segid "SUPF" and resid 64 and name HA ))
4.100 2.100 1.900 peak 785 spectrum 1 weight 0.10000E+01 volume 0.86884E-03 ppm1 0.592 ppm2 5.182 CV 1
ASSI { 786}
( segid "SUPF" and resid 61 and name HG2%)
(( segid "SUPF" and resid 83 and name HA ))
3.000 1.100 1.100 peak 786 spectrum 1 weight 0.10000E+01 volume 0.16522E-02 ppm1 0.590 ppm2 5.110 CV 1
ASSI { 787}
(( segid "SUPF" and resid 62 and name HA ))
(( segid "SUPF" and resid 62 and name HB1 ))
2.400 0.700 0.700 peak 787 spectrum 1 weight 0.10000E+01 volume 0.54194E-02 ppm1 4.406 ppm2 1.675 CV 1
ASSI { 788}
(( segid "SUPF" and resid 62 and name HA ))
(( segid "SUPF" and resid 62 and name HB2 ))
2.800 1.000 1.000 peak 788 spectrum 1 weight 0.10000E+01 volume 0.45985E-02 ppm1 4.412 ppm2 1.814 CV 1
ASSI { 790}
(( segid "SUPF" and resid 62 and name HA ))
( segid "SUPF" and resid 82 and name HG2%)
4.700 2.800 1.300 peak 790 spectrum 1 weight 0.10000E+01 volume 0.81101E-03 ppm1 4.409 ppm2 1.154 CV 1
ASSI { 792}
(( segid "SUPF" and resid 62 and name HB1 ))
(( segid "SUPF" and resid 62 and name HB2 ))
1.800 0.400 0.400 peak 792 spectrum 1 weight 0.10000E+01 volume 0.12952E-01 ppm1 1.685 ppm2 1.812 CV 1
ASSI { 793}
(( segid "SUPF" and resid 62 and name HB1 ))
(( segid "SUPF" and resid 82 and name HB ))
3.700 1.700 1.700 peak 793 spectrum 1 weight 0.10000E+01 volume 0.21642E-02 ppm1 1.674 ppm2 3.938 CV 1
ASSI { 794}
(( segid "SUPF" and resid 62 and name HB1 ))
( segid "SUPF" and resid 82 and name HG2%)
3.600 1.600 1.600 peak 794 spectrum 1 weight 0.10000E+01 volume 0.25181E-02 ppm1 1.678 ppm2 1.152 CV 1
ASSI { 796}
(( segid "SUPF" and resid 62 and name HB2 ))
(( segid "SUPF" and resid 82 and name HB ))
2.600 0.800 0.800 peak 796 spectrum 1 weight 0.10000E+01 volume 0.27510E-02 ppm1 1.815 ppm2 3.940 CV 1
ASSI { 797}
(( segid "SUPF" and resid 62 and name HB2 ))
( segid "SUPF" and resid 82 and name HG2%)
2.400 0.700 0.700 peak 797 spectrum 1 weight 0.10000E+01 volume 0.38140E-02 ppm1 1.818 ppm2 1.152 CV 1
ASSI { 798}
(( segid "SUPF" and resid 62 and name HG1 ))
(( segid "SUPF" and resid 62 and name HA ))
2.600 0.900 0.900 peak 798 spectrum 1 weight 0.10000E+01 volume 0.53756E-02 ppm1 2.088 ppm2 4.407 CV 1
OR { 798}
(( segid "SUPF" and resid 62 and name HG2 ))
(( segid "SUPF" and resid 62 and name HA ))
ASSI { 799}
(( segid "SUPF" and resid 62 and name HG2 ))
(( segid "SUPF" and resid 62 and name HB1 ))
2.400 0.700 0.700 peak 799 spectrum 1 weight 0.10000E+01 volume 0.79294E-02 ppm1 2.081 ppm2 1.675 CV 1
OR { 799}
(( segid "SUPF" and resid 62 and name HG1 ))
(( segid "SUPF" and resid 62 and name HB1 ))
ASSI { 800}
(( segid "SUPF" and resid 62 and name HG2 ))
(( segid "SUPF" and resid 62 and name HB2 ))
2.200 0.600 0.600 peak 800 spectrum 1 weight 0.10000E+01 volume 0.88853E-02 ppm1 2.082 ppm2 1.817 CV 1
OR { 800}
(( segid "SUPF" and resid 62 and name HG1 ))
(( segid "SUPF" and resid 62 and name HB2 ))
ASSI { 801}
(( segid "SUPF" and resid 62 and name HG2 ))
( segid "SUPF" and resid 82 and name HG2%)
2.900 1.100 1.100 peak 801 spectrum 1 weight 0.10000E+01 volume 0.36033E-02 ppm1 2.085 ppm2 1.152 CV 1
OR { 801}
(( segid "SUPF" and resid 62 and name HG1 ))
( segid "SUPF" and resid 82 and name HG2%)
ASSI { 802}
(( segid "SUPF" and resid 62 and name HG1 ))
(( segid "SUPF" and resid 84 and name HA ))
2.500 0.800 0.800 peak 802 spectrum 1 weight 0.10000E+01 volume 0.44993E-02 ppm1 2.088 ppm2 4.101 CV 1
OR { 802}
(( segid "SUPF" and resid 62 and name HG2 ))
(( segid "SUPF" and resid 84 and name HA ))
ASSI { 803}
(( segid "SUPF" and resid 63 and name HA ))
( segid "SUPF" and resid 61 and name HG2%)
2.900 1.000 1.000 peak 803 spectrum 1 weight 0.10000E+01 volume 0.26874E-02 ppm1 4.606 ppm2 0.588 CV 1
ASSI { 805}
(( segid "SUPF" and resid 63 and name HA ))
(( segid "SUPF" and resid 63 and name HG1 ))
2.600 0.800 0.800 peak 805 spectrum 1 weight 0.10000E+01 volume 0.35444E-02 ppm1 4.603 ppm2 2.208 CV 1
ASSI { 806}
(( segid "SUPF" and resid 63 and name HA ))
(( segid "SUPF" and resid 63 and name HG2 ))
2.900 1.000 1.000 peak 806 spectrum 1 weight 0.10000E+01 volume 0.48322E-02 ppm1 4.608 ppm2 2.038 CV 1
ASSI { 807}
(( segid "SUPF" and resid 63 and name HA ))
( segid "SUPF" and resid 64 and name HB% )
4.100 2.100 1.900 peak 807 spectrum 1 weight 0.10000E+01 volume 0.89100E-03 ppm1 4.607 ppm2 1.343 CV 1
ASSI { 808}
(( segid "SUPF" and resid 63 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
4.100 2.100 1.900 peak 808 spectrum 1 weight 0.10000E+01 volume 0.88052E-03 ppm1 4.607 ppm2 0.959 CV 1
ASSI { 809}
(( segid "SUPF" and resid 63 and name HB1 ))
(( segid "SUPF" and resid 63 and name HA ))
2.300 0.700 0.700 peak 809 spectrum 1 weight 0.10000E+01 volume 0.74559E-02 ppm1 2.009 ppm2 4.605 CV 1
OR { 809}
(( segid "SUPF" and resid 63 and name HB2 ))
(( segid "SUPF" and resid 63 and name HA ))
ASSI { 810}
(( segid "SUPF" and resid 63 and name HB1 ))
(( segid "SUPF" and resid 63 and name HG1 ))
2.300 0.700 0.700 peak 810 spectrum 1 weight 0.10000E+01 volume 0.11070E-01 ppm1 2.007 ppm2 2.208 CV 1
OR { 810}
(( segid "SUPF" and resid 63 and name HB2 ))
(( segid "SUPF" and resid 63 and name HG1 ))
ASSI { 811}
(( segid "SUPF" and resid 63 and name HB2 ))
(( segid "SUPF" and resid 64 and name HA ))
4.100 2.100 1.900 peak 811 spectrum 1 weight 0.10000E+01 volume 0.49962E-03 ppm1 2.009 ppm2 5.182 CV 1
OR { 811}
(( segid "SUPF" and resid 63 and name HB1 ))
(( segid "SUPF" and resid 64 and name HA ))
ASSI { 812}
(( segid "SUPF" and resid 63 and name HB2 ))
(( segid "SUPF" and resid 82 and name HB ))
2.600 0.800 0.800 peak 812 spectrum 1 weight 0.10000E+01 volume 0.39457E-02 ppm1 1.996 ppm2 3.938 CV 1
OR { 812}
(( segid "SUPF" and resid 63 and name HB1 ))
(( segid "SUPF" and resid 82 and name HB ))
ASSI { 815}
(( segid "SUPF" and resid 63 and name HG2 ))
(( segid "SUPF" and resid 63 and name HG1 ))
1.800 0.400 0.400 peak 815 spectrum 1 weight 0.10000E+01 volume 0.14619E-01 ppm1 2.068 ppm2 2.208 CV 1
ASSI { 818}
(( segid "SUPF" and resid 64 and name HA ))
( segid "SUPF" and resid 81 and name HG1%)
3.500 1.600 1.600 peak 818 spectrum 1 weight 0.10000E+01 volume 0.26498E-02 ppm1 5.185 ppm2 0.572 CV 1
ASSI { 819}
(( segid "SUPF" and resid 64 and name HA ))
( segid "SUPF" and resid 81 and name HG2%)
3.000 1.100 1.100 peak 819 spectrum 1 weight 0.10000E+01 volume 0.40546E-02 ppm1 5.185 ppm2 0.403 CV 1
ASSI { 822}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 48 and name HA ))
3.200 3.200 2.800 peak 822 spectrum 1 weight 0.10000E+01 volume 0.14995E-02 ppm1 1.339 ppm2 4.014 CV 1
ASSI { 823}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 48 and name HB2 ))
3.800 1.800 1.800 peak 823 spectrum 1 weight 0.10000E+01 volume 0.57203E-03 ppm1 1.340 ppm2 2.763 CV 1
ASSI { 826}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 52 and name HB1 ))
3.700 1.700 1.700 peak 826 spectrum 1 weight 0.10000E+01 volume 0.31993E-02 ppm1 1.346 ppm2 3.508 CV 1
ASSI { 827}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 52 and name HB2 ))
2.600 0.800 0.800 peak 827 spectrum 1 weight 0.10000E+01 volume 0.21024E-02 ppm1 1.326 ppm2 3.566 CV 1
ASSI { 828}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 52 and name HD2 ))
2.300 0.700 0.700 peak 828 spectrum 1 weight 0.10000E+01 volume 0.47763E-02 ppm1 1.346 ppm2 7.247 CV 1
ASSI { 829}
( segid "SUPF" and resid 64 and name HB% )
( segid "SUPF" and resid 55 and name HD% )
4.400 2.400 1.600 peak 829 spectrum 1 weight 0.10000E+01 volume 0.65434E-03 ppm1 1.343 ppm2 7.834 CV 1
ASSI { 830}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 64 and name HA ))
2.100 0.500 0.500 peak 830 spectrum 1 weight 0.10000E+01 volume 0.96636E-02 ppm1 1.345 ppm2 5.185 CV 1
ASSI { 831}
(( segid "SUPF" and resid 65 and name HA ))
(( segid "SUPF" and resid 65 and name HB ))
2.300 0.700 0.700 peak 831 spectrum 1 weight 0.10000E+01 volume 0.53290E-02 ppm1 4.711 ppm2 1.966 CV 1
ASSI { 832}
(( segid "SUPF" and resid 65 and name HA ))
( segid "SUPF" and resid 65 and name HG1%)
2.400 0.700 0.700 peak 832 spectrum 1 weight 0.10000E+01 volume 0.88227E-02 ppm1 4.720 ppm2 0.961 CV 1
OR { 832}
(( segid "SUPF" and resid 65 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
ASSI { 833}
(( segid "SUPF" and resid 65 and name HA ))
( segid "SUPF" and resid 66 and name HG2%)
3.800 1.800 1.800 peak 833 spectrum 1 weight 0.10000E+01 volume 0.10386E-02 ppm1 4.712 ppm2 0.635 CV 1
ASSI { 835}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 80 and name HA ))
4.200 2.200 1.800 peak 835 spectrum 1 weight 0.10000E+01 volume 0.70313E-03 ppm1 0.961 ppm2 5.848 CV 1
OR { 835}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 80 and name HA ))
ASSI { 836}
( segid "SUPF" and resid 65 and name HG2%)
( segid "SUPF" and resid 80 and name HD% )
2.900 1.100 1.100 peak 836 spectrum 1 weight 0.10000E+01 volume 0.36900E-02 ppm1 0.960 ppm2 7.165 CV 1
OR { 836}
( segid "SUPF" and resid 65 and name HG1%)
( segid "SUPF" and resid 80 and name HD% )
ASSI { 837}
( segid "SUPF" and resid 65 and name HG2%)
( segid "SUPF" and resid 80 and name HE% )
3.900 1.900 1.900 peak 837 spectrum 1 weight 0.10000E+01 volume 0.15254E-02 ppm1 0.959 ppm2 7.559 CV 1
OR { 837}
( segid "SUPF" and resid 65 and name HG1%)
( segid "SUPF" and resid 80 and name HE% )
ASSI { 838}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 63 and name HG1 ))
2.900 1.100 1.100 peak 838 spectrum 1 weight 0.10000E+01 volume 0.21761E-02 ppm1 0.962 ppm2 2.209 CV 1
ASSI { 839}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 65 and name HB ))
2.100 0.600 0.600 peak 839 spectrum 1 weight 0.10000E+01 volume 0.12587E-01 ppm1 0.962 ppm2 1.965 CV 1
ASSI { 840}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 64 and name HA ))
3.800 1.800 1.800 peak 840 spectrum 1 weight 0.10000E+01 volume 0.15808E-02 ppm1 0.956 ppm2 5.185 CV 1
ASSI { 841}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 80 and name HB1 ))
3.500 1.500 1.500 peak 841 spectrum 1 weight 0.10000E+01 volume 0.26681E-02 ppm1 0.961 ppm2 2.676 CV 1
ASSI { 842}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 80 and name HB2 ))
3.000 1.100 1.100 peak 842 spectrum 1 weight 0.10000E+01 volume 0.17016E-02 ppm1 0.958 ppm2 2.870 CV 1
ASSI { 844}
(( segid "SUPF" and resid 66 and name HA ))
( segid "SUPF" and resid 42 and name HD1%)
3.900 1.900 1.900 peak 844 spectrum 1 weight 0.10000E+01 volume 0.74041E-03 ppm1 3.929 ppm2 0.499 CV 1
ASSI { 845}
(( segid "SUPF" and resid 66 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
3.500 1.500 1.500 peak 845 spectrum 1 weight 0.10000E+01 volume 0.82360E-03 ppm1 3.933 ppm2 0.957 CV 1
ASSI { 846}
(( segid "SUPF" and resid 66 and name HA ))
(( segid "SUPF" and resid 66 and name HB ))
2.900 1.000 1.000 peak 846 spectrum 1 weight 0.10000E+01 volume 0.21327E-02 ppm1 3.931 ppm2 1.877 CV 1
ASSI { 848}
(( segid "SUPF" and resid 66 and name HA ))
( segid "SUPF" and resid 66 and name HG2%)
2.300 0.600 0.600 peak 848 spectrum 1 weight 0.10000E+01 volume 0.69969E-02 ppm1 3.931 ppm2 0.629 CV 1
ASSI { 849}
(( segid "SUPF" and resid 66 and name HA ))
(( segid "SUPF" and resid 67 and name HG11))
4.400 2.500 1.600 peak 849 spectrum 1 weight 0.10000E+01 volume 0.71277E-03 ppm1 3.932 ppm2 1.450 CV 1
OR { 849}
(( segid "SUPF" and resid 66 and name HA ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 850}
(( segid "SUPF" and resid 66 and name HB ))
( segid "SUPF" and resid 66 and name HG1%)
2.200 0.600 0.600 peak 850 spectrum 1 weight 0.10000E+01 volume 0.10711E-01 ppm1 1.879 ppm2 0.759 CV 1
ASSI { 851}
(( segid "SUPF" and resid 66 and name HB ))
( segid "SUPF" and resid 66 and name HG2%)
2.200 0.600 0.600 peak 851 spectrum 1 weight 0.10000E+01 volume 0.99774E-02 ppm1 1.878 ppm2 0.627 CV 1
ASSI { 852}
(( segid "SUPF" and resid 66 and name HB ))
( segid "SUPF" and resid 68 and name HG2%)
3.300 1.400 1.400 peak 852 spectrum 1 weight 0.10000E+01 volume 0.10200E-02 ppm1 1.874 ppm2 0.979 CV 1
ASSI { 853}
( segid "SUPF" and resid 66 and name HG1%)
(( segid "SUPF" and resid 66 and name HA ))
2.300 0.600 0.600 peak 853 spectrum 1 weight 0.10000E+01 volume 0.79716E-02 ppm1 0.760 ppm2 3.934 CV 1
ASSI { 855}
( segid "SUPF" and resid 66 and name HG1%)
(( segid "SUPF" and resid 75 and name HA ))
2.700 0.900 0.900 peak 855 spectrum 1 weight 0.10000E+01 volume 0.33946E-02 ppm1 0.756 ppm2 4.258 CV 1
ASSI { 856}
( segid "SUPF" and resid 66 and name HG1%)
(( segid "SUPF" and resid 75 and name HB2 ))
3.100 1.200 1.200 peak 856 spectrum 1 weight 0.10000E+01 volume 0.33440E-02 ppm1 0.762 ppm2 4.139 CV 1
ASSI { 857}
(( segid "SUPF" and resid 67 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
2.800 1.000 1.000 peak 857 spectrum 1 weight 0.10000E+01 volume 0.45978E-02 ppm1 4.068 ppm2 0.939 CV 1
ASSI { 858}
(( segid "SUPF" and resid 67 and name HA ))
(( segid "SUPF" and resid 67 and name HB ))
3.000 1.100 1.100 peak 858 spectrum 1 weight 0.10000E+01 volume 0.17457E-02 ppm1 4.063 ppm2 1.219 CV 1
ASSI { 860}
(( segid "SUPF" and resid 67 and name HA ))
( segid "SUPF" and resid 67 and name HG2%)
2.400 0.700 0.700 peak 860 spectrum 1 weight 0.10000E+01 volume 0.74590E-02 ppm1 4.067 ppm2 0.846 CV 1
ASSI { 863}
(( segid "SUPF" and resid 67 and name HB ))
(( segid "SUPF" and resid 67 and name HG11))
2.400 0.700 0.700 peak 863 spectrum 1 weight 0.10000E+01 volume 0.45302E-02 ppm1 1.223 ppm2 1.458 CV 1
OR { 863}
(( segid "SUPF" and resid 67 and name HB ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 864}
(( segid "SUPF" and resid 67 and name HB ))
( segid "SUPF" and resid 67 and name HG2%)
2.300 0.600 0.600 peak 864 spectrum 1 weight 0.10000E+01 volume 0.75385E-02 ppm1 1.223 ppm2 0.847 CV 1
ASSI { 866}
(( segid "SUPF" and resid 67 and name HB ))
( segid "SUPF" and resid 78 and name HE% )
3.100 1.200 1.200 peak 866 spectrum 1 weight 0.10000E+01 volume 0.11618E-02 ppm1 1.227 ppm2 6.850 CV 1
ASSI { 867}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 67 and name HA ))
2.100 0.600 0.600 peak 867 spectrum 1 weight 0.10000E+01 volume 0.10211E-01 ppm1 0.918 ppm2 4.069 CV 1
ASSI { 868}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 67 and name HB ))
3.600 1.700 1.700 peak 868 spectrum 1 weight 0.10000E+01 volume 0.18502E-02 ppm1 0.920 ppm2 1.217 CV 1
ASSI { 869}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 67 and name HG11))
2.200 0.600 0.600 peak 869 spectrum 1 weight 0.10000E+01 volume 0.73813E-02 ppm1 0.919 ppm2 1.457 CV 1
ASSI { 870}
( segid "SUPF" and resid 67 and name HD1%)
( segid "SUPF" and resid 78 and name HD% )
4.500 2.600 1.500 peak 870 spectrum 1 weight 0.10000E+01 volume 0.61639E-03 ppm1 0.923 ppm2 6.744 CV 1
ASSI { 871}
( segid "SUPF" and resid 67 and name HD1%)
( segid "SUPF" and resid 78 and name HE% )
4.200 2.200 1.800 peak 871 spectrum 1 weight 0.10000E+01 volume 0.13008E-02 ppm1 0.918 ppm2 6.850 CV 1
ASSI { 872}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 79 and name HA1 ))
4.600 2.600 1.400 peak 872 spectrum 1 weight 0.10000E+01 volume 0.85486E-03 ppm1 0.915 ppm2 4.284 CV 1
ASSI { 873}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 79 and name HA2 ))
4.300 2.300 1.700 peak 873 spectrum 1 weight 0.10000E+01 volume 0.76252E-03 ppm1 0.915 ppm2 3.950 CV 1
ASSI { 874}
( segid "SUPF" and resid 67 and name HD1%)
( segid "SUPF" and resid 80 and name HD% )
2.800 1.000 1.000 peak 874 spectrum 1 weight 0.10000E+01 volume 0.47291E-02 ppm1 0.917 ppm2 7.166 CV 1
ASSI { 875}
( segid "SUPF" and resid 67 and name HD1%)
( segid "SUPF" and resid 80 and name HE% )
3.600 1.700 1.700 peak 875 spectrum 1 weight 0.10000E+01 volume 0.26255E-02 ppm1 0.918 ppm2 7.558 CV 1
ASSI { 876}
(( segid "SUPF" and resid 67 and name HG11))
(( segid "SUPF" and resid 67 and name HA ))
3.200 1.300 1.300 peak 876 spectrum 1 weight 0.10000E+01 volume 0.17510E-02 ppm1 1.460 ppm2 4.075 CV 1
OR { 876}
(( segid "SUPF" and resid 67 and name HG12))
(( segid "SUPF" and resid 67 and name HA ))
ASSI { 877}
(( segid "SUPF" and resid 67 and name HG11))
( segid "SUPF" and resid 78 and name HD% )
3.700 1.700 1.700 peak 877 spectrum 1 weight 0.10000E+01 volume 0.90281E-03 ppm1 1.468 ppm2 6.745 CV 1
OR { 877}
(( segid "SUPF" and resid 67 and name HG12))
( segid "SUPF" and resid 78 and name HD% )
ASSI { 878}
(( segid "SUPF" and resid 67 and name HG12))
( segid "SUPF" and resid 78 and name HE% )
3.100 1.200 1.200 peak 878 spectrum 1 weight 0.10000E+01 volume 0.20485E-02 ppm1 1.463 ppm2 6.851 CV 1
OR { 878}
(( segid "SUPF" and resid 67 and name HG11))
( segid "SUPF" and resid 78 and name HE% )
ASSI { 879}
(( segid "SUPF" and resid 67 and name HG11))
(( segid "SUPF" and resid 79 and name HA2 ))
3.300 1.300 1.300 peak 879 spectrum 1 weight 0.10000E+01 volume 0.12572E-02 ppm1 1.458 ppm2 3.951 CV 1
OR { 879}
(( segid "SUPF" and resid 67 and name HG12))
(( segid "SUPF" and resid 79 and name HA2 ))
ASSI { 880}
(( segid "SUPF" and resid 67 and name HG11))
( segid "SUPF" and resid 80 and name HD% )
2.800 1.000 1.000 peak 880 spectrum 1 weight 0.10000E+01 volume 0.13781E-02 ppm1 1.471 ppm2 7.166 CV 1
OR { 880}
(( segid "SUPF" and resid 67 and name HG12))
( segid "SUPF" and resid 80 and name HD% )
ASSI { 881}
(( segid "SUPF" and resid 67 and name HG12))
( segid "SUPF" and resid 80 and name HE% )
2.700 0.900 0.900 peak 881 spectrum 1 weight 0.10000E+01 volume 0.17833E-02 ppm1 1.464 ppm2 7.556 CV 1
OR { 881}
(( segid "SUPF" and resid 67 and name HG11))
( segid "SUPF" and resid 80 and name HE% )
ASSI { 884}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 67 and name HG12))
2.500 0.800 0.800 peak 884 spectrum 1 weight 0.10000E+01 volume 0.54508E-02 ppm1 0.850 ppm2 1.458 CV 1
OR { 884}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 67 and name HG11))
ASSI { 885}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HB2 ))
3.600 1.600 1.600 peak 885 spectrum 1 weight 0.10000E+01 volume 0.10561E-02 ppm1 0.855 ppm2 2.207 CV 1
ASSI { 886}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HD1 ))
3.000 1.100 1.100 peak 886 spectrum 1 weight 0.10000E+01 volume 0.25039E-02 ppm1 0.850 ppm2 3.171 CV 1
ASSI { 887}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HD2 ))
2.800 1.000 1.000 peak 887 spectrum 1 weight 0.10000E+01 volume 0.22764E-02 ppm1 0.852 ppm2 3.248 CV 1
ASSI { 888}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HG1 ))
3.400 1.400 1.400 peak 888 spectrum 1 weight 0.10000E+01 volume 0.13523E-02 ppm1 0.852 ppm2 1.623 CV 1
OR { 888}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HG2 ))
ASSI { 889}
( segid "SUPF" and resid 67 and name HG2%)
( segid "SUPF" and resid 78 and name HD% )
4.300 2.300 1.700 peak 889 spectrum 1 weight 0.10000E+01 volume 0.67982E-03 ppm1 0.851 ppm2 6.744 CV 1
ASSI { 890}
( segid "SUPF" and resid 67 and name HG2%)
( segid "SUPF" and resid 78 and name HE% )
3.200 1.300 1.300 peak 890 spectrum 1 weight 0.10000E+01 volume 0.27496E-02 ppm1 0.850 ppm2 6.852 CV 1
ASSI { 891}
( segid "SUPF" and resid 67 and name HG2%)
( segid "SUPF" and resid 80 and name HD% )
5.000 3.100 1.000 peak 891 spectrum 1 weight 0.10000E+01 volume 0.66247E-03 ppm1 0.850 ppm2 7.163 CV 1
ASSI { 892}
( segid "SUPF" and resid 67 and name HG2%)
( segid "SUPF" and resid 80 and name HE% )
4.200 2.200 1.800 peak 892 spectrum 1 weight 0.10000E+01 volume 0.69482E-03 ppm1 0.853 ppm2 7.555 CV 1
ASSI { 893}
(( segid "SUPF" and resid 68 and name HA ))
(( segid "SUPF" and resid 75 and name HA ))
2.100 0.600 0.600 peak 893 spectrum 1 weight 0.10000E+01 volume 0.89618E-02 ppm1 4.792 ppm2 4.255 CV 1
ASSI { 894}
(( segid "SUPF" and resid 68 and name HA ))
( segid "SUPF" and resid 66 and name HG1%)
3.600 1.600 1.600 peak 894 spectrum 1 weight 0.10000E+01 volume 0.85570E-03 ppm1 4.792 ppm2 0.758 CV 1
ASSI { 895}
(( segid "SUPF" and resid 68 and name HA ))
(( segid "SUPF" and resid 68 and name HB ))
2.200 0.600 0.600 peak 895 spectrum 1 weight 0.10000E+01 volume 0.74246E-02 ppm1 4.792 ppm2 3.713 CV 1
ASSI { 896}
(( segid "SUPF" and resid 68 and name HA ))
( segid "SUPF" and resid 68 and name HG2%)
2.300 0.600 0.600 peak 896 spectrum 1 weight 0.10000E+01 volume 0.94594E-02 ppm1 4.785 ppm2 0.979 CV 1
ASSI { 897}
(( segid "SUPF" and resid 68 and name HA ))
(( segid "SUPF" and resid 76 and name HG1 ))
2.800 1.000 1.000 peak 897 spectrum 1 weight 0.10000E+01 volume 0.10450E-02 ppm1 4.794 ppm2 1.634 CV 1
ASSI { 898}
(( segid "SUPF" and resid 68 and name HA ))
(( segid "SUPF" and resid 76 and name HG2 ))
4.100 2.100 1.900 peak 898 spectrum 1 weight 0.10000E+01 volume 0.13255E-02 ppm1 4.792 ppm2 1.588 CV 1
ASSI { 900}
(( segid "SUPF" and resid 68 and name HB ))
(( segid "SUPF" and resid 73 and name HA ))
2.500 0.800 0.800 peak 900 spectrum 1 weight 0.10000E+01 volume 0.39336E-02 ppm1 3.715 ppm2 3.977 CV 1
ASSI { 901}
(( segid "SUPF" and resid 68 and name HB ))
(( segid "SUPF" and resid 75 and name HA ))
3.400 1.500 1.500 peak 901 spectrum 1 weight 0.10000E+01 volume 0.16221E-02 ppm1 3.716 ppm2 4.257 CV 1
ASSI { 903}
( segid "SUPF" and resid 68 and name HG2%)
(( segid "SUPF" and resid 68 and name HB ))
2.100 0.500 0.500 peak 903 spectrum 1 weight 0.10000E+01 volume 0.13305E-01 ppm1 0.983 ppm2 3.713 CV 1
ASSI { 904}
( segid "SUPF" and resid 68 and name HG2%)
(( segid "SUPF" and resid 75 and name HA ))
2.200 0.600 0.600 peak 904 spectrum 1 weight 0.10000E+01 volume 0.79541E-02 ppm1 0.983 ppm2 4.255 CV 1
ASSI { 905}
(( segid "SUPF" and resid 69 and name HA ))
( segid "SUPF" and resid 67 and name HG2%)
3.700 1.700 1.700 peak 905 spectrum 1 weight 0.10000E+01 volume 0.58051E-03 ppm1 4.613 ppm2 0.850 CV 1
ASSI { 906}
(( segid "SUPF" and resid 69 and name HA ))
(( segid "SUPF" and resid 69 and name HB1 ))
2.500 0.800 0.800 peak 906 spectrum 1 weight 0.10000E+01 volume 0.61031E-02 ppm1 4.605 ppm2 2.489 CV 1
ASSI { 907}
(( segid "SUPF" and resid 69 and name HA ))
(( segid "SUPF" and resid 69 and name HB2 ))
2.600 0.900 0.900 peak 907 spectrum 1 weight 0.10000E+01 volume 0.44277E-02 ppm1 4.610 ppm2 3.106 CV 1
ASSI { 909}
(( segid "SUPF" and resid 69 and name HB1 ))
(( segid "SUPF" and resid 69 and name HB2 ))
1.800 0.400 0.400 peak 909 spectrum 1 weight 0.10000E+01 volume 0.15340E-01 ppm1 2.488 ppm2 3.107 CV 1
ASSI { 911}
(( segid "SUPF" and resid 70 and name HB1 ))
(( segid "SUPF" and resid 70 and name HA ))
2.200 0.600 0.600 peak 911 spectrum 1 weight 0.10000E+01 volume 0.11634E-01 ppm1 1.901 ppm2 4.091 CV 1
OR { 911}
(( segid "SUPF" and resid 70 and name HB2 ))
(( segid "SUPF" and resid 70 and name HA ))
ASSI { 912}
(( segid "SUPF" and resid 70 and name HB2 ))
(( segid "SUPF" and resid 70 and name HD2 ))
2.600 0.900 0.900 peak 912 spectrum 1 weight 0.10000E+01 volume 0.44503E-02 ppm1 1.902 ppm2 3.249 CV 1
OR { 912}
(( segid "SUPF" and resid 70 and name HB1 ))
(( segid "SUPF" and resid 70 and name HD1 ))
OR { 912}
(( segid "SUPF" and resid 70 and name HB1 ))
(( segid "SUPF" and resid 70 and name HD2 ))
OR { 912}
(( segid "SUPF" and resid 70 and name HB2 ))
(( segid "SUPF" and resid 70 and name HD1 ))
ASSI { 913}
(( segid "SUPF" and resid 70 and name HG1 ))
(( segid "SUPF" and resid 70 and name HA ))
2.500 0.800 0.800 peak 913 spectrum 1 weight 0.10000E+01 volume 0.49735E-02 ppm1 1.711 ppm2 4.090 CV 1
OR { 913}
(( segid "SUPF" and resid 70 and name HG2 ))
(( segid "SUPF" and resid 70 and name HA ))
ASSI { 914}
(( segid "SUPF" and resid 70 and name HG1 ))
(( segid "SUPF" and resid 70 and name HD1 ))
2.200 0.600 0.600 peak 914 spectrum 1 weight 0.10000E+01 volume 0.10317E-01 ppm1 1.712 ppm2 3.246 CV 1
OR { 914}
(( segid "SUPF" and resid 70 and name HG2 ))
(( segid "SUPF" and resid 70 and name HD2 ))
OR { 914}
(( segid "SUPF" and resid 70 and name HG1 ))
(( segid "SUPF" and resid 70 and name HD2 ))
OR { 914}
(( segid "SUPF" and resid 70 and name HG2 ))
(( segid "SUPF" and resid 70 and name HD1 ))
ASSI { 915}
(( segid "SUPF" and resid 71 and name HA ))
(( segid "SUPF" and resid 71 and name HB1 ))
2.700 0.900 0.900 peak 915 spectrum 1 weight 0.10000E+01 volume 0.35179E-02 ppm1 4.742 ppm2 3.009 CV 1
ASSI { 916}
(( segid "SUPF" and resid 71 and name HA ))
(( segid "SUPF" and resid 71 and name HB2 ))
2.700 0.900 0.900 peak 916 spectrum 1 weight 0.10000E+01 volume 0.60976E-02 ppm1 4.739 ppm2 2.868 CV 1
ASSI { 917}
(( segid "SUPF" and resid 71 and name HB1 ))
( segid "SUPF" and resid 72 and name HG2%)
2.900 1.000 1.000 peak 917 spectrum 1 weight 0.10000E+01 volume 0.28581E-02 ppm1 3.013 ppm2 1.199 CV 1
ASSI { 918}
(( segid "SUPF" and resid 71 and name HB2 ))
( segid "SUPF" and resid 72 and name HG2%)
3.100 1.200 1.200 peak 918 spectrum 1 weight 0.10000E+01 volume 0.22846E-02 ppm1 2.869 ppm2 1.199 CV 1
ASSI { 919}
(( segid "SUPF" and resid 72 and name HA ))
( segid "SUPF" and resid 72 and name HG2%)
2.200 0.600 0.600 peak 919 spectrum 1 weight 0.10000E+01 volume 0.15178E-01 ppm1 4.385 ppm2 1.200 CV 1
ASSI { 920}
(( segid "SUPF" and resid 72 and name HB ))
( segid "SUPF" and resid 72 and name HG2%)
2.100 0.500 0.500 peak 920 spectrum 1 weight 0.10000E+01 volume 0.15708E-01 ppm1 4.345 ppm2 1.200 CV 1
ASSI { 922}
(( segid "SUPF" and resid 72 and name HB ))
(( segid "SUPF" and resid 74 and name HB2 ))
4.000 2.000 2.000 peak 922 spectrum 1 weight 0.10000E+01 volume 0.52863E-03 ppm1 4.353 ppm2 1.821 CV 1
ASSI { 924}
(( segid "SUPF" and resid 72 and name HB ))
(( segid "SUPF" and resid 74 and name HG2 ))
2.700 0.900 0.900 peak 924 spectrum 1 weight 0.10000E+01 volume 0.26756E-02 ppm1 4.344 ppm2 1.434 CV 1
OR { 924}
(( segid "SUPF" and resid 72 and name HB ))
(( segid "SUPF" and resid 74 and name HG1 ))
ASSI { 930}
(( segid "SUPF" and resid 73 and name HA ))
( segid "SUPF" and resid 68 and name HG2%)
3.200 1.300 1.300 peak 930 spectrum 1 weight 0.10000E+01 volume 0.28234E-02 ppm1 3.979 ppm2 0.979 CV 1
ASSI { 931}
(( segid "SUPF" and resid 73 and name HA ))
(( segid "SUPF" and resid 73 and name HB2 ))
2.400 0.700 0.700 peak 931 spectrum 1 weight 0.10000E+01 volume 0.75324E-02 ppm1 3.978 ppm2 2.370 CV 1
OR { 931}
(( segid "SUPF" and resid 73 and name HA ))
(( segid "SUPF" and resid 73 and name HB1 ))
ASSI { 932}
(( segid "SUPF" and resid 73 and name HA ))
(( segid "SUPF" and resid 73 and name HG2 ))
2.600 0.800 0.800 peak 932 spectrum 1 weight 0.10000E+01 volume 0.62091E-02 ppm1 3.977 ppm2 2.298 CV 1
OR { 932}
(( segid "SUPF" and resid 73 and name HA ))
(( segid "SUPF" and resid 73 and name HG1 ))
ASSI { 933}
(( segid "SUPF" and resid 73 and name HB2 ))
(( segid "SUPF" and resid 68 and name HB ))
3.900 1.900 1.900 peak 933 spectrum 1 weight 0.10000E+01 volume 0.63380E-03 ppm1 2.377 ppm2 3.711 CV 1
OR { 933}
(( segid "SUPF" and resid 73 and name HB1 ))
(( segid "SUPF" and resid 68 and name HB ))
ASSI { 934}
(( segid "SUPF" and resid 73 and name HB2 ))
( segid "SUPF" and resid 68 and name HG2%)
3.800 1.800 1.800 peak 934 spectrum 1 weight 0.10000E+01 volume 0.76529E-03 ppm1 2.357 ppm2 0.981 CV 1
OR { 934}
(( segid "SUPF" and resid 73 and name HB1 ))
( segid "SUPF" and resid 68 and name HG2%)
ASSI { 935}
(( segid "SUPF" and resid 73 and name HB1 ))
(( segid "SUPF" and resid 72 and name HA ))
3.800 1.800 1.800 peak 935 spectrum 1 weight 0.10000E+01 volume 0.56263E-03 ppm1 2.370 ppm2 4.397 CV 1
OR { 935}
(( segid "SUPF" and resid 73 and name HB2 ))
(( segid "SUPF" and resid 72 and name HA ))
ASSI { 937}
(( segid "SUPF" and resid 73 and name HB2 ))
(( segid "SUPF" and resid 73 and name HG1 ))
2.000 0.500 0.500 peak 937 spectrum 1 weight 0.10000E+01 volume 0.20123E-01 ppm1 2.377 ppm2 2.300 CV 1
OR { 937}
(( segid "SUPF" and resid 73 and name HB1 ))
(( segid "SUPF" and resid 73 and name HG2 ))
OR { 937}
(( segid "SUPF" and resid 73 and name HB1 ))
(( segid "SUPF" and resid 73 and name HG1 ))
OR { 937}
(( segid "SUPF" and resid 73 and name HB2 ))
(( segid "SUPF" and resid 73 and name HG2 ))
ASSI { 939}
(( segid "SUPF" and resid 74 and name HA ))
( segid "SUPF" and resid 68 and name HG2%)
3.400 1.400 1.400 peak 939 spectrum 1 weight 0.10000E+01 volume 0.13537E-02 ppm1 4.413 ppm2 0.979 CV 1
ASSI { 941}
(( segid "SUPF" and resid 74 and name HA ))
(( segid "SUPF" and resid 74 and name HG1 ))
2.500 0.800 0.800 peak 941 spectrum 1 weight 0.10000E+01 volume 0.56450E-02 ppm1 4.414 ppm2 1.433 CV 1
OR { 941}
(( segid "SUPF" and resid 74 and name HA ))
(( segid "SUPF" and resid 74 and name HG2 ))
ASSI { 942}
(( segid "SUPF" and resid 74 and name HB1 ))
(( segid "SUPF" and resid 74 and name HA ))
2.500 0.800 0.800 peak 942 spectrum 1 weight 0.10000E+01 volume 0.43998E-02 ppm1 1.651 ppm2 4.413 CV 1
ASSI { 943}
(( segid "SUPF" and resid 74 and name HB2 ))
(( segid "SUPF" and resid 74 and name HA ))
2.600 0.800 0.800 peak 943 spectrum 1 weight 0.10000E+01 volume 0.58745E-02 ppm1 1.833 ppm2 4.412 CV 1
ASSI { 944}
(( segid "SUPF" and resid 74 and name HD2 ))
(( segid "SUPF" and resid 74 and name HA ))
3.400 1.500 1.500 peak 944 spectrum 1 weight 0.10000E+01 volume 0.27260E-02 ppm1 1.597 ppm2 4.412 CV 1
OR { 944}
(( segid "SUPF" and resid 74 and name HD1 ))
(( segid "SUPF" and resid 74 and name HA ))
ASSI { 947}
(( segid "SUPF" and resid 74 and name HG1 ))
(( segid "SUPF" and resid 74 and name HE1 ))
3.000 1.100 1.100 peak 947 spectrum 1 weight 0.10000E+01 volume 0.21084E-02 ppm1 1.430 ppm2 2.847 CV 1
OR { 947}
(( segid "SUPF" and resid 74 and name HG2 ))
(( segid "SUPF" and resid 74 and name HE1 ))
ASSI { 948}
(( segid "SUPF" and resid 74 and name HG1 ))
(( segid "SUPF" and resid 74 and name HE2 ))
3.000 1.200 1.200 peak 948 spectrum 1 weight 0.10000E+01 volume 0.21814E-02 ppm1 1.430 ppm2 2.906 CV 1
OR { 948}
(( segid "SUPF" and resid 74 and name HG2 ))
(( segid "SUPF" and resid 74 and name HE2 ))
ASSI { 952}
(( segid "SUPF" and resid 75 and name HA ))
(( segid "SUPF" and resid 75 and name HB1 ))
2.500 0.800 0.800 peak 952 spectrum 1 weight 0.10000E+01 volume 0.34034E-02 ppm1 4.255 ppm2 3.948 CV 1
ASSI { 954}
(( segid "SUPF" and resid 75 and name HB1 ))
(( segid "SUPF" and resid 44 and name HB2 ))
5.000 3.100 1.000 peak 954 spectrum 1 weight 0.10000E+01 volume 0.50924E-03 ppm1 3.957 ppm2 3.014 CV 1
ASSI { 956}
(( segid "SUPF" and resid 75 and name HB1 ))
( segid "SUPF" and resid 44 and name HE% )
5.000 3.100 1.000 peak 956 spectrum 1 weight 0.10000E+01 volume 0.25495E-03 ppm1 3.945 ppm2 6.822 CV 1
ASSI { 957}
(( segid "SUPF" and resid 75 and name HB1 ))
( segid "SUPF" and resid 66 and name HG1%)
3.000 1.100 1.100 peak 957 spectrum 1 weight 0.10000E+01 volume 0.14572E-02 ppm1 3.949 ppm2 0.756 CV 1
ASSI { 958}
(( segid "SUPF" and resid 75 and name HB1 ))
( segid "SUPF" and resid 68 and name HG2%)
4.200 2.200 1.800 peak 958 spectrum 1 weight 0.10000E+01 volume 0.77258E-03 ppm1 3.949 ppm2 0.981 CV 1
ASSI { 960}
(( segid "SUPF" and resid 75 and name HB1 ))
(( segid "SUPF" and resid 75 and name HB2 ))
1.800 0.400 0.400 peak 960 spectrum 1 weight 0.10000E+01 volume 0.12060E-01 ppm1 3.946 ppm2 4.139 CV 1
ASSI { 962}
(( segid "SUPF" and resid 75 and name HB2 ))
( segid "SUPF" and resid 44 and name HD% )
3.500 1.600 1.600 peak 962 spectrum 1 weight 0.10000E+01 volume 0.86058E-03 ppm1 4.145 ppm2 7.161 CV 1
ASSI { 964}
(( segid "SUPF" and resid 75 and name HB2 ))
( segid "SUPF" and resid 68 and name HG2%)
4.000 2.000 2.000 peak 964 spectrum 1 weight 0.10000E+01 volume 0.15441E-02 ppm1 4.140 ppm2 0.980 CV 1
ASSI { 965}
(( segid "SUPF" and resid 75 and name HB2 ))
(( segid "SUPF" and resid 75 and name HA ))
2.600 0.800 0.800 peak 965 spectrum 1 weight 0.10000E+01 volume 0.44816E-02 ppm1 4.134 ppm2 4.255 CV 1
ASSI { 967}
(( segid "SUPF" and resid 76 and name HA ))
( segid "SUPF" and resid 44 and name HE% )
3.400 3.400 2.600 peak 967 spectrum 1 weight 0.10000E+01 volume 0.10345E-02 ppm1 4.514 ppm2 6.824 CV 1
ASSI { 970}
(( segid "SUPF" and resid 76 and name HB1 ))
(( segid "SUPF" and resid 76 and name HD1 ))
3.400 1.400 1.400 peak 970 spectrum 1 weight 0.10000E+01 volume 0.64428E-03 ppm1 1.230 ppm2 3.171 CV 1
ASSI { 971}
(( segid "SUPF" and resid 76 and name HB1 ))
(( segid "SUPF" and resid 76 and name HD2 ))
3.600 1.600 1.600 peak 971 spectrum 1 weight 0.10000E+01 volume 0.10426E-02 ppm1 1.225 ppm2 3.248 CV 1
ASSI { 972}
(( segid "SUPF" and resid 76 and name HB1 ))
( segid "SUPF" and resid 78 and name HD% )
3.600 1.600 1.600 peak 972 spectrum 1 weight 0.10000E+01 volume 0.81842E-03 ppm1 1.238 ppm2 6.743 CV 1
ASSI { 974}
(( segid "SUPF" and resid 76 and name HB2 ))
(( segid "SUPF" and resid 76 and name HA ))
3.000 1.100 1.100 peak 974 spectrum 1 weight 0.10000E+01 volume 0.32452E-02 ppm1 2.211 ppm2 4.512 CV 1
ASSI { 975}
(( segid "SUPF" and resid 76 and name HB2 ))
(( segid "SUPF" and resid 76 and name HD1 ))
3.400 1.400 1.400 peak 975 spectrum 1 weight 0.10000E+01 volume 0.72355E-03 ppm1 2.213 ppm2 3.170 CV 1
ASSI { 978}
(( segid "SUPF" and resid 76 and name HB2 ))
( segid "SUPF" and resid 78 and name HE% )
3.000 1.100 1.100 peak 978 spectrum 1 weight 0.10000E+01 volume 0.19235E-02 ppm1 2.212 ppm2 6.853 CV 1
ASSI { 979}
(( segid "SUPF" and resid 76 and name HD2 ))
( segid "SUPF" and resid 78 and name HE% )
3.400 1.500 1.500 peak 979 spectrum 1 weight 0.10000E+01 volume 0.13873E-02 ppm1 3.232 ppm2 6.854 CV 1
ASSI { 980}
(( segid "SUPF" and resid 76 and name HG2 ))
( segid "SUPF" and resid 78 and name HE% )
4.200 2.200 1.800 peak 980 spectrum 1 weight 0.10000E+01 volume 0.87908E-03 ppm1 1.607 ppm2 6.850 CV 1
OR { 980}
(( segid "SUPF" and resid 76 and name HG1 ))
( segid "SUPF" and resid 78 and name HE% )
ASSI { 981}
(( segid "SUPF" and resid 77 and name HA1 ))
(( segid "SUPF" and resid 42 and name HB1 ))
4.800 2.900 1.200 peak 981 spectrum 1 weight 0.10000E+01 volume 0.56942E-03 ppm1 3.293 ppm2 1.266 CV 1
ASSI { 983}
(( segid "SUPF" and resid 77 and name HA1 ))
( segid "SUPF" and resid 42 and name HD1%)
5.000 3.100 1.000 peak 983 spectrum 1 weight 0.10000E+01 volume 0.38460E-03 ppm1 3.285 ppm2 0.496 CV 1
ASSI { 984}
(( segid "SUPF" and resid 77 and name HA1 ))
( segid "SUPF" and resid 44 and name HD% )
4.100 2.100 1.900 peak 984 spectrum 1 weight 0.10000E+01 volume 0.40095E-03 ppm1 3.280 ppm2 7.158 CV 1
ASSI { 985}
(( segid "SUPF" and resid 77 and name HA1 ))
( segid "SUPF" and resid 44 and name HE% )
3.700 1.700 1.700 peak 985 spectrum 1 weight 0.10000E+01 volume 0.41834E-03 ppm1 3.285 ppm2 6.823 CV 1
ASSI { 987}
(( segid "SUPF" and resid 77 and name HA2 ))
(( segid "SUPF" and resid 42 and name HB1 ))
3.800 1.800 1.800 peak 987 spectrum 1 weight 0.10000E+01 volume 0.71415E-03 ppm1 4.077 ppm2 1.265 CV 1
ASSI { 989}
(( segid "SUPF" and resid 77 and name HA2 ))
( segid "SUPF" and resid 42 and name HD1%)
4.300 2.300 1.700 peak 989 spectrum 1 weight 0.10000E+01 volume 0.50654E-03 ppm1 4.068 ppm2 0.496 CV 1
ASSI { 990}
(( segid "SUPF" and resid 77 and name HA2 ))
( segid "SUPF" and resid 44 and name HD% )
3.700 1.700 1.700 peak 990 spectrum 1 weight 0.10000E+01 volume 0.50886E-03 ppm1 4.073 ppm2 7.158 CV 1
ASSI { 991}
(( segid "SUPF" and resid 77 and name HA2 ))
( segid "SUPF" and resid 44 and name HE% )
3.100 3.100 2.900 peak 991 spectrum 1 weight 0.10000E+01 volume 0.69102E-03 ppm1 4.079 ppm2 6.822 CV 1
ASSI { 992}
(( segid "SUPF" and resid 77 and name HA2 ))
(( segid "SUPF" and resid 77 and name HA1 ))
2.100 0.500 0.500 peak 992 spectrum 1 weight 0.10000E+01 volume 0.67928E-02 ppm1 4.082 ppm2 3.288 CV 1
ASSI { 993}
(( segid "SUPF" and resid 78 and name HA ))
( segid "SUPF" and resid 38 and name HE% )
4.100 2.100 1.900 peak 993 spectrum 1 weight 0.10000E+01 volume 0.97178E-03 ppm1 5.195 ppm2 6.919 CV 1
ASSI { 994}
(( segid "SUPF" and resid 78 and name HA ))
( segid "SUPF" and resid 39 and name HG1%)
4.700 2.700 1.300 peak 994 spectrum 1 weight 0.10000E+01 volume 0.45224E-03 ppm1 5.203 ppm2 0.748 CV 1
ASSI { 995}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 40 and name HA1 ))
4.300 2.300 1.700 peak 995 spectrum 1 weight 0.10000E+01 volume 0.13276E-02 ppm1 5.195 ppm2 3.749 CV 1
ASSI { 996}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 40 and name HA2 ))
2.900 1.000 1.000 peak 996 spectrum 1 weight 0.10000E+01 volume 0.18669E-02 ppm1 5.194 ppm2 4.601 CV 1
ASSI { 997}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 42 and name HB1 ))
4.000 2.000 2.000 peak 997 spectrum 1 weight 0.10000E+01 volume 0.15458E-02 ppm1 5.192 ppm2 1.267 CV 1
ASSI { 1000}
(( segid "SUPF" and resid 78 and name HA ))
( segid "SUPF" and resid 42 and name HD2%)
3.100 1.200 1.200 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.70114E-03 ppm1 5.194 ppm2 0.643 CV 1
ASSI { 1002}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 78 and name HB1 ))
2.500 0.800 0.800 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.35146E-02 ppm1 5.193 ppm2 2.948 CV 1
ASSI { 1003}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 78 and name HB2 ))
2.400 0.700 0.700 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.37623E-02 ppm1 5.194 ppm2 3.227 CV 1
ASSI { 1004}
(( segid "SUPF" and resid 78 and name HA ))
( segid "SUPF" and resid 78 and name HD% )
3.600 1.700 1.700 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.15173E-02 ppm1 5.195 ppm2 6.742 CV 1
ASSI { 1005}
(( segid "SUPF" and resid 78 and name HB1 ))
( segid "SUPF" and resid 38 and name HE% )
3.300 1.400 1.400 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.20724E-02 ppm1 2.967 ppm2 6.917 CV 1
ASSI { 1007}
(( segid "SUPF" and resid 78 and name HB1 ))
( segid "SUPF" and resid 78 and name HD% )
2.700 0.900 0.900 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.24844E-02 ppm1 2.952 ppm2 6.744 CV 1
ASSI { 1008}
(( segid "SUPF" and resid 78 and name HB2 ))
( segid "SUPF" and resid 38 and name HD% )
4.000 2.000 2.000 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.38709E-03 ppm1 3.243 ppm2 6.994 CV 1
ASSI { 1009}
(( segid "SUPF" and resid 78 and name HB2 ))
( segid "SUPF" and resid 38 and name HE% )
3.200 1.300 1.300 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.11003E-02 ppm1 3.219 ppm2 6.919 CV 1
ASSI { 1012}
( segid "SUPF" and resid 78 and name HD% )
( segid "SUPF" and resid 38 and name HD% )
3.100 1.200 1.200 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.20837E-02 ppm1 6.749 ppm2 6.990 CV 1
ASSI { 1013}
( segid "SUPF" and resid 78 and name HD% )
( segid "SUPF" and resid 38 and name HE% )
2.700 0.900 0.900 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.37336E-02 ppm1 6.745 ppm2 6.918 CV 1
ASSI { 1014}
( segid "SUPF" and resid 78 and name HD% )
(( segid "SUPF" and resid 67 and name HB ))
3.500 1.500 1.500 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.99955E-03 ppm1 6.740 ppm2 1.219 CV 1
ASSI { 1017}
( segid "SUPF" and resid 78 and name HD% )
(( segid "SUPF" and resid 76 and name HB2 ))
3.300 1.400 1.400 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.97985E-03 ppm1 6.741 ppm2 2.213 CV 1
ASSI { 1020}
( segid "SUPF" and resid 78 and name HD% )
(( segid "SUPF" and resid 78 and name HB2 ))
2.600 0.900 0.900 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.32119E-02 ppm1 6.743 ppm2 3.231 CV 1
ASSI { 1021}
( segid "SUPF" and resid 78 and name HD% )
( segid "SUPF" and resid 78 and name HE% )
2.100 0.500 0.500 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.11034E-01 ppm1 6.743 ppm2 6.852 CV 1
ASSI { 1022}
( segid "SUPF" and resid 78 and name HD% )
( segid "SUPF" and resid 80 and name HE% )
3.900 1.900 1.900 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.10712E-02 ppm1 6.742 ppm2 7.558 CV 1
ASSI { 1027}
( segid "SUPF" and resid 78 and name HE% )
(( segid "SUPF" and resid 76 and name HA ))
3.100 3.100 2.900 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.73313E-03 ppm1 6.838 ppm2 4.512 CV 1
ASSI { 1028}
( segid "SUPF" and resid 78 and name HE% )
(( segid "SUPF" and resid 76 and name HB1 ))
2.800 1.000 1.000 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.16168E-02 ppm1 6.847 ppm2 1.219 CV 1
ASSI { 1030}
( segid "SUPF" and resid 78 and name HE% )
(( segid "SUPF" and resid 78 and name HB2 ))
3.800 1.800 1.800 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.14759E-02 ppm1 6.838 ppm2 3.240 CV 1
ASSI { 1031}
( segid "SUPF" and resid 78 and name HE% )
( segid "SUPF" and resid 80 and name HE% )
2.600 0.800 0.800 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.25856E-02 ppm1 6.850 ppm2 7.560 CV 1
ASSI { 1032}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 51 and name HD1%)
4.100 2.100 1.900 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.63838E-03 ppm1 4.300 ppm2 0.841 CV 1
ASSI { 1033}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 42 and name HD1%)
3.600 1.600 1.600 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.42335E-03 ppm1 4.287 ppm2 0.500 CV 1
ASSI { 1034}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 65 and name HG2%)
4.300 2.300 1.700 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.47572E-03 ppm1 4.289 ppm2 0.946 CV 1
ASSI { 1035}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 66 and name HG1%)
3.800 1.800 1.800 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.56842E-03 ppm1 4.298 ppm2 0.756 CV 1
ASSI { 1036}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 66 and name HG2%)
3.300 1.300 1.300 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.65223E-03 ppm1 4.289 ppm2 0.638 CV 1
ASSI { 1037}
(( segid "SUPF" and resid 79 and name HA1 ))
(( segid "SUPF" and resid 67 and name HG11))
4.100 2.100 1.900 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.15606E-02 ppm1 4.295 ppm2 1.455 CV 1
OR { 1037}
(( segid "SUPF" and resid 79 and name HA1 ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 1038}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 78 and name HD% )
4.500 2.600 1.500 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.36760E-03 ppm1 4.299 ppm2 6.744 CV 1
ASSI { 1039}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 78 and name HE% )
5.300 3.600 0.700 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.21041E-03 ppm1 4.299 ppm2 6.850 CV 1
ASSI { 1040}
(( segid "SUPF" and resid 79 and name HA1 ))
(( segid "SUPF" and resid 79 and name HA2 ))
1.800 0.400 0.400 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.73915E-02 ppm1 4.290 ppm2 3.948 CV 1
ASSI { 1041}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 80 and name HD% )
4.800 2.800 1.200 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.40927E-03 ppm1 4.292 ppm2 7.167 CV 1
ASSI { 1043}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 42 and name HD1%)
4.000 2.000 2.000 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.82637E-03 ppm1 3.960 ppm2 0.501 CV 1
ASSI { 1044}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 65 and name HG2%)
4.000 2.000 2.000 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.58735E-03 ppm1 3.964 ppm2 0.956 CV 1
ASSI { 1045}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 66 and name HG1%)
3.700 1.700 1.700 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.75071E-03 ppm1 3.963 ppm2 0.753 CV 1
ASSI { 1046}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 66 and name HG2%)
4.000 2.000 2.000 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.89974E-03 ppm1 3.966 ppm2 0.645 CV 1
ASSI { 1048}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 78 and name HD% )
3.700 1.700 1.700 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.32669E-03 ppm1 3.957 ppm2 6.748 CV 1
ASSI { 1050}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 80 and name HD% )
4.200 2.200 1.800 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.25368E-03 ppm1 3.960 ppm2 7.168 CV 1
ASSI { 1051}
(( segid "SUPF" and resid 80 and name HA ))
(( segid "SUPF" and resid 36 and name HG2 ))
4.400 2.400 1.600 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.42652E-03 ppm1 5.849 ppm2 1.391 CV 1
ASSI { 1052}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
4.100 2.100 1.900 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.45309E-03 ppm1 5.858 ppm2 6.994 CV 1
ASSI { 1053}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 39 and name HG2%)
3.200 1.300 1.300 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.12908E-02 ppm1 5.849 ppm2 0.709 CV 1
ASSI { 1054}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
4.400 2.500 1.600 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.43782E-03 ppm1 5.845 ppm2 0.954 CV 1
ASSI { 1055}
(( segid "SUPF" and resid 80 and name HA ))
(( segid "SUPF" and resid 80 and name HB1 ))
2.700 0.900 0.900 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.23887E-02 ppm1 5.846 ppm2 2.677 CV 1
ASSI { 1056}
(( segid "SUPF" and resid 80 and name HA ))
(( segid "SUPF" and resid 80 and name HB2 ))
3.000 1.100 1.100 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.29820E-02 ppm1 5.845 ppm2 2.872 CV 1
ASSI { 1057}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 80 and name HD% )
2.600 0.800 0.800 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.36330E-02 ppm1 5.845 ppm2 7.165 CV 1
ASSI { 1058}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 80 and name HE% )
4.300 2.300 1.700 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.50003E-03 ppm1 5.839 ppm2 7.559 CV 1
ASSI { 1062}
(( segid "SUPF" and resid 80 and name HB1 ))
(( segid "SUPF" and resid 80 and name HB2 ))
2.000 0.500 0.500 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.69319E-02 ppm1 2.680 ppm2 2.872 CV 1
ASSI { 1063}
(( segid "SUPF" and resid 80 and name HB1 ))
( segid "SUPF" and resid 80 and name HD% )
2.600 0.800 0.800 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.37478E-02 ppm1 2.677 ppm2 7.165 CV 1
ASSI { 1064}
(( segid "SUPF" and resid 80 and name HB1 ))
( segid "SUPF" and resid 80 and name HE% )
4.600 2.700 1.400 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.45788E-03 ppm1 2.676 ppm2 7.552 CV 1
ASSI { 1068}
(( segid "SUPF" and resid 80 and name HB2 ))
( segid "SUPF" and resid 80 and name HD% )
2.500 0.800 0.800 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.39060E-02 ppm1 2.873 ppm2 7.166 CV 1
ASSI { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HE2 ))
3.200 1.200 1.200 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.13654E-02 ppm1 7.161 ppm2 1.399 CV 1
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HE1 ))
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HG2 ))
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HG1 ))
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
( segid "SUPF" and resid 36 and name HZ% )
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HD1 ))
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 1072}
( segid "SUPF" and resid 80 and name HD% )
( segid "SUPF" and resid 65 and name HG2%)
2.700 2.700 3.300 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.17223E-02 ppm1 7.160 ppm2 0.954 CV 1
ASSI { 1078}
( segid "SUPF" and resid 80 and name HD% )
( segid "SUPF" and resid 80 and name HE% )
2.200 0.600 0.600 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.62910E-02 ppm1 7.159 ppm2 7.559 CV 1
ASSI { 1081}
( segid "SUPF" and resid 80 and name HE% )
(( segid "SUPF" and resid 38 and name HB2 ))
3.800 1.800 1.800 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.57276E-03 ppm1 7.562 ppm2 3.003 CV 1
OR { 1081}
( segid "SUPF" and resid 80 and name HE% )
(( segid "SUPF" and resid 38 and name HB1 ))
ASSI { 1088}
(( segid "SUPF" and resid 81 and name HA ))
(( segid "SUPF" and resid 64 and name HA ))
2.100 0.500 0.500 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.90986E-02 ppm1 4.711 ppm2 5.185 CV 1
ASSI { 1089}
(( segid "SUPF" and resid 81 and name HA ))
( segid "SUPF" and resid 64 and name HB% )
2.500 0.800 0.800 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.36105E-02 ppm1 4.710 ppm2 1.343 CV 1
ASSI { 1090}
(( segid "SUPF" and resid 81 and name HA ))
(( segid "SUPF" and resid 80 and name HA ))
4.100 2.100 1.900 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.55958E-03 ppm1 4.714 ppm2 5.846 CV 1
ASSI { 1091}
(( segid "SUPF" and resid 81 and name HA ))
(( segid "SUPF" and resid 81 and name HB ))
3.000 1.200 1.200 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.14280E-02 ppm1 4.712 ppm2 1.177 CV 1
ASSI { 1092}
(( segid "SUPF" and resid 81 and name HA ))
( segid "SUPF" and resid 81 and name HG1%)
2.300 0.700 0.700 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.58581E-02 ppm1 4.710 ppm2 0.571 CV 1
ASSI { 1093}
(( segid "SUPF" and resid 81 and name HA ))
( segid "SUPF" and resid 81 and name HG2%)
2.300 0.700 0.700 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.63615E-02 ppm1 4.710 ppm2 0.403 CV 1
ASSI { 1094}
(( segid "SUPF" and resid 81 and name HB ))
(( segid "SUPF" and resid 37 and name HB ))
2.600 0.800 0.800 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.30129E-02 ppm1 1.179 ppm2 1.785 CV 1
ASSI { 1095}
(( segid "SUPF" and resid 81 and name HB ))
( segid "SUPF" and resid 81 and name HG1%)
2.200 0.600 0.600 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.72921E-02 ppm1 1.177 ppm2 0.571 CV 1
ASSI { 1096}
(( segid "SUPF" and resid 81 and name HB ))
( segid "SUPF" and resid 81 and name HG2%)
2.200 0.600 0.600 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.73204E-02 ppm1 1.178 ppm2 0.403 CV 1
ASSI { 1101}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 52 and name HD2 ))
3.200 1.300 1.300 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.51702E-03 ppm1 0.585 ppm2 7.247 CV 1
ASSI { 1102}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 55 and name HB1 ))
2.700 0.900 0.900 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.24483E-02 ppm1 0.571 ppm2 2.924 CV 1
ASSI { 1104}
( segid "SUPF" and resid 81 and name HG1%)
( segid "SUPF" and resid 55 and name HD% )
2.800 1.000 1.000 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.25608E-02 ppm1 0.573 ppm2 7.831 CV 1
ASSI { 1105}
( segid "SUPF" and resid 81 and name HG1%)
( segid "SUPF" and resid 55 and name HE% )
3.700 1.700 1.700 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.83318E-03 ppm1 0.577 ppm2 7.323 CV 1
ASSI { 1106}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 61 and name HG11))
3.700 1.700 1.700 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.23198E-02 ppm1 0.581 ppm2 1.486 CV 1
ASSI { 1108}
( segid "SUPF" and resid 81 and name HG1%)
( segid "SUPF" and resid 64 and name HB% )
2.300 0.600 0.600 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.60114E-02 ppm1 0.582 ppm2 1.343 CV 1
ASSI { 1110}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 83 and name HG1 ))
4.100 2.100 1.900 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.49224E-03 ppm1 0.578 ppm2 2.268 CV 1
ASSI { 1111}
( segid "SUPF" and resid 81 and name HG2%)
(( segid "SUPF" and resid 51 and name HG ))
2.400 0.700 0.700 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.43576E-02 ppm1 0.406 ppm2 1.579 CV 1
ASSI { 1112}
( segid "SUPF" and resid 81 and name HG2%)
(( segid "SUPF" and resid 52 and name HA ))
3.700 1.700 1.700 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.70530E-03 ppm1 0.415 ppm2 3.818 CV 1
ASSI { 1115}
( segid "SUPF" and resid 81 and name HG2%)
(( segid "SUPF" and resid 37 and name HB ))
3.900 1.900 1.900 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.80017E-03 ppm1 0.414 ppm2 1.786 CV 1
ASSI { 1118}
( segid "SUPF" and resid 81 and name HG2%)
( segid "SUPF" and resid 55 and name HD% )
2.600 0.800 0.800 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.34818E-02 ppm1 0.408 ppm2 7.833 CV 1
ASSI { 1119}
( segid "SUPF" and resid 81 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
3.000 1.100 1.100 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.19704E-02 ppm1 0.408 ppm2 7.324 CV 1
ASSI { 1121}
( segid "SUPF" and resid 81 and name HG2%)
( segid "SUPF" and resid 64 and name HB% )
2.100 0.600 0.600 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.80396E-02 ppm1 0.404 ppm2 1.342 CV 1
ASSI { 1122}
( segid "SUPF" and resid 81 and name HG2%)
(( segid "SUPF" and resid 80 and name HA ))
3.700 1.700 1.700 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.65964E-03 ppm1 0.406 ppm2 5.848 CV 1
ASSI { 1123}
(( segid "SUPF" and resid 82 and name HA ))
(( segid "SUPF" and resid 35 and name HB ))
3.600 1.600 1.600 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.81107E-03 ppm1 5.101 ppm2 4.530 CV 1
ASSI { 1125}
(( segid "SUPF" and resid 82 and name HA ))
(( segid "SUPF" and resid 36 and name HB2 ))
4.300 2.300 1.700 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.38895E-03 ppm1 5.087 ppm2 1.980 CV 1
ASSI { 1127}
(( segid "SUPF" and resid 82 and name HA ))
(( segid "SUPF" and resid 36 and name HG2 ))
2.900 2.900 3.100 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.10754E-02 ppm1 5.090 ppm2 1.394 CV 1
ASSI { 1128}
(( segid "SUPF" and resid 82 and name HA ))
( segid "SUPF" and resid 81 and name HG1%)
3.700 1.700 1.700 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.60183E-03 ppm1 5.095 ppm2 0.574 CV 1
ASSI { 1135}
(( segid "SUPF" and resid 82 and name HB ))
(( segid "SUPF" and resid 36 and name HA ))
4.300 2.300 1.700 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.52490E-03 ppm1 3.934 ppm2 5.016 CV 1
ASSI { 1136}
(( segid "SUPF" and resid 82 and name HB ))
( segid "SUPF" and resid 61 and name HG2%)
4.400 2.400 1.600 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.45660E-03 ppm1 3.944 ppm2 0.575 CV 1
ASSI { 1138}
(( segid "SUPF" and resid 82 and name HB ))
(( segid "SUPF" and resid 63 and name HG1 ))
3.000 3.000 3.000 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.79782E-03 ppm1 3.945 ppm2 2.207 CV 1
ASSI { 1139}
(( segid "SUPF" and resid 82 and name HB ))
(( segid "SUPF" and resid 82 and name HA ))
2.900 1.000 1.000 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.20276E-02 ppm1 3.939 ppm2 5.095 CV 1
ASSI { 1140}
(( segid "SUPF" and resid 82 and name HB ))
( segid "SUPF" and resid 82 and name HG2%)
2.100 0.500 0.500 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.12588E-01 ppm1 3.939 ppm2 1.153 CV 1
ASSI { 1142}
(( segid "SUPF" and resid 83 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
4.200 2.300 1.800 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.93558E-03 ppm1 5.110 ppm2 0.416 CV 1
ASSI { 1144}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 61 and name HG11))
4.300 2.300 1.700 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.75571E-03 ppm1 5.111 ppm2 1.485 CV 1
ASSI { 1145}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 61 and name HG12))
3.400 1.500 1.500 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.73776E-03 ppm1 5.111 ppm2 0.986 CV 1
ASSI { 1147}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 83 and name HB1 ))
2.300 0.700 0.700 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.40737E-02 ppm1 5.111 ppm2 2.550 CV 1
ASSI { 1148}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 83 and name HB2 ))
3.100 1.200 1.200 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.18440E-02 ppm1 5.113 ppm2 2.015 CV 1
ASSI { 1149}
(( segid "SUPF" and resid 83 and name HA ))
( segid "SUPF" and resid 83 and name HE% )
2.800 1.000 1.000 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.28447E-02 ppm1 5.111 ppm2 1.938 CV 1
ASSI { 1150}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 83 and name HG1 ))
3.700 1.700 1.700 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.10787E-02 ppm1 5.109 ppm2 2.264 CV 1
ASSI { 1153}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 37 and name HD1%)
3.400 1.400 1.400 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.17245E-02 ppm1 1.939 ppm2 0.681 CV 1
OR { 1153}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 37 and name HG2%)
ASSI { 1155}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 55 and name HB2 ))
3.900 1.900 1.900 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.13436E-02 ppm1 1.940 ppm2 3.286 CV 1
ASSI { 1157}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 55 and name HD% )
3.300 1.400 1.400 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.13197E-02 ppm1 1.939 ppm2 7.832 CV 1
ASSI { 1158}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 58 and name HB1 ))
3.100 1.200 1.200 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.39539E-02 ppm1 1.940 ppm2 2.906 CV 1
ASSI { 1160}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 58 and name HD% )
3.200 1.200 1.200 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.20911E-02 ppm1 1.940 ppm2 7.374 CV 1
ASSI { 1161}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 59 and name HA1 ))
2.800 1.000 1.000 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.19962E-02 ppm1 1.941 ppm2 4.535 CV 1
ASSI { 1162}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 61 and name HA ))
3.300 1.400 1.400 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.16043E-02 ppm1 1.942 ppm2 4.160 CV 1
ASSI { 1163}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 61 and name HG12))
2.700 0.900 0.900 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.16366E-02 ppm1 1.943 ppm2 0.992 CV 1
ASSI { 1164}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 81 and name HG1%)
2.900 1.100 1.100 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.26827E-02 ppm1 1.936 ppm2 0.575 CV 1
ASSI { 1165}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 81 and name HG2%)
2.300 2.300 3.700 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.38791E-02 ppm1 1.940 ppm2 0.414 CV 1
ASSI { 1167}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 83 and name HB1 ))
2.200 0.600 0.600 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.58012E-02 ppm1 1.940 ppm2 2.553 CV 1
ASSI { 1168}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 83 and name HG1 ))
2.700 0.900 0.900 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.30365E-02 ppm1 1.938 ppm2 2.262 CV 1
ASSI { 1169}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 88 and name HA ))
3.300 1.400 1.400 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.25286E-02 ppm1 1.941 ppm2 4.326 CV 1
ASSI { 1170}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 88 and name HB1 ))
2.300 0.700 0.700 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.61693E-02 ppm1 1.940 ppm2 3.872 CV 1
ASSI { 1171}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 88 and name HB2 ))
3.000 1.100 1.100 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.43647E-02 ppm1 1.941 ppm2 4.055 CV 1
ASSI { 1172}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 92 and name HB% )
2.700 0.900 0.900 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.36015E-02 ppm1 1.938 ppm2 1.440 CV 1
ASSI { 1175}
(( segid "SUPF" and resid 83 and name HG2 ))
( segid "SUPF" and resid 37 and name HD1%)
3.000 1.100 1.100 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.18784E-02 ppm1 2.558 ppm2 0.682 CV 1
ASSI { 1176}
(( segid "SUPF" and resid 84 and name HG1 ))
(( segid "SUPF" and resid 84 and name HA ))
2.900 1.000 1.000 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.48340E-02 ppm1 1.381 ppm2 4.102 CV 1
OR { 1176}
(( segid "SUPF" and resid 84 and name HG2 ))
(( segid "SUPF" and resid 84 and name HA ))
ASSI { 1177}
(( segid "SUPF" and resid 85 and name HA ))
(( segid "SUPF" and resid 86 and name HB1 ))
4.700 2.800 1.300 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.39932E-03 ppm1 4.889 ppm2 1.897 CV 1
OR { 1177}
(( segid "SUPF" and resid 85 and name HA ))
(( segid "SUPF" and resid 86 and name HB2 ))
ASSI { 1178}
(( segid "SUPF" and resid 85 and name HA ))
( segid "SUPF" and resid 35 and name HG2%)
2.600 0.900 0.900 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.42654E-02 ppm1 4.890 ppm2 0.811 CV 1
ASSI { 1179}
(( segid "SUPF" and resid 85 and name HA ))
(( segid "SUPF" and resid 85 and name HB1 ))
2.500 0.800 0.800 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.86890E-02 ppm1 4.896 ppm2 2.998 CV 1
ASSI { 1180}
(( segid "SUPF" and resid 85 and name HA ))
(( segid "SUPF" and resid 85 and name HB2 ))
2.400 0.700 0.700 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.70608E-02 ppm1 4.888 ppm2 2.755 CV 1
ASSI { 1182}
(( segid "SUPF" and resid 85 and name HB1 ))
(( segid "SUPF" and resid 85 and name HB2 ))
1.800 0.400 0.400 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.14527E-01 ppm1 2.998 ppm2 2.750 CV 1
ASSI { 1185}
(( segid "SUPF" and resid 86 and name HB2 ))
(( segid "SUPF" and resid 34 and name HB1 ))
3.400 1.500 1.500 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.10729E-02 ppm1 1.885 ppm2 2.788 CV 1
OR { 1185}
(( segid "SUPF" and resid 86 and name HB1 ))
(( segid "SUPF" and resid 34 and name HB1 ))
ASSI { 1187}
(( segid "SUPF" and resid 86 and name HB2 ))
( segid "SUPF" and resid 34 and name HD% )
4.100 2.100 1.900 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.70042E-03 ppm1 1.881 ppm2 7.201 CV 1
OR { 1187}
(( segid "SUPF" and resid 86 and name HB1 ))
( segid "SUPF" and resid 34 and name HD% )
ASSI { 1188}
(( segid "SUPF" and resid 86 and name HB1 ))
( segid "SUPF" and resid 35 and name HG2%)
3.200 1.300 1.300 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.22824E-02 ppm1 1.878 ppm2 0.812 CV 1
OR { 1188}
(( segid "SUPF" and resid 86 and name HB2 ))
( segid "SUPF" and resid 35 and name HG2%)
ASSI { 1189}
(( segid "SUPF" and resid 86 and name HB1 ))
(( segid "SUPF" and resid 86 and name HD1 ))
2.600 0.800 0.800 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.54134E-02 ppm1 1.877 ppm2 2.975 CV 1
OR { 1189}
(( segid "SUPF" and resid 86 and name HB1 ))
(( segid "SUPF" and resid 86 and name HD2 ))
OR { 1189}
(( segid "SUPF" and resid 86 and name HB2 ))
(( segid "SUPF" and resid 86 and name HD1 ))
OR { 1189}
(( segid "SUPF" and resid 86 and name HB2 ))
(( segid "SUPF" and resid 86 and name HD2 ))
ASSI { 1190}
(( segid "SUPF" and resid 86 and name HD2 ))
(( segid "SUPF" and resid 34 and name HB2 ))
3.200 1.300 1.300 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.14060E-02 ppm1 2.982 ppm2 3.460 CV 1
OR { 1190}
(( segid "SUPF" and resid 86 and name HD1 ))
(( segid "SUPF" and resid 34 and name HB2 ))
ASSI { 1191}
(( segid "SUPF" and resid 86 and name HD2 ))
( segid "SUPF" and resid 34 and name HD% )
3.300 1.300 1.300 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.14148E-02 ppm1 2.975 ppm2 7.200 CV 1
OR { 1191}
(( segid "SUPF" and resid 86 and name HD1 ))
( segid "SUPF" and resid 34 and name HD% )
ASSI { 1193}
(( segid "SUPF" and resid 86 and name HD1 ))
(( segid "SUPF" and resid 86 and name HA ))
3.400 1.400 1.400 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.22146E-02 ppm1 2.979 ppm2 4.028 CV 1
OR { 1193}
(( segid "SUPF" and resid 86 and name HD2 ))
(( segid "SUPF" and resid 86 and name HA ))
ASSI { 1195}
(( segid "SUPF" and resid 86 and name HD1 ))
(( segid "SUPF" and resid 86 and name HG1 ))
2.600 0.800 0.800 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.39995E-02 ppm1 2.980 ppm2 1.783 CV 1
OR { 1195}
(( segid "SUPF" and resid 86 and name HD2 ))
(( segid "SUPF" and resid 86 and name HG1 ))
ASSI { 1196}
(( segid "SUPF" and resid 86 and name HD2 ))
(( segid "SUPF" and resid 86 and name HG2 ))
2.500 0.800 0.800 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.50296E-02 ppm1 2.976 ppm2 1.642 CV 1
OR { 1196}
(( segid "SUPF" and resid 86 and name HD1 ))
(( segid "SUPF" and resid 86 and name HG2 ))
ASSI { 1197}
(( segid "SUPF" and resid 86 and name HG1 ))
(( segid "SUPF" and resid 34 and name HB2 ))
3.500 1.600 1.600 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.98358E-03 ppm1 1.787 ppm2 3.459 CV 1
ASSI { 1199}
(( segid "SUPF" and resid 86 and name HG2 ))
(( segid "SUPF" and resid 34 and name HB2 ))
3.700 1.700 1.700 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.58384E-03 ppm1 1.646 ppm2 3.457 CV 1
ASSI { 1200}
(( segid "SUPF" and resid 86 and name HG2 ))
(( segid "SUPF" and resid 86 and name HA ))
3.100 1.200 1.200 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.17287E-02 ppm1 1.633 ppm2 4.027 CV 1
ASSI { 1201}
(( segid "SUPF" and resid 87 and name HA ))
( segid "SUPF" and resid 87 and name HB% )
2.100 0.600 0.600 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.16452E-01 ppm1 4.234 ppm2 1.519 CV 1
ASSI { 1205}
(( segid "SUPF" and resid 88 and name HB1 ))
(( segid "SUPF" and resid 59 and name HA1 ))
3.000 1.100 1.100 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.92437E-03 ppm1 3.876 ppm2 4.537 CV 1
ASSI { 1208}
(( segid "SUPF" and resid 88 and name HB1 ))
(( segid "SUPF" and resid 88 and name HA ))
2.500 0.800 0.800 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.41537E-02 ppm1 3.885 ppm2 4.328 CV 1
ASSI { 1209}
(( segid "SUPF" and resid 88 and name HB1 ))
(( segid "SUPF" and resid 88 and name HB2 ))
1.900 0.500 0.500 peak 1209 spectrum 1 weight 0.10000E+01 volume 0.75957E-02 ppm1 3.876 ppm2 4.054 CV 1
ASSI { 1210}
(( segid "SUPF" and resid 88 and name HB2 ))
(( segid "SUPF" and resid 59 and name HA1 ))
3.600 1.700 1.700 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.77903E-03 ppm1 4.034 ppm2 4.538 CV 1
ASSI { 1213}
(( segid "SUPF" and resid 88 and name HB2 ))
(( segid "SUPF" and resid 88 and name HA ))
2.800 1.000 1.000 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.35447E-02 ppm1 4.057 ppm2 4.327 CV 1
ASSI { 1217}
(( segid "SUPF" and resid 89 and name HA ))
(( segid "SUPF" and resid 83 and name HB2 ))
3.600 1.600 1.600 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.10136E-02 ppm1 4.100 ppm2 2.013 CV 1
ASSI { 1218}
(( segid "SUPF" and resid 89 and name HA ))
(( segid "SUPF" and resid 83 and name HG1 ))
2.400 0.700 0.700 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.24868E-02 ppm1 4.100 ppm2 2.264 CV 1
ASSI { 1224}
( segid "SUPF" and resid 89 and name HB% )
(( segid "SUPF" and resid 89 and name HA ))
2.200 0.600 0.600 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.74867E-02 ppm1 1.556 ppm2 4.101 CV 1
ASSI { 1225}
(( segid "SUPF" and resid 90 and name HA ))
(( segid "SUPF" and resid 90 and name HG2 ))
3.300 1.300 1.300 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.20537E-02 ppm1 3.998 ppm2 2.542 CV 1
ASSI { 1226}
(( segid "SUPF" and resid 90 and name HB1 ))
(( segid "SUPF" and resid 90 and name HG2 ))
2.500 0.800 0.800 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.42562E-02 ppm1 2.220 ppm2 2.538 CV 1
ASSI { 1227}
(( segid "SUPF" and resid 90 and name HB2 ))
(( segid "SUPF" and resid 90 and name HG2 ))
3.200 1.300 1.300 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.24053E-02 ppm1 2.087 ppm2 2.539 CV 1
ASSI { 1228}
(( segid "SUPF" and resid 90 and name HG1 ))
(( segid "SUPF" and resid 87 and name HA ))
3.600 1.600 1.600 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.12824E-02 ppm1 2.237 ppm2 4.226 CV 1
ASSI { 1229}
(( segid "SUPF" and resid 90 and name HG1 ))
(( segid "SUPF" and resid 90 and name HA ))
2.900 1.100 1.100 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.44597E-02 ppm1 2.238 ppm2 3.997 CV 1
ASSI { 1230}
(( segid "SUPF" and resid 90 and name HG1 ))
(( segid "SUPF" and resid 90 and name HG2 ))
1.800 0.400 0.400 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.11910E-01 ppm1 2.238 ppm2 2.540 CV 1
ASSI { 1231}
(( segid "SUPF" and resid 90 and name HG2 ))
(( segid "SUPF" and resid 87 and name HA ))
3.100 1.200 1.200 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.10723E-02 ppm1 2.542 ppm2 4.230 CV 1
ASSI { 1233}
(( segid "SUPF" and resid 91 and name HA ))
( segid "SUPF" and resid 58 and name HD% )
4.200 2.200 1.800 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.72319E-03 ppm1 3.975 ppm2 7.374 CV 1
ASSI { 1234}
(( segid "SUPF" and resid 91 and name HA ))
(( segid "SUPF" and resid 91 and name HB1 ))
2.900 1.100 1.100 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.25911E-02 ppm1 3.980 ppm2 2.335 CV 1
ASSI { 1235}
(( segid "SUPF" and resid 91 and name HA ))
(( segid "SUPF" and resid 91 and name HB2 ))
2.200 0.600 0.600 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.93401E-02 ppm1 3.987 ppm2 2.073 CV 1
ASSI { 1237}
(( segid "SUPF" and resid 91 and name HA ))
(( segid "SUPF" and resid 91 and name HD2 ))
4.300 2.300 1.700 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.90239E-03 ppm1 3.969 ppm2 3.584 CV 1
ASSI { 1238}
(( segid "SUPF" and resid 91 and name HB1 ))
( segid "SUPF" and resid 58 and name HD% )
3.200 1.300 1.300 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.13911E-02 ppm1 2.332 ppm2 7.372 CV 1
ASSI { 1241}
(( segid "SUPF" and resid 91 and name HB1 ))
(( segid "SUPF" and resid 91 and name HD2 ))
3.400 1.400 1.400 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.10637E-02 ppm1 2.332 ppm2 3.586 CV 1
ASSI { 1242}
(( segid "SUPF" and resid 91 and name HB2 ))
( segid "SUPF" and resid 58 and name HD% )
3.700 1.700 1.700 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.21284E-02 ppm1 2.056 ppm2 7.373 CV 1
ASSI { 1246}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 58 and name HA ))
3.100 1.200 1.200 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.12485E-02 ppm1 3.438 ppm2 4.706 CV 1
ASSI { 1247}
(( segid "SUPF" and resid 91 and name HD1 ))
( segid "SUPF" and resid 58 and name HD% )
3.300 1.400 1.400 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.85293E-03 ppm1 3.428 ppm2 7.374 CV 1
ASSI { 1248}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 91 and name HA ))
4.400 2.400 1.600 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.87335E-03 ppm1 3.429 ppm2 3.985 CV 1
ASSI { 1249}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 91 and name HB1 ))
3.000 1.100 1.100 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.14051E-02 ppm1 3.429 ppm2 2.330 CV 1
ASSI { 1250}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 91 and name HB2 ))
2.900 1.000 1.000 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.40897E-02 ppm1 3.430 ppm2 2.070 CV 1
ASSI { 1252}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 91 and name HG1 ))
2.900 1.100 1.100 peak 1252 spectrum 1 weight 0.10000E+01 volume 0.30306E-02 ppm1 3.429 ppm2 1.736 CV 1
ASSI { 1253}
(( segid "SUPF" and resid 91 and name HD2 ))
(( segid "SUPF" and resid 58 and name HA ))
3.900 1.900 1.900 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.10024E-02 ppm1 3.597 ppm2 4.702 CV 1
ASSI { 1254}
(( segid "SUPF" and resid 91 and name HD2 ))
( segid "SUPF" and resid 58 and name HD% )
4.300 2.300 1.700 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.58166E-03 ppm1 3.585 ppm2 7.374 CV 1
ASSI { 1257}
(( segid "SUPF" and resid 91 and name HD2 ))
(( segid "SUPF" and resid 91 and name HB2 ))
2.400 0.700 0.700 peak 1257 spectrum 1 weight 0.10000E+01 volume 0.41621E-02 ppm1 3.589 ppm2 2.074 CV 1
ASSI { 1258}
(( segid "SUPF" and resid 91 and name HD2 ))
(( segid "SUPF" and resid 91 and name HD1 ))
1.700 0.300 0.500 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.15608E-01 ppm1 3.590 ppm2 3.429 CV 1
ASSI { 1259}
(( segid "SUPF" and resid 91 and name HD2 ))
(( segid "SUPF" and resid 91 and name HG1 ))
2.500 0.800 0.800 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.36698E-02 ppm1 3.591 ppm2 1.734 CV 1
ASSI { 1260}
(( segid "SUPF" and resid 91 and name HG1 ))
( segid "SUPF" and resid 58 and name HD% )
4.400 2.400 1.600 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.75469E-03 ppm1 1.738 ppm2 7.375 CV 1
ASSI { 1261}
(( segid "SUPF" and resid 91 and name HG1 ))
(( segid "SUPF" and resid 91 and name HA ))
2.600 0.800 0.800 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.34228E-02 ppm1 1.745 ppm2 3.983 CV 1
ASSI { 1264}
(( segid "SUPF" and resid 91 and name HG2 ))
( segid "SUPF" and resid 58 and name HD% )
3.000 1.200 1.200 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.78716E-03 ppm1 2.090 ppm2 7.378 CV 1
ASSI { 1265}
(( segid "SUPF" and resid 91 and name HG2 ))
(( segid "SUPF" and resid 91 and name HA ))
2.500 0.800 0.800 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.64518E-02 ppm1 2.081 ppm2 3.993 CV 1
ASSI { 1268}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 37 and name HD1%)
4.600 2.700 1.400 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.54782E-03 ppm1 2.017 ppm2 0.684 CV 1
ASSI { 1269}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 54 and name HE% )
4.400 2.400 1.600 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.26967E-03 ppm1 2.016 ppm2 6.483 CV 1
ASSI { 1270}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 55 and name HD% )
4.300 2.300 1.700 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.69867E-03 ppm1 2.016 ppm2 7.833 CV 1
ASSI { 1271}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 55 and name HE% )
4.200 2.200 1.800 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.61500E-03 ppm1 2.015 ppm2 7.329 CV 1
ASSI { 1272}
(( segid "SUPF" and resid 92 and name HA ))
(( segid "SUPF" and resid 58 and name HB1 ))
3.900 1.900 1.900 peak 1272 spectrum 1 weight 0.10000E+01 volume 0.44963E-03 ppm1 2.017 ppm2 2.906 CV 1
ASSI { 1273}
(( segid "SUPF" and resid 92 and name HA ))
(( segid "SUPF" and resid 58 and name HB2 ))
4.100 2.100 1.900 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.44692E-03 ppm1 2.021 ppm2 3.640 CV 1
ASSI { 1274}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 58 and name HD% )
3.000 1.100 1.100 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.18358E-02 ppm1 2.021 ppm2 7.374 CV 1
ASSI { 1275}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 58 and name HE% )
3.100 1.200 1.200 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.17363E-02 ppm1 2.017 ppm2 7.003 CV 1
ASSI { 1276}
(( segid "SUPF" and resid 92 and name HA ))
(( segid "SUPF" and resid 58 and name HZ ))
3.500 1.600 1.600 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.84426E-03 ppm1 2.020 ppm2 7.282 CV 1
ASSI { 1277}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 92 and name HB% )
2.300 0.600 0.600 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.88456E-02 ppm1 2.019 ppm2 1.436 CV 1
ASSI { 1279}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 54 and name HD% )
3.700 1.700 1.700 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.24533E-03 ppm1 1.443 ppm2 6.284 CV 1
ASSI { 1280}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 54 and name HE% )
3.400 3.400 2.600 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.38355E-03 ppm1 1.441 ppm2 6.477 CV 1
ASSI { 1281}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 55 and name HD% )
2.300 0.700 0.700 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.64711E-02 ppm1 1.437 ppm2 7.831 CV 1
ASSI { 1282}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 55 and name HE% )
2.400 0.700 0.700 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.53781E-02 ppm1 1.439 ppm2 7.324 CV 1
ASSI { 1283}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 55 and name HZ ))
4.300 2.300 1.700 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.65163E-03 ppm1 1.444 ppm2 7.201 CV 1
ASSI { 1284}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 58 and name HB1 ))
2.900 1.100 1.100 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.32316E-02 ppm1 1.424 ppm2 2.906 CV 1
ASSI { 1285}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 58 and name HB2 ))
2.900 1.000 1.000 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.17815E-02 ppm1 1.438 ppm2 3.645 CV 1
ASSI { 1286}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 58 and name HD% )
2.600 0.800 0.800 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.41582E-02 ppm1 1.440 ppm2 7.373 CV 1
ASSI { 1287}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 58 and name HE% )
3.200 1.300 1.300 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.16807E-02 ppm1 1.439 ppm2 7.003 CV 1
ASSI { 1288}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 83 and name HG1 ))
3.200 1.300 1.300 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.11663E-02 ppm1 1.439 ppm2 2.263 CV 1
ASSI { 1289}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 83 and name HG2 ))
3.600 1.600 1.600 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.11459E-02 ppm1 1.436 ppm2 2.558 CV 1
ASSI { 1290}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 89 and name HA ))
2.500 0.800 0.800 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.46663E-02 ppm1 1.440 ppm2 4.100 CV 1
ASSI { 1293}
(( segid "SUPF" and resid 93 and name HA ))
(( segid "SUPF" and resid 93 and name HB2 ))
2.700 0.900 0.900 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.28573E-02 ppm1 4.284 ppm2 2.794 CV 1
ASSI { 1294}
(( segid "SUPF" and resid 93 and name HB1 ))
(( segid "SUPF" and resid 90 and name HA ))
3.300 1.400 1.400 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.90323E-03 ppm1 3.051 ppm2 3.999 CV 1
ASSI { 1295}
(( segid "SUPF" and resid 93 and name HB1 ))
(( segid "SUPF" and resid 93 and name HA ))
2.800 1.000 1.000 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.39929E-02 ppm1 3.048 ppm2 4.283 CV 1
ASSI { 1296}
(( segid "SUPF" and resid 93 and name HB1 ))
(( segid "SUPF" and resid 93 and name HB2 ))
1.900 0.500 0.500 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.98154E-02 ppm1 3.048 ppm2 2.792 CV 1
ASSI { 1297}
(( segid "SUPF" and resid 93 and name HB2 ))
(( segid "SUPF" and resid 90 and name HA ))
3.200 1.300 1.300 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.13210E-02 ppm1 2.793 ppm2 3.996 CV 1
ASSI { 1300}
(( segid "SUPF" and resid 94 and name HA ))
(( segid "SUPF" and resid 94 and name HB2 ))
2.500 0.800 0.800 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.57834E-02 ppm1 3.901 ppm2 1.907 CV 1
ASSI { 1301}
(( segid "SUPF" and resid 94 and name HA ))
(( segid "SUPF" and resid 94 and name HG1 ))
3.200 1.300 1.300 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.22564E-02 ppm1 3.895 ppm2 1.548 CV 1
ASSI { 1302}
(( segid "SUPF" and resid 94 and name HA ))
(( segid "SUPF" and resid 94 and name HG2 ))
3.100 1.200 1.200 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.26227E-02 ppm1 3.894 ppm2 1.589 CV 1
ASSI { 1303}
(( segid "SUPF" and resid 94 and name HD1 ))
(( segid "SUPF" and resid 94 and name HA ))
2.600 0.900 0.900 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.34676E-02 ppm1 1.756 ppm2 3.899 CV 1
OR { 1303}
(( segid "SUPF" and resid 94 and name HD2 ))
(( segid "SUPF" and resid 94 and name HA ))
ASSI { 1304}
(( segid "SUPF" and resid 94 and name HG2 ))
(( segid "SUPF" and resid 91 and name HA ))
2.800 1.000 1.000 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.24966E-02 ppm1 1.572 ppm2 3.979 CV 1
OR { 1304}
(( segid "SUPF" and resid 94 and name HG1 ))
(( segid "SUPF" and resid 91 and name HA ))
ASSI { 1305}
(( segid "SUPF" and resid 94 and name HG2 ))
(( segid "SUPF" and resid 94 and name HA ))
2.800 1.000 1.000 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.50181E-02 ppm1 1.585 ppm2 3.899 CV 1
OR { 1305}
(( segid "SUPF" and resid 94 and name HG1 ))
(( segid "SUPF" and resid 94 and name HA ))
ASSI { 1306}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 95 and name HB1 ))
2.600 0.800 0.800 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.34902E-02 ppm1 5.140 ppm2 2.498 CV 1
ASSI { 1307}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 95 and name HB2 ))
3.000 1.100 1.100 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.23023E-02 ppm1 5.140 ppm2 2.824 CV 1
ASSI { 1308}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HA ))
3.600 1.600 1.600 peak 1308 spectrum 1 weight 0.10000E+01 volume 0.11630E-02 ppm1 5.134 ppm2 4.702 CV 1
ASSI { 1309}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HB2 ))
5.500 3.700 0.500 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.35028E-03 ppm1 5.131 ppm2 2.142 CV 1
ASSI { 1310}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HD1 ))
2.400 0.700 0.700 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.64639E-02 ppm1 5.141 ppm2 3.995 CV 1
ASSI { 1311}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HD2 ))
2.300 0.600 0.600 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.58726E-02 ppm1 5.141 ppm2 4.104 CV 1
ASSI { 1312}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HG1 ))
4.300 2.300 1.700 peak 1312 spectrum 1 weight 0.10000E+01 volume 0.16677E-02 ppm1 5.138 ppm2 2.080 CV 1
OR { 1312}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HG2 ))
ASSI { 1314}
(( segid "SUPF" and resid 95 and name HB1 ))
(( segid "SUPF" and resid 96 and name HD1 ))
4.500 2.500 1.500 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.80830E-03 ppm1 2.496 ppm2 3.992 CV 1
ASSI { 1317}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 96 and name HB1 ))
2.400 0.700 0.700 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.56234E-02 ppm1 4.686 ppm2 2.502 CV 1
ASSI { 1318}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 96 and name HB2 ))
2.900 1.000 1.000 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.40081E-02 ppm1 4.686 ppm2 2.146 CV 1
ASSI { 1319}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 96 and name HG2 ))
3.500 1.600 1.600 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.20964E-02 ppm1 4.682 ppm2 2.074 CV 1
OR { 1319}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 96 and name HG1 ))
ASSI { 1320}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 107 and name HB ))
2.700 0.900 0.900 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.32290E-02 ppm1 4.687 ppm2 2.045 CV 1
ASSI { 1321}
(( segid "SUPF" and resid 96 and name HA ))
( segid "SUPF" and resid 107 and name HG2%)
3.300 1.300 1.300 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.24948E-02 ppm1 4.686 ppm2 1.036 CV 1
OR { 1321}
(( segid "SUPF" and resid 96 and name HA ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 1323}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HB1 ))
3.300 1.400 1.400 peak 1323 spectrum 1 weight 0.10000E+01 volume 0.15671E-02 ppm1 3.999 ppm2 2.501 CV 1
ASSI { 1324}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HB2 ))
4.300 2.300 1.700 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.79294E-03 ppm1 4.003 ppm2 2.150 CV 1
ASSI { 1325}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HD2 ))
1.900 0.500 0.500 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.78390E-02 ppm1 3.998 ppm2 4.103 CV 1
ASSI { 1326}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HG1 ))
2.600 0.800 0.800 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.40663E-02 ppm1 3.997 ppm2 2.079 CV 1
OR { 1326}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HG2 ))
ASSI { 1328}
(( segid "SUPF" and resid 96 and name HD2 ))
(( segid "SUPF" and resid 96 and name HB1 ))
3.800 1.800 1.800 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.15232E-02 ppm1 4.102 ppm2 2.502 CV 1
ASSI { 1329}
(( segid "SUPF" and resid 96 and name HD2 ))
(( segid "SUPF" and resid 96 and name HB2 ))
4.100 2.100 1.900 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.75126E-03 ppm1 4.098 ppm2 2.143 CV 1
ASSI { 1331}
(( segid "SUPF" and resid 96 and name HD2 ))
(( segid "SUPF" and resid 96 and name HG2 ))
2.500 0.800 0.800 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.41494E-02 ppm1 4.099 ppm2 2.078 CV 1
OR { 1331}
(( segid "SUPF" and resid 96 and name HD2 ))
(( segid "SUPF" and resid 96 and name HG1 ))
ASSI { 1333}
(( segid "SUPF" and resid 96 and name HG2 ))
(( segid "SUPF" and resid 96 and name HB1 ))
2.500 0.800 0.800 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.49503E-02 ppm1 2.080 ppm2 2.500 CV 1
OR { 1333}
(( segid "SUPF" and resid 96 and name HG1 ))
(( segid "SUPF" and resid 96 and name HB1 ))
ASSI { 1338}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 97 and name HB1 ))
2.600 0.800 0.800 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.28729E-02 ppm1 6.002 ppm2 2.490 CV 1
ASSI { 1340}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 98 and name HD1 ))
2.700 0.900 0.900 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.30198E-02 ppm1 6.003 ppm2 3.582 CV 1
ASSI { 1341}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 98 and name HD2 ))
2.300 0.700 0.700 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.47497E-02 ppm1 6.003 ppm2 3.194 CV 1
ASSI { 1342}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 98 and name HG1 ))
4.800 2.800 1.200 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.62814E-03 ppm1 6.001 ppm2 1.944 CV 1
OR { 1342}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 1344}
(( segid "SUPF" and resid 97 and name HA ))
( segid "SUPF" and resid 105 and name HB% )
4.100 2.100 1.900 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.70783E-03 ppm1 6.006 ppm2 1.280 CV 1
ASSI { 1345}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 106 and name HA ))
2.600 0.900 0.900 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.33826E-02 ppm1 6.002 ppm2 5.497 CV 1
ASSI { 1346}
(( segid "SUPF" and resid 97 and name HA ))
( segid "SUPF" and resid 107 and name HG2%)
4.100 2.200 1.900 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.10663E-02 ppm1 6.000 ppm2 1.037 CV 1
OR { 1346}
(( segid "SUPF" and resid 97 and name HA ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 1348}
(( segid "SUPF" and resid 97 and name HB1 ))
(( segid "SUPF" and resid 97 and name HB2 ))
1.800 0.400 0.400 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.13830E-01 ppm1 2.486 ppm2 2.786 CV 1
ASSI { 1349}
(( segid "SUPF" and resid 97 and name HB2 ))
(( segid "SUPF" and resid 97 and name HA ))
2.900 1.000 1.000 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.38231E-02 ppm1 2.782 ppm2 6.004 CV 1
ASSI { 1351}
(( segid "SUPF" and resid 98 and name HA ))
(( segid "SUPF" and resid 98 and name HB1 ))
2.500 0.800 0.800 peak 1351 spectrum 1 weight 0.10000E+01 volume 0.39317E-02 ppm1 4.458 ppm2 2.135 CV 1
ASSI { 1352}
(( segid "SUPF" and resid 98 and name HA ))
(( segid "SUPF" and resid 98 and name HB2 ))
2.700 0.900 0.900 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.42259E-02 ppm1 4.451 ppm2 1.550 CV 1
ASSI { 1354}
(( segid "SUPF" and resid 98 and name HA ))
(( segid "SUPF" and resid 98 and name HD2 ))
3.800 1.800 1.800 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.76674E-03 ppm1 4.461 ppm2 3.184 CV 1
ASSI { 1355}
(( segid "SUPF" and resid 98 and name HB1 ))
( segid "SUPF" and resid 54 and name HE% )
4.200 2.200 1.800 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.57986E-03 ppm1 2.136 ppm2 6.480 CV 1
ASSI { 1358}
(( segid "SUPF" and resid 98 and name HD1 ))
(( segid "SUPF" and resid 98 and name HB1 ))
3.400 1.500 1.500 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.80691E-03 ppm1 3.583 ppm2 2.135 CV 1
ASSI { 1359}
(( segid "SUPF" and resid 98 and name HD1 ))
(( segid "SUPF" and resid 98 and name HB2 ))
3.500 1.600 1.600 peak 1359 spectrum 1 weight 0.10000E+01 volume 0.23395E-02 ppm1 3.590 ppm2 1.564 CV 1
ASSI { 1360}
(( segid "SUPF" and resid 98 and name HD1 ))
(( segid "SUPF" and resid 98 and name HD2 ))
2.000 0.500 0.500 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.49664E-02 ppm1 3.584 ppm2 3.193 CV 1
ASSI { 1363}
(( segid "SUPF" and resid 98 and name HD1 ))
( segid "SUPF" and resid 107 and name HG1%)
4.700 2.700 1.300 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.53528E-03 ppm1 3.588 ppm2 1.089 CV 1
ASSI { 1366}
(( segid "SUPF" and resid 98 and name HD2 ))
(( segid "SUPF" and resid 98 and name HB1 ))
4.400 2.400 1.600 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.54833E-03 ppm1 3.186 ppm2 2.134 CV 1
ASSI { 1367}
(( segid "SUPF" and resid 98 and name HD2 ))
(( segid "SUPF" and resid 98 and name HB2 ))
3.700 1.700 1.700 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.16629E-02 ppm1 3.190 ppm2 1.565 CV 1
ASSI { 1369}
(( segid "SUPF" and resid 98 and name HD2 ))
(( segid "SUPF" and resid 98 and name HG1 ))
2.900 1.000 1.000 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.14560E-02 ppm1 3.188 ppm2 1.942 CV 1
OR { 1369}
(( segid "SUPF" and resid 98 and name HD2 ))
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 1370}
(( segid "SUPF" and resid 98 and name HD2 ))
( segid "SUPF" and resid 100 and name HD1%)
4.600 2.600 1.400 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.37520E-03 ppm1 3.204 ppm2 0.221 CV 1
ASSI { 1374}
(( segid "SUPF" and resid 98 and name HD2 ))
( segid "SUPF" and resid 107 and name HG1%)
5.100 3.200 0.900 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.52025E-03 ppm1 3.201 ppm2 1.087 CV 1
ASSI { 1378}
(( segid "SUPF" and resid 98 and name HG2 ))
( segid "SUPF" and resid 54 and name HE% )
3.600 1.700 1.700 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.61091E-03 ppm1 1.945 ppm2 6.478 CV 1
OR { 1378}
(( segid "SUPF" and resid 98 and name HG1 ))
( segid "SUPF" and resid 54 and name HE% )
ASSI { 1380}
(( segid "SUPF" and resid 99 and name HA ))
(( segid "SUPF" and resid 99 and name HB ))
2.800 1.000 1.000 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.24359E-02 ppm1 4.293 ppm2 1.790 CV 1
ASSI { 1383}
(( segid "SUPF" and resid 99 and name HA ))
(( segid "SUPF" and resid 99 and name HG12))
3.000 1.100 1.100 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.20153E-02 ppm1 4.289 ppm2 1.120 CV 1
ASSI { 1384}
(( segid "SUPF" and resid 99 and name HA ))
( segid "SUPF" and resid 99 and name HG2%)
2.300 0.700 0.700 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.74373E-02 ppm1 4.286 ppm2 0.574 CV 1
ASSI { 1387}
(( segid "SUPF" and resid 99 and name HB ))
(( segid "SUPF" and resid 99 and name HG11))
2.600 0.800 0.800 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.39338E-02 ppm1 1.793 ppm2 1.483 CV 1
ASSI { 1388}
(( segid "SUPF" and resid 99 and name HB ))
(( segid "SUPF" and resid 99 and name HG12))
2.600 0.900 0.900 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.31447E-02 ppm1 1.792 ppm2 1.119 CV 1
ASSI { 1389}
(( segid "SUPF" and resid 99 and name HB ))
( segid "SUPF" and resid 99 and name HG2%)
2.100 0.600 0.600 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.12119E-01 ppm1 1.792 ppm2 0.574 CV 1
ASSI { 1391}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 99 and name HA ))
2.400 0.700 0.700 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.47402E-02 ppm1 0.731 ppm2 4.285 CV 1
ASSI { 1392}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 99 and name HB ))
3.300 1.400 1.400 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.37614E-02 ppm1 0.734 ppm2 1.790 CV 1
ASSI { 1393}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 99 and name HG11))
2.300 0.700 0.700 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.76240E-02 ppm1 0.734 ppm2 1.489 CV 1
ASSI { 1394}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 99 and name HG12))
2.200 0.600 0.600 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.86751E-02 ppm1 0.737 ppm2 1.129 CV 1
ASSI { 1395}
( segid "SUPF" and resid 99 and name HD1%)
( segid "SUPF" and resid 99 and name HG2%)
2.100 0.600 0.600 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.15331E-01 ppm1 0.735 ppm2 0.574 CV 1
ASSI { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HG1 ))
3.000 1.100 1.100 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.26489E-02 ppm1 0.732 ppm2 1.685 CV 1
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HB2 ))
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
( segid "SUPF" and resid 104 and name HZ% )
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HG2 ))
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HB1 ))
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HD2 ))
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HD1 ))
ASSI { 1397}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HA ))
2.400 0.700 0.700 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.50786E-02 ppm1 0.730 ppm2 4.186 CV 1
ASSI { 1398}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HB2 ))
3.100 1.200 1.200 peak 1398 spectrum 1 weight 0.10000E+01 volume 0.17400E-02 ppm1 0.732 ppm2 1.595 CV 1
ASSI { 1399}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HE1 ))
3.200 1.200 1.200 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.22888E-02 ppm1 0.730 ppm2 2.963 CV 1
OR { 1399}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HE2 ))
ASSI { 1400}
(( segid "SUPF" and resid 99 and name HG11))
(( segid "SUPF" and resid 99 and name HA ))
3.300 1.400 1.400 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.31522E-02 ppm1 1.476 ppm2 4.287 CV 1
ASSI { 1402}
(( segid "SUPF" and resid 99 and name HG11))
( segid "SUPF" and resid 99 and name HG2%)
2.300 0.600 0.600 peak 1402 spectrum 1 weight 0.10000E+01 volume 0.86775E-02 ppm1 1.484 ppm2 0.577 CV 1
ASSI { 1405}
(( segid "SUPF" and resid 99 and name HG12))
( segid "SUPF" and resid 99 and name HG2%)
3.100 1.200 1.200 peak 1405 spectrum 1 weight 0.10000E+01 volume 0.62247E-02 ppm1 1.119 ppm2 0.575 CV 1
ASSI { 1406}
(( segid "SUPF" and resid 99 and name HG12))
(( segid "SUPF" and resid 104 and name HA ))
4.100 2.100 1.900 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.12521E-02 ppm1 1.122 ppm2 4.185 CV 1
ASSI { 1412}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 100 and name HA ))
3.500 1.500 1.500 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.96816E-03 ppm1 0.571 ppm2 3.796 CV 1
ASSI { 1413}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 102 and name HA1 ))
3.700 1.700 1.700 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.33185E-02 ppm1 0.578 ppm2 3.471 CV 1
ASSI { 1414}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 102 and name HA2 ))
2.700 0.900 0.900 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.28655E-02 ppm1 0.583 ppm2 4.136 CV 1
ASSI { 1415}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 104 and name HG1 ))
3.600 1.700 1.700 peak 1415 spectrum 1 weight 0.10000E+01 volume 0.25915E-02 ppm1 0.588 ppm2 1.344 CV 1
OR { 1415}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 104 and name HG2 ))
ASSI { 1416}
(( segid "SUPF" and resid 100 and name HA ))
( segid "SUPF" and resid 54 and name HE% )
3.700 1.700 1.700 peak 1416 spectrum 1 weight 0.10000E+01 volume 0.49511E-03 ppm1 3.785 ppm2 6.482 CV 1
ASSI { 1417}
(( segid "SUPF" and resid 100 and name HA ))
(( segid "SUPF" and resid 100 and name HB ))
2.800 1.000 1.000 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.28592E-02 ppm1 3.793 ppm2 1.279 CV 1
ASSI { 1418}
(( segid "SUPF" and resid 100 and name HA ))
( segid "SUPF" and resid 100 and name HD1%)
3.800 1.800 1.800 peak 1418 spectrum 1 weight 0.10000E+01 volume 0.21036E-02 ppm1 3.791 ppm2 0.223 CV 1
ASSI { 1420}
(( segid "SUPF" and resid 100 and name HA ))
(( segid "SUPF" and resid 100 and name HG12))
2.500 0.800 0.800 peak 1420 spectrum 1 weight 0.10000E+01 volume 0.30754E-02 ppm1 3.791 ppm2 -0.339 CV 1
ASSI { 1421}
(( segid "SUPF" and resid 100 and name HA ))
( segid "SUPF" and resid 100 and name HG2%)
2.400 0.700 0.700 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.69265E-02 ppm1 3.792 ppm2 0.473 CV 1
ASSI { 1422}
(( segid "SUPF" and resid 100 and name HB ))
( segid "SUPF" and resid 42 and name HD2%)
2.900 1.100 1.100 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.16768E-02 ppm1 1.284 ppm2 0.649 CV 1
ASSI { 1425}
(( segid "SUPF" and resid 100 and name HB ))
(( segid "SUPF" and resid 100 and name HG11))
2.600 0.900 0.900 peak 1425 spectrum 1 weight 0.10000E+01 volume 0.24019E-02 ppm1 1.282 ppm2 0.784 CV 1
ASSI { 1429}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 39 and name HG1%)
2.800 1.000 1.000 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.26007E-02 ppm1 0.227 ppm2 0.716 CV 1
OR { 1429}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 39 and name HG2%)
ASSI { 1431}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 42 and name HD2%)
2.300 0.700 0.700 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.58870E-02 ppm1 0.228 ppm2 0.648 CV 1
ASSI { 1433}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 51 and name HD1%)
2.700 0.900 0.900 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.26951E-02 ppm1 0.227 ppm2 0.828 CV 1
ASSI { 1434}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 54 and name HB1 ))
3.400 1.500 1.500 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.72096E-03 ppm1 0.228 ppm2 2.836 CV 1
ASSI { 1435}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 54 and name HB2 ))
3.900 1.900 1.900 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.74565E-03 ppm1 0.226 ppm2 3.204 CV 1
ASSI { 1436}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 54 and name HD% )
3.100 1.200 1.200 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.15331E-02 ppm1 0.224 ppm2 6.276 CV 1
ASSI { 1437}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 54 and name HE% )
3.100 1.200 1.200 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.18128E-02 ppm1 0.226 ppm2 6.478 CV 1
ASSI { 1438}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 55 and name HD% )
3.000 1.200 1.200 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.76776E-03 ppm1 0.228 ppm2 7.831 CV 1
ASSI { 1439}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 55 and name HE% )
2.500 0.800 0.800 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.37132E-02 ppm1 0.226 ppm2 7.324 CV 1
ASSI { 1440}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 55 and name HZ ))
3.100 1.200 1.200 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.17627E-02 ppm1 0.229 ppm2 7.200 CV 1
ASSI { 1441}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 98 and name HB1 ))
4.600 2.600 1.400 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.60147E-03 ppm1 0.227 ppm2 2.138 CV 1
ASSI { 1442}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 98 and name HD1 ))
4.900 3.000 1.100 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.48570E-03 ppm1 0.226 ppm2 3.588 CV 1
ASSI { 1443}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 98 and name HG1 ))
3.000 1.100 1.100 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.15056E-02 ppm1 0.227 ppm2 1.943 CV 1
OR { 1443}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 1444}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 99 and name HA ))
4.900 3.000 1.100 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.43088E-03 ppm1 0.224 ppm2 4.285 CV 1
ASSI { 1446}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 100 and name HB ))
2.100 0.600 0.600 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.13219E-01 ppm1 0.226 ppm2 1.279 CV 1
ASSI { 1447}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 100 and name HG11))
2.400 0.700 0.700 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.52907E-02 ppm1 0.223 ppm2 0.785 CV 1
ASSI { 1448}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 100 and name HG12))
2.400 0.700 0.700 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.49867E-02 ppm1 0.225 ppm2 -0.339 CV 1
ASSI { 1449}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 100 and name HG2%)
2.100 0.600 0.600 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.11856E-01 ppm1 0.225 ppm2 0.473 CV 1
ASSI { 1451}
(( segid "SUPF" and resid 100 and name HG11))
( segid "SUPF" and resid 54 and name HE% )
4.300 2.300 1.700 peak 1451 spectrum 1 weight 0.10000E+01 volume 0.42215E-03 ppm1 0.800 ppm2 6.478 CV 1
ASSI { 1452}
(( segid "SUPF" and resid 100 and name HG11))
(( segid "SUPF" and resid 100 and name HG12))
2.000 0.500 0.500 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.54182E-02 ppm1 0.785 ppm2 -0.341 CV 1
ASSI { 1453}
(( segid "SUPF" and resid 100 and name HG12))
( segid "SUPF" and resid 54 and name HE% )
3.600 1.600 1.600 peak 1453 spectrum 1 weight 0.10000E+01 volume 0.45998E-03 ppm1 -0.338 ppm2 6.476 CV 1
ASSI { 1454}
(( segid "SUPF" and resid 100 and name HG12))
(( segid "SUPF" and resid 98 and name HB2 ))
3.500 1.600 1.600 peak 1454 spectrum 1 weight 0.10000E+01 volume 0.71246E-03 ppm1 -0.327 ppm2 1.547 CV 1
ASSI { 1456}
(( segid "SUPF" and resid 100 and name HG12))
(( segid "SUPF" and resid 100 and name HB ))
3.100 1.200 1.200 peak 1456 spectrum 1 weight 0.10000E+01 volume 0.21940E-02 ppm1 -0.338 ppm2 1.280 CV 1
ASSI { 1461}
( segid "SUPF" and resid 100 and name HG2%)
( segid "SUPF" and resid 46 and name HG2%)
2.600 0.900 0.900 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.40802E-02 ppm1 0.474 ppm2 1.132 CV 1
ASSI { 1463}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 54 and name HB1 ))
3.600 1.600 1.600 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.88450E-03 ppm1 0.476 ppm2 2.838 CV 1
ASSI { 1464}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 54 and name HB2 ))
3.000 1.200 1.200 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.11160E-02 ppm1 0.473 ppm2 3.222 CV 1
ASSI { 1465}
( segid "SUPF" and resid 100 and name HG2%)
( segid "SUPF" and resid 54 and name HD% )
3.500 1.600 1.600 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.79336E-03 ppm1 0.478 ppm2 6.276 CV 1
ASSI { 1466}
( segid "SUPF" and resid 100 and name HG2%)
( segid "SUPF" and resid 54 and name HE% )
4.200 2.200 1.800 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.61259E-03 ppm1 0.479 ppm2 6.478 CV 1
ASSI { 1467}
( segid "SUPF" and resid 100 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
4.200 2.200 1.800 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.58438E-03 ppm1 0.464 ppm2 7.319 CV 1
ASSI { 1469}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 100 and name HB ))
2.000 0.500 0.500 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.13613E-01 ppm1 0.475 ppm2 1.282 CV 1
ASSI { 1471}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 100 and name HG12))
2.600 0.800 0.800 peak 1471 spectrum 1 weight 0.10000E+01 volume 0.35491E-02 ppm1 0.475 ppm2 -0.341 CV 1
ASSI { 1472}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 101 and name HB1 ))
3.200 1.300 1.300 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.25743E-02 ppm1 0.474 ppm2 2.201 CV 1
ASSI { 1473}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 101 and name HB2 ))
3.000 1.100 1.100 peak 1473 spectrum 1 weight 0.10000E+01 volume 0.13602E-02 ppm1 0.476 ppm2 2.992 CV 1
ASSI { 1474}
(( segid "SUPF" and resid 101 and name HA ))
(( segid "SUPF" and resid 101 and name HB1 ))
2.700 0.900 0.900 peak 1474 spectrum 1 weight 0.10000E+01 volume 0.55203E-02 ppm1 4.235 ppm2 2.217 CV 1
ASSI { 1475}
(( segid "SUPF" and resid 101 and name HA ))
(( segid "SUPF" and resid 101 and name HB2 ))
2.500 0.800 0.800 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.48088E-02 ppm1 4.240 ppm2 2.991 CV 1
ASSI { 1476}
(( segid "SUPF" and resid 101 and name HB1 ))
( segid "SUPF" and resid 42 and name HD2%)
3.300 1.300 1.300 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.50187E-03 ppm1 2.198 ppm2 0.645 CV 1
ASSI { 1477}
(( segid "SUPF" and resid 101 and name HB1 ))
(( segid "SUPF" and resid 43 and name HG1 ))
3.400 1.400 1.400 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.11376E-02 ppm1 2.204 ppm2 1.934 CV 1
ASSI { 1478}
(( segid "SUPF" and resid 101 and name HB1 ))
(( segid "SUPF" and resid 43 and name HG2 ))
2.900 1.000 1.000 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.11233E-02 ppm1 2.200 ppm2 1.818 CV 1
ASSI { 1480}
(( segid "SUPF" and resid 101 and name HB1 ))
(( segid "SUPF" and resid 100 and name HB ))
3.100 1.200 1.200 peak 1480 spectrum 1 weight 0.10000E+01 volume 0.17114E-02 ppm1 2.204 ppm2 1.285 CV 1
ASSI { 1483}
(( segid "SUPF" and resid 101 and name HB1 ))
(( segid "SUPF" and resid 101 and name HB2 ))
1.900 0.400 0.400 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.11066E-01 ppm1 2.202 ppm2 2.988 CV 1
ASSI { 1485}
(( segid "SUPF" and resid 101 and name HB2 ))
(( segid "SUPF" and resid 43 and name HG2 ))
3.800 1.800 1.800 peak 1485 spectrum 1 weight 0.10000E+01 volume 0.82420E-03 ppm1 3.000 ppm2 1.816 CV 1
ASSI { 1487}
(( segid "SUPF" and resid 101 and name HB2 ))
(( segid "SUPF" and resid 100 and name HB ))
3.700 1.700 1.700 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.10210E-02 ppm1 2.989 ppm2 1.284 CV 1
ASSI { 1492}
(( segid "SUPF" and resid 102 and name HA1 ))
(( segid "SUPF" and resid 102 and name HA2 ))
2.000 0.500 0.500 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.86143E-02 ppm1 3.471 ppm2 4.128 CV 1
ASSI { 1495}
(( segid "SUPF" and resid 103 and name HA ))
(( segid "SUPF" and resid 103 and name HB1 ))
2.800 1.000 1.000 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.38313E-02 ppm1 4.660 ppm2 1.823 CV 1
ASSI { 1496}
(( segid "SUPF" and resid 103 and name HA ))
(( segid "SUPF" and resid 103 and name HB2 ))
2.500 0.800 0.800 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.39046E-02 ppm1 4.658 ppm2 1.641 CV 1
ASSI { 1497}
(( segid "SUPF" and resid 103 and name HA ))
(( segid "SUPF" and resid 103 and name HG1 ))
2.900 1.000 1.000 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.26789E-02 ppm1 4.659 ppm2 1.568 CV 1
ASSI { 1498}
(( segid "SUPF" and resid 103 and name HA ))
(( segid "SUPF" and resid 103 and name HG2 ))
3.500 1.500 1.500 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.20110E-02 ppm1 4.657 ppm2 1.682 CV 1
ASSI { 1500}
(( segid "SUPF" and resid 103 and name HB1 ))
(( segid "SUPF" and resid 103 and name HD1 ))
3.800 1.800 1.800 peak 1500 spectrum 1 weight 0.10000E+01 volume 0.10214E-02 ppm1 1.830 ppm2 3.154 CV 1
ASSI { 1501}
(( segid "SUPF" and resid 103 and name HB1 ))
(( segid "SUPF" and resid 103 and name HD2 ))
3.500 1.500 1.500 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.15771E-02 ppm1 1.826 ppm2 3.110 CV 1
ASSI { 1503}
(( segid "SUPF" and resid 103 and name HB2 ))
(( segid "SUPF" and resid 103 and name HD1 ))
3.200 1.300 1.300 peak 1503 spectrum 1 weight 0.10000E+01 volume 0.11290E-02 ppm1 1.637 ppm2 3.155 CV 1
ASSI { 1504}
(( segid "SUPF" and resid 103 and name HB2 ))
(( segid "SUPF" and resid 103 and name HD2 ))
2.900 1.100 1.100 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.19390E-02 ppm1 1.639 ppm2 3.110 CV 1
ASSI { 1505}
(( segid "SUPF" and resid 103 and name HG1 ))
(( segid "SUPF" and resid 43 and name HD1 ))
3.400 1.400 1.400 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.13331E-02 ppm1 1.568 ppm2 3.591 CV 1
ASSI { 1506}
(( segid "SUPF" and resid 103 and name HG1 ))
(( segid "SUPF" and resid 103 and name HD2 ))
2.600 0.800 0.800 peak 1506 spectrum 1 weight 0.10000E+01 volume 0.30650E-02 ppm1 1.567 ppm2 3.110 CV 1
ASSI { 1507}
(( segid "SUPF" and resid 103 and name HG2 ))
(( segid "SUPF" and resid 103 and name HD2 ))
3.100 1.200 1.200 peak 1507 spectrum 1 weight 0.10000E+01 volume 0.19030E-02 ppm1 1.686 ppm2 3.110 CV 1
ASSI { 1509}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HG1 ))
2.600 0.900 0.900 peak 1509 spectrum 1 weight 0.10000E+01 volume 0.33197E-02 ppm1 4.186 ppm2 1.342 CV 1
OR { 1509}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HG2 ))
ASSI { 1510}
(( segid "SUPF" and resid 104 and name HG1 ))
(( segid "SUPF" and resid 97 and name HA ))
3.400 1.400 1.400 peak 1510 spectrum 1 weight 0.10000E+01 volume 0.10079E-02 ppm1 1.344 ppm2 6.004 CV 1
OR { 1510}
(( segid "SUPF" and resid 104 and name HG2 ))
(( segid "SUPF" and resid 97 and name HA ))
ASSI { 1511}
(( segid "SUPF" and resid 105 and name HA ))
( segid "SUPF" and resid 39 and name HG1%)
4.300 2.300 1.700 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.50353E-03 ppm1 4.698 ppm2 0.751 CV 1
ASSI { 1512}
(( segid "SUPF" and resid 105 and name HA ))
(( segid "SUPF" and resid 41 and name HA1 ))
2.800 1.000 1.000 peak 1512 spectrum 1 weight 0.10000E+01 volume 0.18400E-02 ppm1 4.685 ppm2 4.020 CV 1
ASSI { 1513}
(( segid "SUPF" and resid 105 and name HA ))
(( segid "SUPF" and resid 41 and name HA2 ))
4.500 2.500 1.500 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.11056E-02 ppm1 4.682 ppm2 3.736 CV 1
ASSI { 1514}
(( segid "SUPF" and resid 105 and name HA ))
( segid "SUPF" and resid 42 and name HD2%)
4.000 2.000 2.000 peak 1514 spectrum 1 weight 0.10000E+01 volume 0.56955E-03 ppm1 4.688 ppm2 0.647 CV 1
ASSI { 1515}
(( segid "SUPF" and resid 105 and name HA ))
( segid "SUPF" and resid 100 and name HD1%)
4.700 2.800 1.300 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.55053E-03 ppm1 4.691 ppm2 0.226 CV 1
ASSI { 1516}
(( segid "SUPF" and resid 105 and name HA ))
( segid "SUPF" and resid 105 and name HB% )
2.200 0.600 0.600 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.11359E-01 ppm1 4.688 ppm2 1.280 CV 1
ASSI { 1519}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 98 and name HB1 ))
4.600 2.700 1.400 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.80155E-03 ppm1 1.284 ppm2 2.131 CV 1
ASSI { 1520}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 98 and name HD2 ))
3.000 1.100 1.100 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.14716E-02 ppm1 1.280 ppm2 3.194 CV 1
ASSI { 1521}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 98 and name HG1 ))
2.900 1.100 1.100 peak 1521 spectrum 1 weight 0.10000E+01 volume 0.17340E-02 ppm1 1.288 ppm2 1.946 CV 1
OR { 1521}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 1522}
( segid "SUPF" and resid 105 and name HB% )
( segid "SUPF" and resid 100 and name HD1%)
2.200 0.600 0.600 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.89576E-02 ppm1 1.282 ppm2 0.222 CV 1
ASSI { 1524}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 106 and name HA ))
3.900 1.900 1.900 peak 1524 spectrum 1 weight 0.10000E+01 volume 0.71692E-03 ppm1 1.278 ppm2 5.495 CV 1
ASSI { 1526}
(( segid "SUPF" and resid 106 and name HA ))
(( segid "SUPF" and resid 98 and name HD1 ))
4.300 2.300 1.700 peak 1526 spectrum 1 weight 0.10000E+01 volume 0.50021E-03 ppm1 5.491 ppm2 3.578 CV 1
ASSI { 1527}
(( segid "SUPF" and resid 106 and name HA ))
(( segid "SUPF" and resid 98 and name HD2 ))
3.200 1.300 1.300 peak 1527 spectrum 1 weight 0.10000E+01 volume 0.98479E-03 ppm1 5.494 ppm2 3.197 CV 1
ASSI { 1529}
(( segid "SUPF" and resid 106 and name HA ))
(( segid "SUPF" and resid 106 and name HB1 ))
2.500 0.800 0.800 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.43165E-02 ppm1 5.498 ppm2 2.545 CV 1
ASSI { 1530}
(( segid "SUPF" and resid 106 and name HA ))
(( segid "SUPF" and resid 106 and name HB2 ))
2.500 0.800 0.800 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.55214E-02 ppm1 5.498 ppm2 2.707 CV 1
ASSI { 1532}
(( segid "SUPF" and resid 106 and name HB1 ))
( segid "SUPF" and resid 38 and name HD% )
3.900 1.900 1.900 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.35849E-03 ppm1 2.537 ppm2 6.992 CV 1
ASSI { 1533}
(( segid "SUPF" and resid 106 and name HB1 ))
( segid "SUPF" and resid 38 and name HE% )
3.100 3.100 2.900 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.64181E-03 ppm1 2.531 ppm2 6.918 CV 1
ASSI { 1535}
(( segid "SUPF" and resid 106 and name HB2 ))
( segid "SUPF" and resid 38 and name HE% )
3.200 3.200 2.800 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.56521E-03 ppm1 2.710 ppm2 6.919 CV 1
ASSI { 1537}
(( segid "SUPF" and resid 107 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
3.800 1.800 1.800 peak 1537 spectrum 1 weight 0.10000E+01 volume 0.58983E-03 ppm1 5.366 ppm2 6.994 CV 1
ASSI { 1538}
(( segid "SUPF" and resid 107 and name HA ))
(( segid "SUPF" and resid 39 and name HA ))
2.500 0.800 0.800 peak 1538 spectrum 1 weight 0.10000E+01 volume 0.40323E-02 ppm1 5.365 ppm2 4.530 CV 1
ASSI { 1540}
(( segid "SUPF" and resid 107 and name HA ))
(( segid "SUPF" and resid 107 and name HB ))
2.800 1.000 1.000 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.26660E-02 ppm1 5.364 ppm2 2.039 CV 1
ASSI { 1542}
(( segid "SUPF" and resid 107 and name HA ))
( segid "SUPF" and resid 107 and name HG2%)
2.400 0.700 0.700 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.50895E-02 ppm1 5.365 ppm2 1.036 CV 1
ASSI { 1543}
(( segid "SUPF" and resid 107 and name HB ))
( segid "SUPF" and resid 37 and name HG2%)
3.700 1.800 1.800 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.26106E-02 ppm1 2.041 ppm2 0.719 CV 1
ASSI { 1544}
(( segid "SUPF" and resid 107 and name HB ))
(( segid "SUPF" and resid 98 and name HD1 ))
3.400 1.400 1.400 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.84047E-03 ppm1 2.062 ppm2 3.580 CV 1
ASSI { 1545}
(( segid "SUPF" and resid 107 and name HB ))
(( segid "SUPF" and resid 98 and name HD2 ))
4.300 2.300 1.700 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.62235E-03 ppm1 2.059 ppm2 3.197 CV 1
ASSI { 1547}
(( segid "SUPF" and resid 107 and name HB ))
( segid "SUPF" and resid 107 and name HG1%)
2.300 0.600 0.600 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.75433E-02 ppm1 2.042 ppm2 1.088 CV 1
ASSI { 1548}
(( segid "SUPF" and resid 107 and name HB ))
( segid "SUPF" and resid 107 and name HG2%)
2.300 0.600 0.600 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.70831E-02 ppm1 2.042 ppm2 1.036 CV 1
ASSI { 1549}
( segid "SUPF" and resid 107 and name HG2%)
( segid "SUPF" and resid 54 and name HE% )
2.800 1.000 1.000 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.11321E-02 ppm1 1.057 ppm2 6.481 CV 1
OR { 1549}
( segid "SUPF" and resid 107 and name HG1%)
( segid "SUPF" and resid 54 and name HE% )
ASSI { 1550}
( segid "SUPF" and resid 107 and name HG1%)
( segid "SUPF" and resid 55 and name HD% )
3.000 1.200 1.200 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.75969E-03 ppm1 1.084 ppm2 7.831 CV 1
OR { 1550}
( segid "SUPF" and resid 107 and name HG2%)
( segid "SUPF" and resid 55 and name HD% )
ASSI { 1551}
( segid "SUPF" and resid 107 and name HG1%)
( segid "SUPF" and resid 55 and name HE% )
2.600 0.900 0.900 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.44225E-02 ppm1 1.078 ppm2 7.323 CV 1
OR { 1551}
( segid "SUPF" and resid 107 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
ASSI { 1552}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 55 and name HZ ))
2.300 0.700 0.700 peak 1552 spectrum 1 weight 0.10000E+01 volume 0.58808E-02 ppm1 1.066 ppm2 7.200 CV 1
OR { 1552}
( segid "SUPF" and resid 107 and name HG1%)
(( segid "SUPF" and resid 55 and name HZ ))
ASSI { 1554}
( segid "SUPF" and resid 107 and name HG1%)
(( segid "SUPF" and resid 107 and name HA ))
2.300 0.600 0.600 peak 1554 spectrum 1 weight 0.10000E+01 volume 0.84173E-02 ppm1 1.066 ppm2 5.364 CV 1
OR { 1554}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 107 and name HA ))
ASSI { 1555}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 98 and name HD1 ))
2.800 1.000 1.000 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.28679E-02 ppm1 1.048 ppm2 3.583 CV 1
ASSI { 1556}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 98 and name HD2 ))
2.700 0.900 0.900 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.33866E-02 ppm1 1.046 ppm2 3.194 CV 1
ASSI { 1557}
( segid "SUPF" and resid 107 and name HG2%)
( segid "SUPF" and resid 100 and name HD1%)
2.700 0.900 0.900 peak 1557 spectrum 1 weight 0.10000E+01 volume 0.39385E-02 ppm1 1.054 ppm2 0.223 CV 1
ASSI { 1558}
(( segid "SUPF" and resid 108 and name HA ))
( segid "SUPF" and resid 37 and name HG2%)
3.800 1.800 1.800 peak 1558 spectrum 1 weight 0.10000E+01 volume 0.63711E-03 ppm1 4.928 ppm2 0.719 CV 1
ASSI { 1559}
(( segid "SUPF" and resid 108 and name HA ))
( segid "SUPF" and resid 107 and name HG1%)
3.300 1.400 1.400 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.10289E-02 ppm1 4.929 ppm2 1.089 CV 1
ASSI { 1560}
(( segid "SUPF" and resid 108 and name HA ))
(( segid "SUPF" and resid 108 and name HB1 ))
2.400 0.700 0.700 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.10082E-01 ppm1 4.909 ppm2 3.008 CV 1
ASSI { 1561}
(( segid "SUPF" and resid 108 and name HA ))
(( segid "SUPF" and resid 108 and name HB2 ))
2.400 0.700 0.700 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.64753E-02 ppm1 4.925 ppm2 2.789 CV 1
ASSI { 1564}
(( segid "SUPF" and resid 109 and name HA ))
( segid "SUPF" and resid 109 and name HD2%)
2.200 0.600 0.600 peak 1564 spectrum 1 weight 0.10000E+01 volume 0.81818E-02 ppm1 4.475 ppm2 0.846 CV 1
ASSI { 1565}
(( segid "SUPF" and resid 109 and name HB2 ))
(( segid "SUPF" and resid 109 and name HA ))
2.400 0.700 0.700 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.39705E-02 ppm1 1.787 ppm2 4.473 CV 1
OR { 1565}
(( segid "SUPF" and resid 109 and name HB1 ))
(( segid "SUPF" and resid 109 and name HA ))
ASSI { 1566}
(( segid "SUPF" and resid 109 and name HB2 ))
( segid "SUPF" and resid 111 and name HD% )
2.600 0.800 0.800 peak 1566 spectrum 1 weight 0.10000E+01 volume 0.30535E-02 ppm1 1.788 ppm2 7.075 CV 1
OR { 1566}
(( segid "SUPF" and resid 109 and name HB1 ))
( segid "SUPF" and resid 111 and name HD% )
ASSI { 1567}
(( segid "SUPF" and resid 109 and name HB2 ))
( segid "SUPF" and resid 111 and name HE% )
3.200 1.300 1.300 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.21931E-02 ppm1 1.790 ppm2 6.752 CV 1
OR { 1567}
(( segid "SUPF" and resid 109 and name HB1 ))
( segid "SUPF" and resid 111 and name HE% )
ASSI { 1568}
( segid "SUPF" and resid 109 and name HD1%)
( segid "SUPF" and resid 34 and name HD% )
2.700 0.900 0.900 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.29888E-02 ppm1 1.273 ppm2 7.199 CV 1
ASSI { 1569}
( segid "SUPF" and resid 109 and name HD1%)
( segid "SUPF" and resid 34 and name HE% )
3.700 1.800 1.800 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.86853E-03 ppm1 1.275 ppm2 7.285 CV 1
ASSI { 1570}
( segid "SUPF" and resid 109 and name HD1%)
(( segid "SUPF" and resid 109 and name HA ))
3.900 1.900 1.900 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.18600E-02 ppm1 1.279 ppm2 4.466 CV 1
ASSI { 1571}
( segid "SUPF" and resid 109 and name HD1%)
(( segid "SUPF" and resid 109 and name HG ))
2.300 0.700 0.700 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.56427E-02 ppm1 1.273 ppm2 2.035 CV 1
ASSI { 1572}
( segid "SUPF" and resid 109 and name HD1%)
( segid "SUPF" and resid 111 and name HD% )
3.200 1.300 1.300 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.16583E-02 ppm1 1.272 ppm2 7.075 CV 1
ASSI { 1573}
( segid "SUPF" and resid 109 and name HD1%)
( segid "SUPF" and resid 111 and name HE% )
2.400 0.700 0.700 peak 1573 spectrum 1 weight 0.10000E+01 volume 0.58446E-02 ppm1 1.273 ppm2 6.751 CV 1
ASSI { 1576}
( segid "SUPF" and resid 109 and name HD2%)
( segid "SUPF" and resid 34 and name HD% )
3.300 1.400 1.400 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.12567E-02 ppm1 0.846 ppm2 7.197 CV 1
ASSI { 1578}
( segid "SUPF" and resid 109 and name HD2%)
(( segid "SUPF" and resid 109 and name HB2 ))
2.500 0.800 0.800 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.61579E-02 ppm1 0.846 ppm2 1.787 CV 1
OR { 1578}
( segid "SUPF" and resid 109 and name HD2%)
(( segid "SUPF" and resid 109 and name HB1 ))
ASSI { 1579}
( segid "SUPF" and resid 109 and name HD2%)
(( segid "SUPF" and resid 109 and name HG ))
2.200 0.600 0.600 peak 1579 spectrum 1 weight 0.10000E+01 volume 0.75385E-02 ppm1 0.848 ppm2 2.034 CV 1
ASSI { 1580}
( segid "SUPF" and resid 109 and name HD2%)
( segid "SUPF" and resid 111 and name HD% )
3.900 1.900 1.900 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.97889E-03 ppm1 0.845 ppm2 7.075 CV 1
ASSI { 1581}
( segid "SUPF" and resid 109 and name HD2%)
( segid "SUPF" and resid 111 and name HE% )
4.000 2.000 2.000 peak 1581 spectrum 1 weight 0.10000E+01 volume 0.12392E-02 ppm1 0.843 ppm2 6.752 CV 1
ASSI { 1582}
(( segid "SUPF" and resid 110 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
3.800 1.800 1.800 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.12239E-02 ppm1 4.144 ppm2 6.988 CV 1
ASSI { 1583}
(( segid "SUPF" and resid 110 and name HA ))
( segid "SUPF" and resid 80 and name HE% )
3.800 1.800 1.800 peak 1583 spectrum 1 weight 0.10000E+01 volume 0.70259E-03 ppm1 4.141 ppm2 7.556 CV 1
ASSI { 1585}
( segid "SUPF" and resid 110 and name HB% )
(( segid "SUPF" and resid 38 and name HB2 ))
2.800 1.000 1.000 peak 1585 spectrum 1 weight 0.10000E+01 volume 0.29655E-02 ppm1 1.500 ppm2 3.002 CV 1
OR { 1585}
( segid "SUPF" and resid 110 and name HB% )
(( segid "SUPF" and resid 38 and name HB1 ))
ASSI { 1586}
( segid "SUPF" and resid 110 and name HB% )
( segid "SUPF" and resid 38 and name HD% )
4.000 2.000 2.000 peak 1586 spectrum 1 weight 0.10000E+01 volume 0.93799E-03 ppm1 1.490 ppm2 6.992 CV 1
ASSI { 1587}
( segid "SUPF" and resid 110 and name HB% )
( segid "SUPF" and resid 38 and name HE% )
4.600 2.700 1.400 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.42717E-03 ppm1 1.487 ppm2 6.919 CV 1
ASSI { 1588}
( segid "SUPF" and resid 110 and name HB% )
( segid "SUPF" and resid 80 and name HD% )
2.800 1.000 1.000 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.28882E-02 ppm1 1.488 ppm2 7.166 CV 1
ASSI { 1589}
( segid "SUPF" and resid 110 and name HB% )
( segid "SUPF" and resid 80 and name HE% )
2.700 0.900 0.900 peak 1589 spectrum 1 weight 0.10000E+01 volume 0.30489E-02 ppm1 1.491 ppm2 7.558 CV 1
ASSI { 1590}
( segid "SUPF" and resid 110 and name HB% )
(( segid "SUPF" and resid 80 and name HZ ))
2.900 2.900 3.100 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.93010E-03 ppm1 1.492 ppm2 7.593 CV 1
ASSI { 1591}
( segid "SUPF" and resid 110 and name HB% )
(( segid "SUPF" and resid 110 and name HA ))
2.400 0.700 0.700 peak 1591 spectrum 1 weight 0.10000E+01 volume 0.71391E-02 ppm1 1.493 ppm2 4.142 CV 1
ASSI { 1592}
(( segid "SUPF" and resid 111 and name HA ))
(( segid "SUPF" and resid 111 and name HB1 ))
2.700 0.900 0.900 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.52632E-02 ppm1 4.440 ppm2 2.859 CV 1
ASSI { 1593}
(( segid "SUPF" and resid 111 and name HA ))
(( segid "SUPF" and resid 111 and name HB2 ))
2.400 0.700 0.700 peak 1593 spectrum 1 weight 0.10000E+01 volume 0.49632E-02 ppm1 4.441 ppm2 3.176 CV 1
ASSI { 1594}
(( segid "SUPF" and resid 111 and name HA ))
( segid "SUPF" and resid 111 and name HD% )
3.400 1.400 1.400 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.26177E-02 ppm1 4.441 ppm2 7.075 CV 1
ASSI { 1597}
(( segid "SUPF" and resid 111 and name HB1 ))
(( segid "SUPF" and resid 111 and name HB2 ))
1.900 0.500 0.500 peak 1597 spectrum 1 weight 0.10000E+01 volume 0.78505E-02 ppm1 2.859 ppm2 3.177 CV 1
ASSI { 1598}
(( segid "SUPF" and resid 111 and name HB1 ))
( segid "SUPF" and resid 111 and name HD% )
2.500 0.800 0.800 peak 1598 spectrum 1 weight 0.10000E+01 volume 0.41952E-02 ppm1 2.860 ppm2 7.076 CV 1
ASSI { 1599}
(( segid "SUPF" and resid 111 and name HB1 ))
( segid "SUPF" and resid 111 and name HE% )
4.400 2.400 1.600 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.75168E-03 ppm1 2.856 ppm2 6.753 CV 1
ASSI { 1600}
(( segid "SUPF" and resid 111 and name HB2 ))
(( segid "SUPF" and resid 33 and name HA ))
4.000 2.000 2.000 peak 1600 spectrum 1 weight 0.10000E+01 volume 0.51400E-03 ppm1 3.173 ppm2 3.865 CV 1
ASSI { 1603}
(( segid "SUPF" and resid 111 and name HB2 ))
( segid "SUPF" and resid 111 and name HD% )
2.600 0.800 0.800 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.35230E-02 ppm1 3.179 ppm2 7.075 CV 1
ASSI { 1607}
( segid "SUPF" and resid 111 and name HD% )
( segid "SUPF" and resid 34 and name HD% )
3.000 1.100 1.100 peak 1607 spectrum 1 weight 0.10000E+01 volume 0.20242E-02 ppm1 7.069 ppm2 7.201 CV 1
ASSI { 1608}
( segid "SUPF" and resid 111 and name HD% )
( segid "SUPF" and resid 34 and name HE% )
3.100 1.200 1.200 peak 1608 spectrum 1 weight 0.10000E+01 volume 0.20566E-02 ppm1 7.066 ppm2 7.280 CV 1
ASSI { 1615}
( segid "SUPF" and resid 111 and name HD% )
( segid "SUPF" and resid 111 and name HE% )
1.900 0.500 0.500 peak 1615 spectrum 1 weight 0.10000E+01 volume 0.20534E-01 ppm1 7.072 ppm2 6.751 CV 1
ASSI { 1616}
( segid "SUPF" and resid 111 and name HD% )
( segid "SUPF" and resid 112 and name HD1%)
4.600 2.600 1.400 peak 1616 spectrum 1 weight 0.10000E+01 volume 0.64139E-03 ppm1 7.076 ppm2 0.889 CV 1
ASSI { 1619}
( segid "SUPF" and resid 111 and name HE% )
( segid "SUPF" and resid 34 and name HD% )
2.900 1.100 1.100 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.21004E-02 ppm1 6.750 ppm2 7.198 CV 1
ASSI { 1620}
( segid "SUPF" and resid 111 and name HE% )
( segid "SUPF" and resid 34 and name HE% )
3.100 1.200 1.200 peak 1620 spectrum 1 weight 0.10000E+01 volume 0.15373E-02 ppm1 6.751 ppm2 7.283 CV 1
ASSI { 1625}
( segid "SUPF" and resid 111 and name HE% )
(( segid "SUPF" and resid 111 and name HB2 ))
4.300 2.300 1.700 peak 1625 spectrum 1 weight 0.10000E+01 volume 0.78740E-03 ppm1 6.760 ppm2 3.178 CV 1
ASSI { 1629}
(( segid "SUPF" and resid 112 and name HA ))
( segid "SUPF" and resid 111 and name HD% )
3.800 1.800 1.800 peak 1629 spectrum 1 weight 0.10000E+01 volume 0.60113E-03 ppm1 3.962 ppm2 7.077 CV 1
ASSI { 1630}
(( segid "SUPF" and resid 112 and name HA ))
( segid "SUPF" and resid 111 and name HE% )
4.500 2.600 1.500 peak 1630 spectrum 1 weight 0.10000E+01 volume 0.52405E-03 ppm1 3.962 ppm2 6.752 CV 1
ASSI { 1631}
(( segid "SUPF" and resid 112 and name HA ))
(( segid "SUPF" and resid 112 and name HB1 ))
2.600 0.900 0.900 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.28718E-02 ppm1 3.963 ppm2 1.540 CV 1
ASSI { 1632}
(( segid "SUPF" and resid 112 and name HA ))
(( segid "SUPF" and resid 112 and name HB2 ))
2.800 1.000 1.000 peak 1632 spectrum 1 weight 0.10000E+01 volume 0.41578E-02 ppm1 3.968 ppm2 1.431 CV 1
ASSI { 1633}
(( segid "SUPF" and resid 112 and name HA ))
( segid "SUPF" and resid 112 and name HD1%)
3.900 1.900 1.900 peak 1633 spectrum 1 weight 0.10000E+01 volume 0.24606E-02 ppm1 3.965 ppm2 0.885 CV 1
ASSI { 1634}
(( segid "SUPF" and resid 112 and name HA ))
( segid "SUPF" and resid 112 and name HD2%)
2.200 0.600 0.600 peak 1634 spectrum 1 weight 0.10000E+01 volume 0.11050E-01 ppm1 3.965 ppm2 0.653 CV 1
ASSI { 1635}
(( segid "SUPF" and resid 112 and name HA ))
(( segid "SUPF" and resid 112 and name HG ))
3.400 1.400 1.400 peak 1635 spectrum 1 weight 0.10000E+01 volume 0.10410E-02 ppm1 3.965 ppm2 0.729 CV 1
ASSI { 1636}
(( segid "SUPF" and resid 112 and name HB1 ))
(( segid "SUPF" and resid 112 and name HB2 ))
1.800 0.400 0.400 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.11610E-01 ppm1 1.539 ppm2 1.428 CV 1
ASSI { 1637}
(( segid "SUPF" and resid 112 and name HB1 ))
( segid "SUPF" and resid 112 and name HD1%)
2.400 0.700 0.700 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.66404E-02 ppm1 1.540 ppm2 0.887 CV 1
ASSI { 1638}
(( segid "SUPF" and resid 112 and name HB1 ))
(( segid "SUPF" and resid 112 and name HG ))
3.200 1.300 1.300 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.17452E-02 ppm1 1.548 ppm2 0.736 CV 1
ASSI { 1640}
(( segid "SUPF" and resid 112 and name HB2 ))
( segid "SUPF" and resid 112 and name HD1%)
2.400 0.700 0.700 peak 1640 spectrum 1 weight 0.10000E+01 volume 0.55792E-02 ppm1 1.433 ppm2 0.886 CV 1
ASSI { 1641}
(( segid "SUPF" and resid 112 and name HB2 ))
(( segid "SUPF" and resid 112 and name HG ))
2.900 1.100 1.100 peak 1641 spectrum 1 weight 0.10000E+01 volume 0.12608E-02 ppm1 1.437 ppm2 0.737 CV 1
ASSI { 1642}
( segid "SUPF" and resid 112 and name HD1%)
(( segid "SUPF" and resid 108 and name HB1 ))
2.900 2.900 3.100 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.94774E-03 ppm1 0.886 ppm2 3.006 CV 1
ASSI { 1643}
( segid "SUPF" and resid 112 and name HD1%)
(( segid "SUPF" and resid 108 and name HB2 ))
2.700 2.700 3.300 peak 1643 spectrum 1 weight 0.10000E+01 volume 0.14294E-02 ppm1 0.887 ppm2 2.790 CV 1
ASSI { 1645}
( segid "SUPF" and resid 112 and name HD1%)
( segid "SUPF" and resid 111 and name HE% )
3.500 1.500 1.500 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.16244E-02 ppm1 0.889 ppm2 6.751 CV 1
ASSI { 1647}
( segid "SUPF" and resid 112 and name HD2%)
( segid "SUPF" and resid 111 and name HD% )
3.300 1.400 1.400 peak 1647 spectrum 1 weight 0.10000E+01 volume 0.16474E-02 ppm1 0.656 ppm2 7.076 CV 1
ASSI { 1648}
( segid "SUPF" and resid 112 and name HD2%)
( segid "SUPF" and resid 111 and name HE% )
2.600 0.800 0.800 peak 1648 spectrum 1 weight 0.10000E+01 volume 0.42225E-02 ppm1 0.655 ppm2 6.752 CV 1
ASSI { 1650}
(( segid "SUPF" and resid 113 and name HA1 ))
(( segid "SUPF" and resid 113 and name HA2 ))
1.800 0.400 0.400 peak 1650 spectrum 1 weight 0.10000E+01 volume 0.16148E-01 ppm1 3.878 ppm2 3.641 CV 1
ASSI { 1652}
(( segid "SUPF" and resid 114 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
3.400 1.400 1.400 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.92859E-03 ppm1 3.820 ppm2 6.990 CV 1
ASSI { 1653}
(( segid "SUPF" and resid 114 and name HA ))
( segid "SUPF" and resid 38 and name HE% )
4.000 2.000 2.000 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.51874E-03 ppm1 3.821 ppm2 6.919 CV 1
ASSI { 1654}
(( segid "SUPF" and resid 114 and name HA ))
( segid "SUPF" and resid 114 and name HB% )
2.400 0.700 0.700 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.68283E-02 ppm1 3.817 ppm2 1.168 CV 1
ASSI { 1655}
( segid "SUPF" and resid 114 and name HB% )
( segid "SUPF" and resid 38 and name HD% )
3.200 1.300 1.300 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.15587E-02 ppm1 1.169 ppm2 6.993 CV 1
ASSI { 1656}
( segid "SUPF" and resid 114 and name HB% )
( segid "SUPF" and resid 38 and name HE% )
3.300 1.400 1.400 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.15296E-02 ppm1 1.172 ppm2 6.917 CV 1
ASSI { 1657}
( segid "SUPF" and resid 114 and name HB% )
( segid "SUPF" and resid 80 and name HE% )
2.900 1.000 1.000 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.22024E-02 ppm1 1.171 ppm2 7.561 CV 1
ASSI { 1658}
( segid "SUPF" and resid 114 and name HB% )
(( segid "SUPF" and resid 80 and name HZ ))
2.800 2.800 3.200 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.12930E-02 ppm1 1.171 ppm2 7.586 CV 1
ASSI { 1659}
( segid "SUPF" and resid 114 and name HB% )
(( segid "SUPF" and resid 110 and name HA ))
3.600 1.600 1.600 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.68518E-03 ppm1 1.167 ppm2 4.140 CV 1
ASSI { 1661}
(( segid "SUPF" and resid 115 and name HA ))
( segid "SUPF" and resid 114 and name HB% )
3.300 1.300 1.300 peak 1661 spectrum 1 weight 0.10000E+01 volume 0.48576E-03 ppm1 4.478 ppm2 1.167 CV 1
ASSI { 1662}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 115 and name HB1 ))
2.500 0.800 0.800 peak 1662 spectrum 1 weight 0.10000E+01 volume 0.35423E-02 ppm1 4.475 ppm2 1.725 CV 1
ASSI { 1663}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 115 and name HB2 ))
3.000 1.100 1.100 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.17752E-02 ppm1 4.472 ppm2 1.569 CV 1
ASSI { 1665}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HD2 ))
3.500 1.600 1.600 peak 1665 spectrum 1 weight 0.10000E+01 volume 0.59871E-03 ppm1 4.481 ppm2 1.856 CV 1
OR { 1665}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HD1 ))
OR { 1665}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HG2 ))
OR { 1665}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HG1 ))
ASSI { 1667}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HG1 ))
4.900 3.000 1.100 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.69560E-03 ppm1 4.479 ppm2 1.962 CV 1
ASSI { 1669}
(( segid "SUPF" and resid 115 and name HG2 ))
(( segid "SUPF" and resid 115 and name HA ))
3.000 1.100 1.100 peak 1669 spectrum 1 weight 0.10000E+01 volume 0.28326E-02 ppm1 1.355 ppm2 4.473 CV 1
OR { 1669}
(( segid "SUPF" and resid 115 and name HG1 ))
(( segid "SUPF" and resid 115 and name HA ))
ASSI { 1670}
(( segid "SUPF" and resid 116 and name HA ))
(( segid "SUPF" and resid 38 and name HZ ))
3.300 1.300 1.300 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.11492E-02 ppm1 4.396 ppm2 6.916 CV 1
ASSI { 1673}
(( segid "SUPF" and resid 116 and name HB1 ))
( segid "SUPF" and resid 38 and name HE% )
3.800 1.800 1.800 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.47683E-03 ppm1 2.214 ppm2 6.915 CV 1
ASSI { 1674}
(( segid "SUPF" and resid 116 and name HB1 ))
(( segid "SUPF" and resid 116 and name HA ))
2.300 0.600 0.600 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.73572E-02 ppm1 2.214 ppm2 4.397 CV 1
ASSI { 1675}
(( segid "SUPF" and resid 116 and name HB1 ))
(( segid "SUPF" and resid 116 and name HB2 ))
1.700 0.400 0.500 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.15980E-01 ppm1 2.213 ppm2 1.870 CV 1
ASSI { 1676}
(( segid "SUPF" and resid 116 and name HB2 ))
(( segid "SUPF" and resid 116 and name HA ))
2.900 1.000 1.000 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.38734E-02 ppm1 1.873 ppm2 4.397 CV 1
ASSI { 1678}
(( segid "SUPF" and resid 116 and name HD1 ))
( segid "SUPF" and resid 38 and name HE% )
3.300 1.300 1.300 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.76282E-03 ppm1 3.557 ppm2 6.918 CV 1
OR { 1678}
(( segid "SUPF" and resid 116 and name HD2 ))
( segid "SUPF" and resid 38 and name HE% )
ASSI { 1679}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 115 and name HA ))
2.000 0.500 0.500 peak 1679 spectrum 1 weight 0.10000E+01 volume 0.14489E-01 ppm1 3.554 ppm2 4.474 CV 1
OR { 1679}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 115 and name HA ))
ASSI { 1680}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 115 and name HG2 ))
4.000 2.000 2.000 peak 1680 spectrum 1 weight 0.10000E+01 volume 0.90612E-03 ppm1 3.555 ppm2 1.358 CV 1
OR { 1680}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 115 and name HG1 ))
OR { 1680}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 115 and name HG2 ))
OR { 1680}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 115 and name HG1 ))
ASSI { 1681}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 116 and name HB1 ))
3.300 1.400 1.400 peak 1681 spectrum 1 weight 0.10000E+01 volume 0.17395E-02 ppm1 3.553 ppm2 2.214 CV 1
OR { 1681}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 116 and name HB1 ))
ASSI { 1682}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 116 and name HG1 ))
2.400 0.700 0.700 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.57028E-02 ppm1 3.553 ppm2 1.959 CV 1
OR { 1682}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 116 and name HG1 ))
ASSI { 1683}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 116 and name HG2 ))
2.400 0.700 0.700 peak 1683 spectrum 1 weight 0.10000E+01 volume 0.57081E-02 ppm1 3.558 ppm2 1.848 CV 1
OR { 1683}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 116 and name HG2 ))
ASSI { 1684}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 115 and name HB1 ))
3.200 1.300 1.300 peak 1684 spectrum 1 weight 0.10000E+01 volume 0.27656E-02 ppm1 3.547 ppm2 1.727 CV 1
ASSI { 1685}
(( segid "SUPF" and resid 116 and name HG1 ))
(( segid "SUPF" and resid 116 and name HB1 ))
2.400 0.700 0.700 peak 1685 spectrum 1 weight 0.10000E+01 volume 0.42383E-02 ppm1 1.953 ppm2 2.209 CV 1
ASSI { 1686}
(( segid "SUPF" and resid 116 and name HG2 ))
(( segid "SUPF" and resid 116 and name HB1 ))
2.900 1.000 1.000 peak 1686 spectrum 1 weight 0.10000E+01 volume 0.51402E-02 ppm1 1.847 ppm2 2.209 CV 1
ASSI { 1687}
(( segid "SUPF" and resid 117 and name HD2 ))
( segid "SUPF" and resid 78 and name HD% )
3.100 3.100 2.900 peak 1687 spectrum 1 weight 0.10000E+01 volume 0.69271E-03 ppm1 3.208 ppm2 6.749 CV 1
OR { 1687}
(( segid "SUPF" and resid 117 and name HD1 ))
( segid "SUPF" and resid 78 and name HD% )
ASSI { 1688}
(( segid "SUPF" and resid 117 and name HD1 ))
( segid "SUPF" and resid 78 and name HE% )
3.100 1.200 1.200 peak 1688 spectrum 1 weight 0.10000E+01 volume 0.12345E-02 ppm1 3.209 ppm2 6.849 CV 1
OR { 1688}
(( segid "SUPF" and resid 117 and name HD2 ))
( segid "SUPF" and resid 78 and name HE% )
ASSI { 1689}
(( segid "SUPF" and resid 117 and name HD2 ))
(( segid "SUPF" and resid 117 and name HA ))
3.200 1.300 1.300 peak 1689 spectrum 1 weight 0.10000E+01 volume 0.35609E-02 ppm1 3.203 ppm2 4.367 CV 1
OR { 1689}
(( segid "SUPF" and resid 117 and name HD1 ))
(( segid "SUPF" and resid 117 and name HA ))
ASSI { 1690}
(( segid "SUPF" and resid 117 and name HG1 ))
(( segid "SUPF" and resid 117 and name HA ))
2.700 0.900 0.900 peak 1690 spectrum 1 weight 0.10000E+01 volume 0.41555E-02 ppm1 1.673 ppm2 4.365 CV 1
OR { 1690}
(( segid "SUPF" and resid 117 and name HG2 ))
(( segid "SUPF" and resid 117 and name HA ))
ASSI { 1692}
(( segid "SUPF" and resid 118 and name HB ))
( segid "SUPF" and resid 118 and name HG2%)
2.400 0.700 0.700 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.76818E-02 ppm1 4.232 ppm2 1.202 CV 1
ASSI { 1694}
(( segid "SUPF" and resid 119 and name HA ))
(( segid "SUPF" and resid 119 and name HB1 ))
3.100 1.200 1.200 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.23248E-02 ppm1 4.772 ppm2 2.775 CV 1
ASSI { 1695}
(( segid "SUPF" and resid 119 and name HA ))
(( segid "SUPF" and resid 119 and name HB2 ))
2.900 1.000 1.000 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.21447E-02 ppm1 4.779 ppm2 2.847 CV 1
ASSI { 5}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HG2 ))
4.600 2.700 1.400 peak 5 spectrum 1 weight 0.10000E+01 volume 0.48355E-03 ppm1 6.745 ppm2 2.335 CV 1
OR { 5}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HG1 ))
OR { 5}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HB2 ))
OR { 5}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HB1 ))
ASSI { 6}
(( segid "SUPF" and resid 31 and name HN ))
(( segid "SUPF" and resid 30 and name HA ))
2.800 1.000 1.000 peak 6 spectrum 1 weight 0.10000E+01 volume 0.24472E-02 ppm1 8.368 ppm2 4.300 CV 1
ASSI { 7}
(( segid "SUPF" and resid 31 and name HN ))
(( segid "SUPF" and resid 31 and name HB1 ))
4.000 2.000 2.000 peak 7 spectrum 1 weight 0.10000E+01 volume 0.60609E-03 ppm1 8.371 ppm2 2.660 CV 1
ASSI { 8}
(( segid "SUPF" and resid 31 and name HN ))
(( segid "SUPF" and resid 31 and name HB2 ))
3.300 1.400 1.400 peak 8 spectrum 1 weight 0.10000E+01 volume 0.97648E-03 ppm1 8.366 ppm2 2.804 CV 1
ASSI { 9}
(( segid "SUPF" and resid 32 and name HN ))
(( segid "SUPF" and resid 31 and name HA ))
2.700 0.900 0.900 peak 9 spectrum 1 weight 0.10000E+01 volume 0.33364E-02 ppm1 8.094 ppm2 4.625 CV 1
ASSI { 10}
(( segid "SUPF" and resid 32 and name HN ))
( segid "SUPF" and resid 32 and name HG2%)
3.300 1.400 1.400 peak 10 spectrum 1 weight 0.10000E+01 volume 0.11999E-02 ppm1 8.092 ppm2 1.082 CV 1
ASSI { 11}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 32 and name HA ))
2.700 0.900 0.900 peak 11 spectrum 1 weight 0.10000E+01 volume 0.30248E-02 ppm1 8.072 ppm2 4.597 CV 1
ASSI { 12}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 33 and name HA ))
2.700 0.900 0.900 peak 12 spectrum 1 weight 0.10000E+01 volume 0.36490E-02 ppm1 8.070 ppm2 3.843 CV 1
ASSI { 13}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 33 and name HB1 ))
2.700 0.900 0.900 peak 13 spectrum 1 weight 0.10000E+01 volume 0.36768E-02 ppm1 8.071 ppm2 1.382 CV 1
ASSI { 14}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 33 and name HB2 ))
2.400 0.700 0.700 peak 14 spectrum 1 weight 0.10000E+01 volume 0.55568E-02 ppm1 8.071 ppm2 1.812 CV 1
ASSI { 15}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 33 and name HG1 ))
3.800 1.800 1.800 peak 15 spectrum 1 weight 0.10000E+01 volume 0.94937E-03 ppm1 8.068 ppm2 1.524 CV 1
ASSI { 16}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 34 and name HN ))
2.900 1.100 1.100 peak 16 spectrum 1 weight 0.10000E+01 volume 0.16432E-02 ppm1 8.074 ppm2 8.390 CV 1
ASSI { 19}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 33 and name HB1 ))
2.900 1.100 1.100 peak 19 spectrum 1 weight 0.10000E+01 volume 0.18048E-02 ppm1 8.408 ppm2 1.378 CV 1
ASSI { 20}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 33 and name HB2 ))
3.900 1.900 1.900 peak 20 spectrum 1 weight 0.10000E+01 volume 0.80926E-03 ppm1 8.408 ppm2 1.816 CV 1
ASSI { 21}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 34 and name HA ))
3.000 1.100 1.100 peak 21 spectrum 1 weight 0.10000E+01 volume 0.18648E-02 ppm1 8.405 ppm2 4.896 CV 1
ASSI { 22}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 34 and name HB1 ))
3.600 1.600 1.600 peak 22 spectrum 1 weight 0.10000E+01 volume 0.25067E-02 ppm1 8.408 ppm2 2.779 CV 1
ASSI { 23}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 34 and name HB2 ))
2.900 1.100 1.100 peak 23 spectrum 1 weight 0.10000E+01 volume 0.13532E-02 ppm1 8.405 ppm2 3.475 CV 1
ASSI { 24}
(( segid "SUPF" and resid 34 and name HN ))
( segid "SUPF" and resid 34 and name HD% )
3.300 1.400 1.400 peak 24 spectrum 1 weight 0.10000E+01 volume 0.11711E-02 ppm1 8.402 ppm2 7.189 CV 1
ASSI { 25}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 35 and name HN ))
2.600 0.800 0.800 peak 25 spectrum 1 weight 0.10000E+01 volume 0.27950E-02 ppm1 8.406 ppm2 7.466 CV 1
ASSI { 26}
(( segid "SUPF" and resid 34 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
3.800 1.800 1.800 peak 26 spectrum 1 weight 0.10000E+01 volume 0.54724E-03 ppm1 8.413 ppm2 0.797 CV 1
ASSI { 27}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 32 and name HA ))
3.300 1.400 1.400 peak 27 spectrum 1 weight 0.10000E+01 volume 0.13556E-02 ppm1 7.465 ppm2 4.570 CV 1
ASSI { 29}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 34 and name HB1 ))
4.400 2.400 1.600 peak 29 spectrum 1 weight 0.10000E+01 volume 0.37235E-03 ppm1 7.462 ppm2 2.786 CV 1
ASSI { 30}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 35 and name HA ))
3.200 1.200 1.200 peak 30 spectrum 1 weight 0.10000E+01 volume 0.10453E-02 ppm1 7.465 ppm2 4.401 CV 1
ASSI { 31}
(( segid "SUPF" and resid 35 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
3.000 1.100 1.100 peak 31 spectrum 1 weight 0.10000E+01 volume 0.17321E-02 ppm1 7.465 ppm2 0.808 CV 1
ASSI { 33}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 36 and name HB1 ))
4.900 3.000 1.100 peak 33 spectrum 1 weight 0.10000E+01 volume 0.48578E-03 ppm1 7.466 ppm2 1.707 CV 1
ASSI { 34}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 36 and name HB2 ))
5.100 3.200 0.900 peak 34 spectrum 1 weight 0.10000E+01 volume 0.43579E-03 ppm1 7.469 ppm2 1.975 CV 1
ASSI { 35}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 36 and name HG1 ))
5.600 4.000 0.400 peak 35 spectrum 1 weight 0.10000E+01 volume 0.44435E-03 ppm1 7.465 ppm2 1.117 CV 1
ASSI { 38}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 35 and name HN ))
2.000 0.500 0.500 peak 38 spectrum 1 weight 0.10000E+01 volume 0.56725E-02 ppm1 7.810 ppm2 7.471 CV 1
ASSI { 39}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 35 and name HA ))
3.500 1.500 1.500 peak 39 spectrum 1 weight 0.10000E+01 volume 0.10829E-02 ppm1 7.810 ppm2 4.410 CV 1
ASSI { 40}
(( segid "SUPF" and resid 36 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
4.400 2.400 1.600 peak 40 spectrum 1 weight 0.10000E+01 volume 0.75391E-03 ppm1 7.811 ppm2 0.814 CV 1
ASSI { 41}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HA ))
2.900 1.100 1.100 peak 41 spectrum 1 weight 0.10000E+01 volume 0.13327E-02 ppm1 7.808 ppm2 5.003 CV 1
ASSI { 42}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HB1 ))
2.500 0.800 0.800 peak 42 spectrum 1 weight 0.10000E+01 volume 0.28291E-02 ppm1 7.809 ppm2 1.682 CV 1
ASSI { 43}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HB2 ))
2.600 0.900 0.900 peak 43 spectrum 1 weight 0.10000E+01 volume 0.29073E-02 ppm1 7.810 ppm2 1.980 CV 1
ASSI { 44}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HG1 ))
4.000 2.000 2.000 peak 44 spectrum 1 weight 0.10000E+01 volume 0.11175E-02 ppm1 7.810 ppm2 1.105 CV 1
ASSI { 45}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HG2 ))
4.000 2.000 2.000 peak 45 spectrum 1 weight 0.10000E+01 volume 0.97449E-03 ppm1 7.809 ppm2 1.388 CV 1
ASSI { 46}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HA ))
2.600 0.900 0.900 peak 46 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 9.930 ppm2 5.010 CV 1
ASSI { 47}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HB2 ))
4.800 2.900 1.200 peak 47 spectrum 1 weight 0.10000E+01 volume 0.47302E-03 ppm1 9.938 ppm2 1.955 CV 1
ASSI { 48}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HD1 ))
4.400 2.400 1.600 peak 48 spectrum 1 weight 0.10000E+01 volume 0.63970E-03 ppm1 9.921 ppm2 1.416 CV 1
OR { 48}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 49}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HG1 ))
4.100 2.100 1.900 peak 49 spectrum 1 weight 0.10000E+01 volume 0.31478E-03 ppm1 9.920 ppm2 1.118 CV 1
ASSI { 50}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 37 and name HB ))
3.100 1.200 1.200 peak 50 spectrum 1 weight 0.10000E+01 volume 0.11125E-02 ppm1 9.927 ppm2 1.780 CV 1
ASSI { 51}
(( segid "SUPF" and resid 37 and name HN ))
( segid "SUPF" and resid 37 and name HD1%)
4.500 2.600 1.500 peak 51 spectrum 1 weight 0.10000E+01 volume 0.56752E-03 ppm1 9.934 ppm2 0.685 CV 1
ASSI { 52}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 37 and name HG11))
3.100 1.200 1.200 peak 52 spectrum 1 weight 0.10000E+01 volume 0.84408E-03 ppm1 9.931 ppm2 1.643 CV 1
ASSI { 53}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 81 and name HN ))
3.600 1.600 1.600 peak 53 spectrum 1 weight 0.10000E+01 volume 0.49076E-03 ppm1 9.927 ppm2 9.080 CV 1
ASSI { 54}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 37 and name HA ))
2.400 0.700 0.700 peak 54 spectrum 1 weight 0.10000E+01 volume 0.44963E-02 ppm1 9.410 ppm2 4.244 CV 1
ASSI { 55}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 37 and name HB ))
4.300 2.400 1.700 peak 55 spectrum 1 weight 0.10000E+01 volume 0.42140E-03 ppm1 9.406 ppm2 1.791 CV 1
ASSI { 56}
(( segid "SUPF" and resid 38 and name HN ))
( segid "SUPF" and resid 37 and name HG2%)
2.800 1.000 1.000 peak 56 spectrum 1 weight 0.10000E+01 volume 0.21682E-02 ppm1 9.409 ppm2 0.705 CV 1
ASSI { 57}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 38 and name HA ))
3.200 1.300 1.300 peak 57 spectrum 1 weight 0.10000E+01 volume 0.99304E-03 ppm1 9.406 ppm2 4.728 CV 1
ASSI { 58}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 38 and name HB1 ))
2.500 0.800 0.800 peak 58 spectrum 1 weight 0.10000E+01 volume 0.40229E-02 ppm1 9.411 ppm2 3.003 CV 1
OR { 58}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 38 and name HB2 ))
ASSI { 59}
(( segid "SUPF" and resid 38 and name HN ))
( segid "SUPF" and resid 38 and name HD% )
4.500 2.600 1.500 peak 59 spectrum 1 weight 0.10000E+01 volume 0.60452E-03 ppm1 9.412 ppm2 7.004 CV 1
ASSI { 62}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 110 and name HN ))
3.300 1.400 1.400 peak 62 spectrum 1 weight 0.10000E+01 volume 0.12396E-02 ppm1 9.412 ppm2 9.238 CV 1
ASSI { 63}
(( segid "SUPF" and resid 38 and name HN ))
( segid "SUPF" and resid 110 and name HB% )
3.500 1.500 1.500 peak 63 spectrum 1 weight 0.10000E+01 volume 0.10168E-02 ppm1 9.404 ppm2 1.481 CV 1
ASSI { 64}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 38 and name HA ))
2.300 0.700 0.700 peak 64 spectrum 1 weight 0.10000E+01 volume 0.63012E-02 ppm1 7.818 ppm2 4.727 CV 1
ASSI { 65}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 38 and name HB2 ))
4.200 2.200 1.800 peak 65 spectrum 1 weight 0.10000E+01 volume 0.87040E-03 ppm1 7.821 ppm2 3.001 CV 1
OR { 65}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 38 and name HB1 ))
ASSI { 66}
(( segid "SUPF" and resid 39 and name HN ))
( segid "SUPF" and resid 38 and name HD% )
3.600 1.600 1.600 peak 66 spectrum 1 weight 0.10000E+01 volume 0.92196E-03 ppm1 7.815 ppm2 6.976 CV 1
ASSI { 67}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 39 and name HA ))
3.100 1.200 1.200 peak 67 spectrum 1 weight 0.10000E+01 volume 0.12122E-02 ppm1 7.820 ppm2 4.546 CV 1
ASSI { 68}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 39 and name HB ))
2.700 0.900 0.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.22904E-02 ppm1 7.820 ppm2 1.575 CV 1
ASSI { 69}
(( segid "SUPF" and resid 39 and name HN ))
( segid "SUPF" and resid 39 and name HG2%)
2.600 0.800 0.800 peak 69 spectrum 1 weight 0.10000E+01 volume 0.37284E-02 ppm1 7.818 ppm2 0.704 CV 1
ASSI { 70}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 79 and name HN ))
3.200 1.200 1.200 peak 70 spectrum 1 weight 0.10000E+01 volume 0.11802E-02 ppm1 7.815 ppm2 8.976 CV 1
ASSI { 71}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 80 and name HA ))
3.300 1.400 1.400 peak 71 spectrum 1 weight 0.10000E+01 volume 0.89444E-03 ppm1 7.821 ppm2 5.841 CV 1
ASSI { 72}
(( segid "SUPF" and resid 39 and name HN ))
( segid "SUPF" and resid 80 and name HD% )
4.200 2.200 1.800 peak 72 spectrum 1 weight 0.10000E+01 volume 0.58254E-03 ppm1 7.817 ppm2 7.157 CV 1
ASSI { 73}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 38 and name HE% )
3.400 1.500 1.500 peak 73 spectrum 1 weight 0.10000E+01 volume 0.10584E-02 ppm1 8.934 ppm2 6.925 CV 1
ASSI { 74}
(( segid "SUPF" and resid 40 and name HN ))
(( segid "SUPF" and resid 39 and name HA ))
2.300 0.700 0.700 peak 74 spectrum 1 weight 0.10000E+01 volume 0.58560E-02 ppm1 8.940 ppm2 4.520 CV 1
ASSI { 75}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 39 and name HG1%)
3.200 1.300 1.300 peak 75 spectrum 1 weight 0.10000E+01 volume 0.25218E-02 ppm1 8.939 ppm2 0.719 CV 1
OR { 75}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 39 and name HG2%)
ASSI { 76}
(( segid "SUPF" and resid 40 and name HN ))
(( segid "SUPF" and resid 40 and name HA1 ))
2.700 0.900 0.900 peak 76 spectrum 1 weight 0.10000E+01 volume 0.21147E-02 ppm1 8.941 ppm2 3.736 CV 1
ASSI { 77}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 105 and name HB% )
4.000 2.000 2.000 peak 77 spectrum 1 weight 0.10000E+01 volume 0.55199E-03 ppm1 8.943 ppm2 1.282 CV 1
ASSI { 79}
(( segid "SUPF" and resid 40 and name HN ))
(( segid "SUPF" and resid 106 and name HB1 ))
3.900 1.900 1.900 peak 79 spectrum 1 weight 0.10000E+01 volume 0.45803E-03 ppm1 8.947 ppm2 2.534 CV 1
ASSI { 80}
(( segid "SUPF" and resid 40 and name HN ))
(( segid "SUPF" and resid 107 and name HA ))
3.600 1.600 1.600 peak 80 spectrum 1 weight 0.10000E+01 volume 0.93534E-03 ppm1 8.937 ppm2 5.351 CV 1
ASSI { 81}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
4.100 2.100 1.900 peak 81 spectrum 1 weight 0.10000E+01 volume 0.79107E-03 ppm1 8.934 ppm2 1.046 CV 1
OR { 81}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 83}
(( segid "SUPF" and resid 41 and name HN ))
( segid "SUPF" and resid 38 and name HE% )
4.400 2.400 1.600 peak 83 spectrum 1 weight 0.10000E+01 volume 0.53578E-03 ppm1 8.395 ppm2 6.901 CV 1
OR { 83}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 38 and name HZ ))
ASSI { 85}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 40 and name HA2 ))
2.600 0.800 0.800 peak 85 spectrum 1 weight 0.10000E+01 volume 0.27328E-02 ppm1 8.387 ppm2 4.591 CV 1
ASSI { 86}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 41 and name HA1 ))
3.000 1.100 1.100 peak 86 spectrum 1 weight 0.10000E+01 volume 0.33623E-02 ppm1 8.386 ppm2 4.021 CV 1
ASSI { 88}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 42 and name HB1 ))
4.500 2.500 1.500 peak 88 spectrum 1 weight 0.10000E+01 volume 0.11066E-02 ppm1 8.389 ppm2 1.267 CV 1
ASSI { 90}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 78 and name HB2 ))
4.500 2.500 1.500 peak 90 spectrum 1 weight 0.10000E+01 volume 0.70494E-03 ppm1 8.385 ppm2 3.213 CV 1
ASSI { 94}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 41 and name HN ))
2.700 0.900 0.900 peak 94 spectrum 1 weight 0.10000E+01 volume 0.26640E-02 ppm1 7.631 ppm2 8.381 CV 1
ASSI { 95}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 41 and name HA1 ))
3.900 1.900 1.900 peak 95 spectrum 1 weight 0.10000E+01 volume 0.75638E-03 ppm1 7.630 ppm2 4.034 CV 1
ASSI { 96}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 42 and name HA ))
2.900 1.100 1.100 peak 96 spectrum 1 weight 0.10000E+01 volume 0.15856E-02 ppm1 7.631 ppm2 4.301 CV 1
ASSI { 97}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 42 and name HB1 ))
3.000 1.100 1.100 peak 97 spectrum 1 weight 0.10000E+01 volume 0.61747E-02 ppm1 7.629 ppm2 1.261 CV 1
ASSI { 98}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 42 and name HB2 ))
2.500 0.800 0.800 peak 98 spectrum 1 weight 0.10000E+01 volume 0.30704E-02 ppm1 7.630 ppm2 0.986 CV 1
ASSI { 99}
(( segid "SUPF" and resid 42 and name HN ))
( segid "SUPF" and resid 42 and name HD1%)
3.700 1.700 1.700 peak 99 spectrum 1 weight 0.10000E+01 volume 0.19820E-02 ppm1 7.631 ppm2 0.483 CV 1
ASSI { 100}
(( segid "SUPF" and resid 42 and name HN ))
( segid "SUPF" and resid 42 and name HD2%)
3.700 1.700 1.700 peak 100 spectrum 1 weight 0.10000E+01 volume 0.14214E-02 ppm1 7.629 ppm2 0.657 CV 1
ASSI { 101}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 77 and name HA1 ))
4.000 2.100 2.000 peak 101 spectrum 1 weight 0.10000E+01 volume 0.41761E-03 ppm1 7.631 ppm2 3.273 CV 1
ASSI { 102}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 78 and name HA ))
3.600 1.700 1.700 peak 102 spectrum 1 weight 0.10000E+01 volume 0.60031E-03 ppm1 7.631 ppm2 5.166 CV 1
ASSI { 103}
(( segid "SUPF" and resid 44 and name HN ))
(( segid "SUPF" and resid 43 and name HA ))
2.800 1.000 1.000 peak 103 spectrum 1 weight 0.10000E+01 volume 0.21966E-02 ppm1 8.538 ppm2 4.369 CV 1
ASSI { 104}
(( segid "SUPF" and resid 44 and name HN ))
(( segid "SUPF" and resid 44 and name HA ))
3.500 1.500 1.500 peak 104 spectrum 1 weight 0.10000E+01 volume 0.68976E-03 ppm1 8.536 ppm2 4.163 CV 1
ASSI { 105}
(( segid "SUPF" and resid 44 and name HN ))
(( segid "SUPF" and resid 44 and name HB1 ))
4.300 2.300 1.700 peak 105 spectrum 1 weight 0.10000E+01 volume 0.60025E-03 ppm1 8.542 ppm2 3.232 CV 1
ASSI { 106}
(( segid "SUPF" and resid 44 and name HN ))
(( segid "SUPF" and resid 44 and name HB2 ))
3.200 1.200 1.200 peak 106 spectrum 1 weight 0.10000E+01 volume 0.94166E-03 ppm1 8.537 ppm2 3.023 CV 1
ASSI { 107}
(( segid "SUPF" and resid 44 and name HN ))
( segid "SUPF" and resid 44 and name HD% )
3.800 1.800 1.800 peak 107 spectrum 1 weight 0.10000E+01 volume 0.40577E-03 ppm1 8.544 ppm2 7.167 CV 1
ASSI { 111}
(( segid "SUPF" and resid 46 and name HN ))
(( segid "SUPF" and resid 66 and name HB ))
4.400 2.400 1.600 peak 111 spectrum 1 weight 0.10000E+01 volume 0.39589E-03 ppm1 6.994 ppm2 1.878 CV 1
ASSI { 112}
(( segid "SUPF" and resid 46 and name HN ))
(( segid "SUPF" and resid 46 and name HA ))
2.800 1.000 1.000 peak 112 spectrum 1 weight 0.10000E+01 volume 0.25627E-02 ppm1 6.993 ppm2 4.036 CV 1
ASSI { 113}
(( segid "SUPF" and resid 46 and name HN ))
(( segid "SUPF" and resid 46 and name HB ))
2.400 0.700 0.700 peak 113 spectrum 1 weight 0.10000E+01 volume 0.66361E-02 ppm1 6.992 ppm2 3.666 CV 1
ASSI { 114}
(( segid "SUPF" and resid 46 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
3.800 1.800 1.800 peak 114 spectrum 1 weight 0.10000E+01 volume 0.14538E-02 ppm1 6.996 ppm2 1.120 CV 1
ASSI { 115}
(( segid "SUPF" and resid 46 and name HN ))
(( segid "SUPF" and resid 47 and name HN ))
4.300 2.400 1.700 peak 115 spectrum 1 weight 0.10000E+01 volume 0.60013E-03 ppm1 6.997 ppm2 8.413 CV 1
ASSI { 117}
(( segid "SUPF" and resid 47 and name HN ))
( segid "SUPF" and resid 50 and name HG2%)
3.600 1.600 1.600 peak 117 spectrum 1 weight 0.10000E+01 volume 0.15611E-02 ppm1 8.411 ppm2 1.275 CV 1
ASSI { 118}
(( segid "SUPF" and resid 47 and name HN ))
(( segid "SUPF" and resid 46 and name HA ))
2.000 0.500 0.500 peak 118 spectrum 1 weight 0.10000E+01 volume 0.13539E-01 ppm1 8.413 ppm2 4.032 CV 1
ASSI { 119}
(( segid "SUPF" and resid 47 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
2.600 0.900 0.900 peak 119 spectrum 1 weight 0.10000E+01 volume 0.48696E-02 ppm1 8.412 ppm2 1.123 CV 1
ASSI { 120}
(( segid "SUPF" and resid 47 and name HN ))
(( segid "SUPF" and resid 47 and name HA ))
2.900 1.100 1.100 peak 120 spectrum 1 weight 0.10000E+01 volume 0.18687E-02 ppm1 8.413 ppm2 4.866 CV 1
ASSI { 121}
(( segid "SUPF" and resid 47 and name HN ))
(( segid "SUPF" and resid 50 and name HN ))
3.400 1.400 1.400 peak 121 spectrum 1 weight 0.10000E+01 volume 0.92184E-03 ppm1 8.413 ppm2 7.872 CV 1
ASSI { 122}
(( segid "SUPF" and resid 47 and name HN ))
(( segid "SUPF" and resid 50 and name HB ))
2.600 0.800 0.800 peak 122 spectrum 1 weight 0.10000E+01 volume 0.29288E-02 ppm1 8.414 ppm2 4.449 CV 1
ASSI { 123}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 47 and name HA ))
2.300 0.700 0.700 peak 123 spectrum 1 weight 0.10000E+01 volume 0.75379E-02 ppm1 8.786 ppm2 4.856 CV 1
ASSI { 124}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 47 and name HB1 ))
2.300 0.700 0.700 peak 124 spectrum 1 weight 0.10000E+01 volume 0.64825E-02 ppm1 8.785 ppm2 3.992 CV 1
ASSI { 125}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 47 and name HB2 ))
2.800 1.000 1.000 peak 125 spectrum 1 weight 0.10000E+01 volume 0.51182E-02 ppm1 8.786 ppm2 4.428 CV 1
ASSI { 126}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 48 and name HB1 ))
2.700 0.900 0.900 peak 126 spectrum 1 weight 0.10000E+01 volume 0.20495E-02 ppm1 8.786 ppm2 2.957 CV 1
ASSI { 127}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 48 and name HB2 ))
3.200 1.300 1.300 peak 127 spectrum 1 weight 0.10000E+01 volume 0.26891E-02 ppm1 8.783 ppm2 2.751 CV 1
ASSI { 128}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 49 and name HN ))
2.700 0.900 0.900 peak 128 spectrum 1 weight 0.10000E+01 volume 0.22801E-02 ppm1 8.786 ppm2 7.914 CV 1
ASSI { 129}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 66 and name HB ))
3.300 1.300 1.300 peak 129 spectrum 1 weight 0.10000E+01 volume 0.12062E-02 ppm1 8.788 ppm2 1.870 CV 1
ASSI { 130}
(( segid "SUPF" and resid 48 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
3.100 1.200 1.200 peak 130 spectrum 1 weight 0.10000E+01 volume 0.21640E-02 ppm1 8.785 ppm2 0.611 CV 1
ASSI { 131}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 47 and name HB1 ))
2.500 0.800 0.800 peak 131 spectrum 1 weight 0.10000E+01 volume 0.63000E-02 ppm1 7.920 ppm2 3.979 CV 1
ASSI { 132}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 47 and name HB2 ))
2.900 1.000 1.000 peak 132 spectrum 1 weight 0.10000E+01 volume 0.25669E-02 ppm1 7.921 ppm2 4.439 CV 1
ASSI { 134}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 48 and name HB1 ))
3.300 1.400 1.400 peak 134 spectrum 1 weight 0.10000E+01 volume 0.13878E-02 ppm1 7.920 ppm2 2.960 CV 1
ASSI { 135}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 48 and name HB2 ))
2.900 1.000 1.000 peak 135 spectrum 1 weight 0.10000E+01 volume 0.20516E-02 ppm1 7.921 ppm2 2.754 CV 1
ASSI { 136}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HA ))
2.600 0.800 0.800 peak 136 spectrum 1 weight 0.10000E+01 volume 0.39853E-02 ppm1 7.919 ppm2 4.147 CV 1
ASSI { 137}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HB2 ))
2.400 0.700 0.700 peak 137 spectrum 1 weight 0.10000E+01 volume 0.76577E-02 ppm1 7.920 ppm2 1.874 CV 1
OR { 137}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HB1 ))
ASSI { 138}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HG1 ))
3.900 1.900 1.900 peak 138 spectrum 1 weight 0.10000E+01 volume 0.10988E-02 ppm1 7.917 ppm2 1.487 CV 1
ASSI { 139}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HG2 ))
3.000 1.100 1.100 peak 139 spectrum 1 weight 0.10000E+01 volume 0.60188E-03 ppm1 7.922 ppm2 1.374 CV 1
ASSI { 140}
(( segid "SUPF" and resid 50 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
4.200 2.200 1.800 peak 140 spectrum 1 weight 0.10000E+01 volume 0.81547E-03 ppm1 7.864 ppm2 1.107 CV 1
ASSI { 141}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 49 and name HG1 ))
3.200 1.300 1.300 peak 141 spectrum 1 weight 0.10000E+01 volume 0.57061E-03 ppm1 7.865 ppm2 1.465 CV 1
ASSI { 143}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 47 and name HB1 ))
4.000 2.000 2.000 peak 143 spectrum 1 weight 0.10000E+01 volume 0.96991E-03 ppm1 7.864 ppm2 3.995 CV 1
ASSI { 144}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 49 and name HB1 ))
3.100 1.200 1.200 peak 144 spectrum 1 weight 0.10000E+01 volume 0.38940E-02 ppm1 7.865 ppm2 1.842 CV 1
OR { 144}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 49 and name HB2 ))
ASSI { 145}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 50 and name HA ))
2.400 0.800 0.800 peak 145 spectrum 1 weight 0.10000E+01 volume 0.52628E-02 ppm1 7.866 ppm2 4.153 CV 1
ASSI { 146}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 50 and name HB ))
2.300 0.600 0.600 peak 146 spectrum 1 weight 0.10000E+01 volume 0.58905E-02 ppm1 7.865 ppm2 4.451 CV 1
ASSI { 147}
(( segid "SUPF" and resid 50 and name HN ))
( segid "SUPF" and resid 50 and name HG2%)
3.300 1.400 1.400 peak 147 spectrum 1 weight 0.10000E+01 volume 0.34668E-02 ppm1 7.865 ppm2 1.284 CV 1
ASSI { 148}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 51 and name HN ))
2.400 0.700 0.700 peak 148 spectrum 1 weight 0.10000E+01 volume 0.47047E-02 ppm1 7.865 ppm2 8.140 CV 1
ASSI { 152}
(( segid "SUPF" and resid 51 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
3.100 1.200 1.200 peak 152 spectrum 1 weight 0.10000E+01 volume 0.22158E-02 ppm1 8.148 ppm2 1.119 CV 1
ASSI { 153}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 48 and name HA ))
3.000 1.100 1.100 peak 153 spectrum 1 weight 0.10000E+01 volume 0.16506E-02 ppm1 8.149 ppm2 4.002 CV 1
ASSI { 155}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 50 and name HB ))
2.500 0.800 0.800 peak 155 spectrum 1 weight 0.10000E+01 volume 0.28368E-02 ppm1 8.147 ppm2 4.458 CV 1
ASSI { 156}
(( segid "SUPF" and resid 51 and name HN ))
( segid "SUPF" and resid 50 and name HG2%)
3.500 1.500 1.500 peak 156 spectrum 1 weight 0.10000E+01 volume 0.17287E-02 ppm1 8.148 ppm2 1.290 CV 1
ASSI { 157}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 51 and name HA ))
2.400 0.700 0.700 peak 157 spectrum 1 weight 0.10000E+01 volume 0.56651E-02 ppm1 8.147 ppm2 4.164 CV 1
ASSI { 158}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 51 and name HB1 ))
2.500 0.800 0.800 peak 158 spectrum 1 weight 0.10000E+01 volume 0.38371E-02 ppm1 8.147 ppm2 1.725 CV 1
ASSI { 159}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 51 and name HB2 ))
2.200 0.600 0.600 peak 159 spectrum 1 weight 0.10000E+01 volume 0.76505E-02 ppm1 8.148 ppm2 1.573 CV 1
ASSI { 160}
(( segid "SUPF" and resid 51 and name HN ))
( segid "SUPF" and resid 51 and name HD1%)
3.900 1.900 1.900 peak 160 spectrum 1 weight 0.10000E+01 volume 0.14731E-02 ppm1 8.148 ppm2 0.810 CV 1
ASSI { 161}
(( segid "SUPF" and resid 51 and name HN ))
( segid "SUPF" and resid 51 and name HD2%)
3.800 1.800 1.800 peak 161 spectrum 1 weight 0.10000E+01 volume 0.20386E-02 ppm1 8.148 ppm2 0.640 CV 1
ASSI { 162}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 52 and name HN ))
2.600 0.800 0.800 peak 162 spectrum 1 weight 0.10000E+01 volume 0.36054E-02 ppm1 8.147 ppm2 8.515 CV 1
ASSI { 166}
(( segid "SUPF" and resid 52 and name HN ))
(( segid "SUPF" and resid 51 and name HA ))
2.800 1.000 1.000 peak 166 spectrum 1 weight 0.10000E+01 volume 0.31627E-02 ppm1 8.524 ppm2 4.157 CV 1
ASSI { 167}
(( segid "SUPF" and resid 52 and name HN ))
(( segid "SUPF" and resid 51 and name HB1 ))
2.600 0.900 0.900 peak 167 spectrum 1 weight 0.10000E+01 volume 0.20511E-02 ppm1 8.525 ppm2 1.726 CV 1
ASSI { 168}
(( segid "SUPF" and resid 52 and name HN ))
(( segid "SUPF" and resid 51 and name HB2 ))
3.300 1.400 1.400 peak 168 spectrum 1 weight 0.10000E+01 volume 0.38697E-02 ppm1 8.529 ppm2 1.570 CV 1
ASSI { 169}
(( segid "SUPF" and resid 52 and name HN ))
(( segid "SUPF" and resid 52 and name HA ))
2.700 0.900 0.900 peak 169 spectrum 1 weight 0.10000E+01 volume 0.33983E-02 ppm1 8.525 ppm2 3.818 CV 1
ASSI { 171}
(( segid "SUPF" and resid 52 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
3.400 1.400 1.400 peak 171 spectrum 1 weight 0.10000E+01 volume 0.16872E-02 ppm1 8.527 ppm2 1.344 CV 1
ASSI { 173}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 51 and name HN ))
3.700 1.700 1.700 peak 173 spectrum 1 weight 0.10000E+01 volume 0.69451E-03 ppm1 8.484 ppm2 8.166 CV 1
ASSI { 174}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 52 and name HA ))
3.500 1.600 1.600 peak 174 spectrum 1 weight 0.10000E+01 volume 0.83366E-03 ppm1 8.488 ppm2 3.818 CV 1
ASSI { 175}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 52 and name HB1 ))
2.600 0.800 0.800 peak 175 spectrum 1 weight 0.10000E+01 volume 0.43491E-02 ppm1 8.487 ppm2 3.509 CV 1
OR { 175}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 52 and name HB2 ))
ASSI { 176}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 53 and name HB1 ))
2.600 0.900 0.900 peak 176 spectrum 1 weight 0.10000E+01 volume 0.34605E-02 ppm1 8.487 ppm2 2.078 CV 1
ASSI { 177}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 53 and name HB2 ))
2.400 0.700 0.700 peak 177 spectrum 1 weight 0.10000E+01 volume 0.59197E-02 ppm1 8.487 ppm2 2.262 CV 1
ASSI { 178}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 53 and name HG2 ))
3.400 1.400 1.400 peak 178 spectrum 1 weight 0.10000E+01 volume 0.46317E-02 ppm1 8.488 ppm2 2.620 CV 1
ASSI { 180}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 53 and name HN ))
2.700 0.900 0.900 peak 180 spectrum 1 weight 0.10000E+01 volume 0.26951E-02 ppm1 7.837 ppm2 8.483 CV 1
ASSI { 181}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 53 and name HB1 ))
2.800 1.000 1.000 peak 181 spectrum 1 weight 0.10000E+01 volume 0.16701E-02 ppm1 7.838 ppm2 2.085 CV 1
ASSI { 182}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 53 and name HB2 ))
3.700 1.700 1.700 peak 182 spectrum 1 weight 0.10000E+01 volume 0.20278E-02 ppm1 7.837 ppm2 2.253 CV 1
ASSI { 183}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 53 and name HG2 ))
4.300 2.300 1.700 peak 183 spectrum 1 weight 0.10000E+01 volume 0.48289E-03 ppm1 7.837 ppm2 2.630 CV 1
ASSI { 184}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 54 and name HA ))
2.600 0.800 0.800 peak 184 spectrum 1 weight 0.10000E+01 volume 0.49479E-02 ppm1 7.835 ppm2 4.130 CV 1
ASSI { 185}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 54 and name HB1 ))
2.600 0.800 0.800 peak 185 spectrum 1 weight 0.10000E+01 volume 0.36652E-02 ppm1 7.837 ppm2 2.836 CV 1
ASSI { 186}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 54 and name HB2 ))
2.500 0.800 0.800 peak 186 spectrum 1 weight 0.10000E+01 volume 0.43609E-02 ppm1 7.839 ppm2 3.212 CV 1
ASSI { 187}
(( segid "SUPF" and resid 54 and name HN ))
( segid "SUPF" and resid 54 and name HD% )
4.300 2.400 1.700 peak 187 spectrum 1 weight 0.10000E+01 volume 0.96051E-03 ppm1 7.841 ppm2 6.268 CV 1
ASSI { 188}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 55 and name HN ))
2.700 0.900 0.900 peak 188 spectrum 1 weight 0.10000E+01 volume 0.28964E-02 ppm1 7.837 ppm2 7.963 CV 1
ASSI { 190}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 52 and name HA ))
3.700 1.700 1.700 peak 190 spectrum 1 weight 0.10000E+01 volume 0.51492E-03 ppm1 7.968 ppm2 3.837 CV 1
ASSI { 191}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 54 and name HA ))
3.300 1.300 1.300 peak 191 spectrum 1 weight 0.10000E+01 volume 0.15361E-02 ppm1 7.966 ppm2 4.138 CV 1
ASSI { 192}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 54 and name HD% )
3.700 1.700 1.700 peak 192 spectrum 1 weight 0.10000E+01 volume 0.69560E-03 ppm1 7.961 ppm2 6.253 CV 1
ASSI { 193}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 55 and name HA ))
2.800 1.000 1.000 peak 193 spectrum 1 weight 0.10000E+01 volume 0.18644E-02 ppm1 7.963 ppm2 4.296 CV 1
ASSI { 194}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 55 and name HB1 ))
3.300 1.400 1.400 peak 194 spectrum 1 weight 0.10000E+01 volume 0.38646E-02 ppm1 7.966 ppm2 2.906 CV 1
ASSI { 196}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 55 and name HD% )
2.200 0.600 0.600 peak 196 spectrum 1 weight 0.10000E+01 volume 0.68205E-02 ppm1 7.967 ppm2 7.831 CV 1
ASSI { 197}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 56 and name HN ))
2.500 0.800 0.800 peak 197 spectrum 1 weight 0.10000E+01 volume 0.32365E-02 ppm1 7.966 ppm2 8.356 CV 1
ASSI { 198}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 58 and name HD% )
4.800 2.900 1.200 peak 198 spectrum 1 weight 0.10000E+01 volume 0.49577E-03 ppm1 7.964 ppm2 7.348 CV 1
ASSI { 199}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 61 and name HD1%)
3.500 1.600 1.600 peak 199 spectrum 1 weight 0.10000E+01 volume 0.13429E-02 ppm1 7.968 ppm2 0.402 CV 1
ASSI { 200}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 81 and name HG1%)
4.900 3.000 1.100 peak 200 spectrum 1 weight 0.10000E+01 volume 0.41660E-03 ppm1 7.968 ppm2 0.577 CV 1
ASSI { 203}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 55 and name HB1 ))
3.900 1.900 1.900 peak 203 spectrum 1 weight 0.10000E+01 volume 0.70951E-03 ppm1 8.366 ppm2 2.915 CV 1
ASSI { 204}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 55 and name HB2 ))
3.700 1.800 1.800 peak 204 spectrum 1 weight 0.10000E+01 volume 0.44181E-03 ppm1 8.363 ppm2 3.266 CV 1
ASSI { 205}
(( segid "SUPF" and resid 56 and name HN ))
( segid "SUPF" and resid 55 and name HD% )
4.500 2.500 1.500 peak 205 spectrum 1 weight 0.10000E+01 volume 0.65139E-03 ppm1 8.364 ppm2 7.808 CV 1
ASSI { 206}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HA ))
2.600 0.800 0.800 peak 206 spectrum 1 weight 0.10000E+01 volume 0.40112E-02 ppm1 8.365 ppm2 4.498 CV 1
ASSI { 207}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HB1 ))
2.800 1.000 1.000 peak 207 spectrum 1 weight 0.10000E+01 volume 0.31929E-02 ppm1 8.365 ppm2 2.072 CV 1
ASSI { 208}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HB2 ))
2.400 0.700 0.700 peak 208 spectrum 1 weight 0.10000E+01 volume 0.37801E-02 ppm1 8.365 ppm2 2.155 CV 1
ASSI { 209}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HG1 ))
3.600 1.700 1.700 peak 209 spectrum 1 weight 0.10000E+01 volume 0.24581E-02 ppm1 8.365 ppm2 2.396 CV 1
ASSI { 210}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HG2 ))
3.600 1.600 1.600 peak 210 spectrum 1 weight 0.10000E+01 volume 0.26934E-02 ppm1 8.366 ppm2 2.593 CV 1
ASSI { 213}
(( segid "SUPF" and resid 56 and name HN ))
( segid "SUPF" and resid 61 and name HD1%)
2.700 0.900 0.900 peak 213 spectrum 1 weight 0.10000E+01 volume 0.25233E-02 ppm1 8.366 ppm2 0.404 CV 1
ASSI { 214}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 56 and name HG2 ))
4.000 2.000 2.000 peak 214 spectrum 1 weight 0.10000E+01 volume 0.62699E-03 ppm1 6.734 ppm2 2.585 CV 1
ASSI { 216}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 56 and name HN ))
2.900 1.000 1.000 peak 216 spectrum 1 weight 0.10000E+01 volume 0.17943E-02 ppm1 6.736 ppm2 8.359 CV 1
ASSI { 217}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 56 and name HA ))
3.400 1.400 1.400 peak 217 spectrum 1 weight 0.10000E+01 volume 0.90950E-03 ppm1 6.734 ppm2 4.490 CV 1
ASSI { 220}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 57 and name HA ))
2.800 1.000 1.000 peak 220 spectrum 1 weight 0.10000E+01 volume 0.28985E-02 ppm1 6.734 ppm2 4.082 CV 1
ASSI { 222}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 58 and name HN ))
2.800 1.000 1.000 peak 222 spectrum 1 weight 0.10000E+01 volume 0.20716E-02 ppm1 6.732 ppm2 7.662 CV 1
ASSI { 223}
(( segid "SUPF" and resid 57 and name HN ))
( segid "SUPF" and resid 58 and name HD% )
3.900 1.900 1.900 peak 223 spectrum 1 weight 0.10000E+01 volume 0.68891E-03 ppm1 6.734 ppm2 7.368 CV 1
ASSI { 227}
(( segid "SUPF" and resid 57 and name HE21))
(( segid "SUPF" and resid 57 and name HA ))
3.800 1.800 1.800 peak 227 spectrum 1 weight 0.10000E+01 volume 0.82709E-03 ppm1 6.740 ppm2 4.093 CV 1
ASSI { 228}
(( segid "SUPF" and resid 57 and name HE22))
(( segid "SUPF" and resid 57 and name HE21))
2.000 0.500 0.500 peak 228 spectrum 1 weight 0.10000E+01 volume 0.83360E-02 ppm1 6.082 ppm2 6.741 CV 1
ASSI { 230}
(( segid "SUPF" and resid 57 and name HE21))
(( segid "SUPF" and resid 57 and name HG1 ))
3.100 1.200 1.200 peak 230 spectrum 1 weight 0.10000E+01 volume 0.24214E-02 ppm1 6.739 ppm2 1.540 CV 1
ASSI { 231}
(( segid "SUPF" and resid 57 and name HE22))
(( segid "SUPF" and resid 57 and name HG1 ))
4.200 2.200 1.800 peak 231 spectrum 1 weight 0.10000E+01 volume 0.98196E-03 ppm1 6.083 ppm2 1.517 CV 1
ASSI { 232}
(( segid "SUPF" and resid 57 and name HE21))
(( segid "SUPF" and resid 57 and name HG2 ))
3.100 1.200 1.200 peak 232 spectrum 1 weight 0.10000E+01 volume 0.89191E-03 ppm1 6.740 ppm2 0.234 CV 1
ASSI { 233}
(( segid "SUPF" and resid 57 and name HE22))
(( segid "SUPF" and resid 57 and name HG2 ))
4.600 2.700 1.400 peak 233 spectrum 1 weight 0.10000E+01 volume 0.48966E-03 ppm1 6.087 ppm2 0.218 CV 1
ASSI { 234}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 56 and name HA ))
3.400 1.400 1.400 peak 234 spectrum 1 weight 0.10000E+01 volume 0.10502E-02 ppm1 7.671 ppm2 4.507 CV 1
ASSI { 236}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 57 and name HA ))
3.800 1.800 1.800 peak 236 spectrum 1 weight 0.10000E+01 volume 0.61163E-03 ppm1 7.673 ppm2 4.065 CV 1
ASSI { 237}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 57 and name HG1 ))
3.300 1.300 1.300 peak 237 spectrum 1 weight 0.10000E+01 volume 0.16935E-02 ppm1 7.672 ppm2 1.545 CV 1
ASSI { 238}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 57 and name HG2 ))
3.300 1.400 1.400 peak 238 spectrum 1 weight 0.10000E+01 volume 0.94112E-03 ppm1 7.679 ppm2 0.203 CV 1
ASSI { 239}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 58 and name HA ))
3.000 1.100 1.100 peak 239 spectrum 1 weight 0.10000E+01 volume 0.17359E-02 ppm1 7.675 ppm2 4.696 CV 1
ASSI { 240}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 58 and name HB1 ))
3.400 1.500 1.500 peak 240 spectrum 1 weight 0.10000E+01 volume 0.26905E-02 ppm1 7.675 ppm2 2.897 CV 1
ASSI { 241}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 58 and name HB2 ))
2.800 1.000 1.000 peak 241 spectrum 1 weight 0.10000E+01 volume 0.16004E-02 ppm1 7.677 ppm2 3.631 CV 1
ASSI { 242}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 59 and name HN ))
2.400 0.700 0.700 peak 242 spectrum 1 weight 0.10000E+01 volume 0.67952E-02 ppm1 7.675 ppm2 7.350 CV 1
ASSI { 243}
(( segid "SUPF" and resid 58 and name HN ))
( segid "SUPF" and resid 83 and name HE% )
3.800 1.800 1.800 peak 243 spectrum 1 weight 0.10000E+01 volume 0.71144E-03 ppm1 7.676 ppm2 1.954 CV 1
ASSI { 245}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 57 and name HA ))
3.700 1.700 1.700 peak 245 spectrum 1 weight 0.10000E+01 volume 0.72307E-03 ppm1 7.335 ppm2 4.057 CV 1
ASSI { 247}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 58 and name HA ))
3.300 1.400 1.400 peak 247 spectrum 1 weight 0.10000E+01 volume 0.13549E-02 ppm1 7.335 ppm2 4.706 CV 1
ASSI { 248}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 58 and name HB1 ))
4.100 2.100 1.900 peak 248 spectrum 1 weight 0.10000E+01 volume 0.76306E-03 ppm1 7.333 ppm2 2.893 CV 1
ASSI { 249}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 58 and name HB2 ))
3.700 1.700 1.700 peak 249 spectrum 1 weight 0.10000E+01 volume 0.47588E-03 ppm1 7.336 ppm2 3.658 CV 1
ASSI { 250}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 59 and name HA1 ))
2.700 0.900 0.900 peak 250 spectrum 1 weight 0.10000E+01 volume 0.44812E-02 ppm1 7.336 ppm2 4.515 CV 1
ASSI { 251}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 59 and name HA2 ))
2.700 0.900 0.900 peak 251 spectrum 1 weight 0.10000E+01 volume 0.34824E-02 ppm1 7.336 ppm2 3.855 CV 1
ASSI { 252}
(( segid "SUPF" and resid 59 and name HN ))
( segid "SUPF" and resid 83 and name HE% )
3.100 1.200 1.200 peak 252 spectrum 1 weight 0.10000E+01 volume 0.16758E-02 ppm1 7.335 ppm2 1.926 CV 1
ASSI { 254}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 59 and name HN ))
4.300 2.300 1.700 peak 254 spectrum 1 weight 0.10000E+01 volume 0.69114E-03 ppm1 8.214 ppm2 7.339 CV 1
ASSI { 255}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 59 and name HA1 ))
2.500 0.800 0.800 peak 255 spectrum 1 weight 0.10000E+01 volume 0.52475E-02 ppm1 8.208 ppm2 4.538 CV 1
ASSI { 256}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 59 and name HA2 ))
2.600 0.800 0.800 peak 256 spectrum 1 weight 0.10000E+01 volume 0.55376E-02 ppm1 8.208 ppm2 3.856 CV 1
ASSI { 257}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 60 and name HA ))
2.600 0.800 0.800 peak 257 spectrum 1 weight 0.10000E+01 volume 0.44436E-02 ppm1 8.208 ppm2 4.717 CV 1
ASSI { 258}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 60 and name HB1 ))
2.800 1.000 1.000 peak 258 spectrum 1 weight 0.10000E+01 volume 0.77144E-02 ppm1 8.205 ppm2 2.534 CV 1
ASSI { 260}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 84 and name HB1 ))
3.500 1.500 1.500 peak 260 spectrum 1 weight 0.10000E+01 volume 0.11349E-02 ppm1 8.207 ppm2 1.727 CV 1
ASSI { 261}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 84 and name HB2 ))
3.900 1.900 1.900 peak 261 spectrum 1 weight 0.10000E+01 volume 0.14416E-02 ppm1 8.205 ppm2 1.902 CV 1
ASSI { 262}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 60 and name HN ))
4.800 2.800 1.200 peak 262 spectrum 1 weight 0.10000E+01 volume 0.45557E-03 ppm1 8.801 ppm2 8.217 CV 1
ASSI { 263}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 60 and name HA ))
2.200 0.600 0.600 peak 263 spectrum 1 weight 0.10000E+01 volume 0.11294E-01 ppm1 8.801 ppm2 4.723 CV 1
ASSI { 264}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 60 and name HB2 ))
3.500 1.600 1.600 peak 264 spectrum 1 weight 0.10000E+01 volume 0.23158E-02 ppm1 8.799 ppm2 2.576 CV 1
ASSI { 265}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 61 and name HA ))
2.800 0.900 0.900 peak 265 spectrum 1 weight 0.10000E+01 volume 0.22506E-02 ppm1 8.801 ppm2 4.142 CV 1
ASSI { 266}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 61 and name HB ))
2.300 0.700 0.700 peak 266 spectrum 1 weight 0.10000E+01 volume 0.64470E-02 ppm1 8.800 ppm2 1.511 CV 1
ASSI { 267}
(( segid "SUPF" and resid 61 and name HN ))
( segid "SUPF" and resid 61 and name HD1%)
4.300 2.300 1.700 peak 267 spectrum 1 weight 0.10000E+01 volume 0.70831E-03 ppm1 8.803 ppm2 0.395 CV 1
ASSI { 268}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 61 and name HG12))
4.300 2.300 1.700 peak 268 spectrum 1 weight 0.10000E+01 volume 0.72337E-03 ppm1 8.797 ppm2 1.007 CV 1
ASSI { 269}
(( segid "SUPF" and resid 61 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
3.700 1.700 1.700 peak 269 spectrum 1 weight 0.10000E+01 volume 0.15573E-02 ppm1 8.803 ppm2 0.590 CV 1
ASSI { 270}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 84 and name HB1 ))
3.900 1.900 1.900 peak 270 spectrum 1 weight 0.10000E+01 volume 0.53869E-03 ppm1 8.798 ppm2 1.706 CV 1
ASSI { 273}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 61 and name HN ))
4.200 2.200 1.800 peak 273 spectrum 1 weight 0.10000E+01 volume 0.47288E-03 ppm1 9.117 ppm2 8.809 CV 1
ASSI { 274}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 61 and name HA ))
2.100 0.600 0.600 peak 274 spectrum 1 weight 0.10000E+01 volume 0.68427E-02 ppm1 9.109 ppm2 4.140 CV 1
ASSI { 275}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 61 and name HG11))
4.900 3.000 1.100 peak 275 spectrum 1 weight 0.10000E+01 volume 0.50910E-03 ppm1 9.115 ppm2 1.482 CV 1
ASSI { 276}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 61 and name HG12))
4.500 2.500 1.500 peak 276 spectrum 1 weight 0.10000E+01 volume 0.62097E-03 ppm1 9.110 ppm2 1.000 CV 1
ASSI { 277}
(( segid "SUPF" and resid 62 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
2.700 0.900 0.900 peak 277 spectrum 1 weight 0.10000E+01 volume 0.30456E-02 ppm1 9.109 ppm2 0.585 CV 1
ASSI { 278}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HA ))
3.000 1.100 1.100 peak 278 spectrum 1 weight 0.10000E+01 volume 0.18388E-02 ppm1 9.109 ppm2 4.399 CV 1
ASSI { 279}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HB1 ))
3.600 1.600 1.600 peak 279 spectrum 1 weight 0.10000E+01 volume 0.22275E-02 ppm1 9.110 ppm2 1.663 CV 1
ASSI { 280}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HB2 ))
2.600 0.800 0.800 peak 280 spectrum 1 weight 0.10000E+01 volume 0.21045E-02 ppm1 9.111 ppm2 1.807 CV 1
ASSI { 281}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HG1 ))
3.300 1.400 1.400 peak 281 spectrum 1 weight 0.10000E+01 volume 0.92817E-03 ppm1 9.111 ppm2 2.081 CV 1
OR { 281}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HG2 ))
ASSI { 283}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 83 and name HA ))
3.000 1.100 1.100 peak 283 spectrum 1 weight 0.10000E+01 volume 0.20252E-02 ppm1 9.109 ppm2 5.100 CV 1
ASSI { 285}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
3.500 1.500 1.500 peak 285 spectrum 1 weight 0.10000E+01 volume 0.47087E-03 ppm1 7.534 ppm2 1.486 CV 1
OR { 285}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 61 and name HD1%)
ASSI { 286}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 61 and name HA ))
3.600 1.700 1.700 peak 286 spectrum 1 weight 0.10000E+01 volume 0.14870E-02 ppm1 7.528 ppm2 4.137 CV 1
ASSI { 287}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
2.200 0.600 0.600 peak 287 spectrum 1 weight 0.10000E+01 volume 0.60332E-02 ppm1 7.532 ppm2 0.587 CV 1
ASSI { 288}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HN ))
2.400 0.700 0.700 peak 288 spectrum 1 weight 0.10000E+01 volume 0.53876E-02 ppm1 7.529 ppm2 9.108 CV 1
ASSI { 289}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HA ))
3.500 1.500 1.500 peak 289 spectrum 1 weight 0.10000E+01 volume 0.10766E-02 ppm1 7.531 ppm2 4.402 CV 1
ASSI { 290}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HB1 ))
3.600 1.600 1.600 peak 290 spectrum 1 weight 0.10000E+01 volume 0.16915E-02 ppm1 7.529 ppm2 1.658 CV 1
ASSI { 291}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HB2 ))
2.500 0.800 0.800 peak 291 spectrum 1 weight 0.10000E+01 volume 0.25652E-02 ppm1 7.532 ppm2 1.807 CV 1
ASSI { 292}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HG1 ))
4.200 2.200 1.800 peak 292 spectrum 1 weight 0.10000E+01 volume 0.10386E-02 ppm1 7.529 ppm2 2.111 CV 1
OR { 292}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HG2 ))
ASSI { 293}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 63 and name HA ))
2.800 1.000 1.000 peak 293 spectrum 1 weight 0.10000E+01 volume 0.21537E-02 ppm1 7.532 ppm2 4.600 CV 1
ASSI { 294}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 63 and name HB2 ))
2.700 0.900 0.900 peak 294 spectrum 1 weight 0.10000E+01 volume 0.31728E-02 ppm1 7.531 ppm2 2.013 CV 1
OR { 294}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 63 and name HB1 ))
ASSI { 295}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 64 and name HN ))
3.800 1.800 1.800 peak 295 spectrum 1 weight 0.10000E+01 volume 0.84408E-03 ppm1 7.532 ppm2 8.929 CV 1
ASSI { 296}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
4.500 2.500 1.500 peak 296 spectrum 1 weight 0.10000E+01 volume 0.49649E-03 ppm1 7.533 ppm2 1.338 CV 1
ASSI { 297}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 82 and name HN ))
2.900 1.000 1.000 peak 297 spectrum 1 weight 0.10000E+01 volume 0.21709E-02 ppm1 7.534 ppm2 9.511 CV 1
ASSI { 298}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 82 and name HB ))
2.500 0.800 0.800 peak 298 spectrum 1 weight 0.10000E+01 volume 0.34031E-02 ppm1 7.531 ppm2 3.943 CV 1
ASSI { 299}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 82 and name HG2%)
4.200 2.200 1.800 peak 299 spectrum 1 weight 0.10000E+01 volume 0.81733E-03 ppm1 7.528 ppm2 1.165 CV 1
ASSI { 301}
(( segid "SUPF" and resid 64 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
3.400 1.500 1.500 peak 301 spectrum 1 weight 0.10000E+01 volume 0.10744E-02 ppm1 8.911 ppm2 0.603 CV 1
ASSI { 303}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 63 and name HA ))
2.100 0.500 0.500 peak 303 spectrum 1 weight 0.10000E+01 volume 0.12787E-01 ppm1 8.908 ppm2 4.600 CV 1
ASSI { 304}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 63 and name HB2 ))
3.500 1.600 1.600 peak 304 spectrum 1 weight 0.10000E+01 volume 0.31794E-02 ppm1 8.907 ppm2 2.025 CV 1
OR { 304}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 63 and name HB1 ))
ASSI { 305}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 63 and name HG1 ))
3.200 1.300 1.300 peak 305 spectrum 1 weight 0.10000E+01 volume 0.18556E-02 ppm1 8.906 ppm2 2.201 CV 1
ASSI { 306}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 64 and name HA ))
2.800 1.000 1.000 peak 306 spectrum 1 weight 0.10000E+01 volume 0.19700E-02 ppm1 8.909 ppm2 5.177 CV 1
ASSI { 307}
(( segid "SUPF" and resid 64 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
2.600 0.800 0.800 peak 307 spectrum 1 weight 0.10000E+01 volume 0.32963E-02 ppm1 8.906 ppm2 1.338 CV 1
ASSI { 308}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 65 and name HN ))
3.700 1.700 1.700 peak 308 spectrum 1 weight 0.10000E+01 volume 0.99792E-03 ppm1 8.906 ppm2 8.742 CV 1
ASSI { 309}
(( segid "SUPF" and resid 64 and name HN ))
( segid "SUPF" and resid 65 and name HG1%)
3.600 1.700 1.700 peak 309 spectrum 1 weight 0.10000E+01 volume 0.60928E-03 ppm1 8.904 ppm2 0.950 CV 1
OR { 309}
(( segid "SUPF" and resid 64 and name HN ))
( segid "SUPF" and resid 65 and name HG2%)
ASSI { 312}
(( segid "SUPF" and resid 65 and name HN ))
(( segid "SUPF" and resid 64 and name HA ))
2.100 0.600 0.600 peak 312 spectrum 1 weight 0.10000E+01 volume 0.92275E-02 ppm1 8.753 ppm2 5.179 CV 1
ASSI { 313}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
3.400 1.400 1.400 peak 313 spectrum 1 weight 0.10000E+01 volume 0.19993E-02 ppm1 8.753 ppm2 1.346 CV 1
ASSI { 314}
(( segid "SUPF" and resid 65 and name HN ))
(( segid "SUPF" and resid 65 and name HA ))
2.500 0.800 0.800 peak 314 spectrum 1 weight 0.10000E+01 volume 0.38029E-02 ppm1 8.754 ppm2 4.711 CV 1
ASSI { 315}
(( segid "SUPF" and resid 65 and name HN ))
(( segid "SUPF" and resid 65 and name HB ))
3.600 1.600 1.600 peak 315 spectrum 1 weight 0.10000E+01 volume 0.13438E-02 ppm1 8.750 ppm2 1.981 CV 1
ASSI { 316}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 65 and name HG2%)
2.600 0.800 0.800 peak 316 spectrum 1 weight 0.10000E+01 volume 0.44442E-02 ppm1 8.753 ppm2 0.959 CV 1
OR { 316}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 65 and name HG1%)
ASSI { 317}
(( segid "SUPF" and resid 65 and name HN ))
(( segid "SUPF" and resid 66 and name HA ))
4.000 2.000 2.000 peak 317 spectrum 1 weight 0.10000E+01 volume 0.41540E-03 ppm1 8.753 ppm2 3.930 CV 1
ASSI { 318}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
3.600 1.600 1.600 peak 318 spectrum 1 weight 0.10000E+01 volume 0.13131E-02 ppm1 8.753 ppm2 0.628 CV 1
ASSI { 319}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 81 and name HG2%)
4.200 2.200 1.800 peak 319 spectrum 1 weight 0.10000E+01 volume 0.64253E-03 ppm1 8.751 ppm2 0.397 CV 1
ASSI { 321}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 48 and name HB1 ))
3.400 1.400 1.400 peak 321 spectrum 1 weight 0.10000E+01 volume 0.53278E-03 ppm1 8.511 ppm2 2.982 CV 1
ASSI { 322}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 65 and name HN ))
3.800 1.800 1.800 peak 322 spectrum 1 weight 0.10000E+01 volume 0.93606E-03 ppm1 8.509 ppm2 8.747 CV 1
ASSI { 323}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 65 and name HA ))
2.000 0.500 0.500 peak 323 spectrum 1 weight 0.10000E+01 volume 0.14000E-01 ppm1 8.512 ppm2 4.705 CV 1
ASSI { 324}
(( segid "SUPF" and resid 66 and name HN ))
( segid "SUPF" and resid 65 and name HG2%)
3.200 1.300 1.300 peak 324 spectrum 1 weight 0.10000E+01 volume 0.35266E-02 ppm1 8.511 ppm2 0.949 CV 1
OR { 324}
(( segid "SUPF" and resid 66 and name HN ))
( segid "SUPF" and resid 65 and name HG1%)
ASSI { 325}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 66 and name HA ))
2.700 0.900 0.900 peak 325 spectrum 1 weight 0.10000E+01 volume 0.20019E-02 ppm1 8.514 ppm2 3.945 CV 1
ASSI { 326}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 66 and name HB ))
2.300 0.700 0.700 peak 326 spectrum 1 weight 0.10000E+01 volume 0.63398E-02 ppm1 8.512 ppm2 1.870 CV 1
ASSI { 327}
(( segid "SUPF" and resid 66 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.700 1.700 1.700 peak 327 spectrum 1 weight 0.10000E+01 volume 0.19067E-02 ppm1 8.511 ppm2 0.773 CV 1
ASSI { 328}
(( segid "SUPF" and resid 66 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
2.500 0.800 0.800 peak 328 spectrum 1 weight 0.10000E+01 volume 0.41756E-02 ppm1 8.511 ppm2 0.619 CV 1
ASSI { 330}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 66 and name HA ))
2.100 0.600 0.600 peak 330 spectrum 1 weight 0.10000E+01 volume 0.69397E-02 ppm1 8.716 ppm2 3.925 CV 1
ASSI { 331}
(( segid "SUPF" and resid 67 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.000 1.100 1.100 peak 331 spectrum 1 weight 0.10000E+01 volume 0.23950E-02 ppm1 8.715 ppm2 0.761 CV 1
ASSI { 332}
(( segid "SUPF" and resid 67 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
4.500 2.600 1.500 peak 332 spectrum 1 weight 0.10000E+01 volume 0.68837E-03 ppm1 8.715 ppm2 0.609 CV 1
ASSI { 333}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 67 and name HA ))
2.800 1.000 1.000 peak 333 spectrum 1 weight 0.10000E+01 volume 0.18216E-02 ppm1 8.715 ppm2 4.081 CV 1
ASSI { 334}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 67 and name HB ))
2.500 0.800 0.800 peak 334 spectrum 1 weight 0.10000E+01 volume 0.38561E-02 ppm1 8.715 ppm2 1.209 CV 1
ASSI { 335}
(( segid "SUPF" and resid 67 and name HN ))
( segid "SUPF" and resid 67 and name HD1%)
3.400 1.500 1.500 peak 335 spectrum 1 weight 0.10000E+01 volume 0.20109E-02 ppm1 8.716 ppm2 0.910 CV 1
ASSI { 336}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 67 and name HG11))
2.500 0.800 0.800 peak 336 spectrum 1 weight 0.10000E+01 volume 0.25542E-02 ppm1 8.716 ppm2 1.446 CV 1
OR { 336}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 338}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 67 and name HN ))
4.400 2.400 1.600 peak 338 spectrum 1 weight 0.10000E+01 volume 0.57998E-03 ppm1 7.962 ppm2 8.714 CV 1
ASSI { 339}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 67 and name HA ))
2.000 0.500 0.500 peak 339 spectrum 1 weight 0.10000E+01 volume 0.14940E-01 ppm1 7.969 ppm2 4.062 CV 1
ASSI { 340}
(( segid "SUPF" and resid 68 and name HN ))
( segid "SUPF" and resid 67 and name HD1%)
3.600 1.600 1.600 peak 340 spectrum 1 weight 0.10000E+01 volume 0.36094E-02 ppm1 7.970 ppm2 0.902 CV 1
ASSI { 341}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 67 and name HG11))
5.000 3.100 1.000 peak 341 spectrum 1 weight 0.10000E+01 volume 0.49594E-03 ppm1 7.966 ppm2 1.449 CV 1
OR { 341}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 342}
(( segid "SUPF" and resid 68 and name HN ))
( segid "SUPF" and resid 67 and name HG2%)
2.500 0.800 0.800 peak 342 spectrum 1 weight 0.10000E+01 volume 0.52216E-02 ppm1 7.968 ppm2 0.848 CV 1
ASSI { 343}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 68 and name HB ))
3.700 1.700 1.700 peak 343 spectrum 1 weight 0.10000E+01 volume 0.97545E-03 ppm1 7.967 ppm2 3.729 CV 1
ASSI { 344}
(( segid "SUPF" and resid 68 and name HN ))
( segid "SUPF" and resid 68 and name HG2%)
2.700 0.900 0.900 peak 344 spectrum 1 weight 0.10000E+01 volume 0.33506E-02 ppm1 7.970 ppm2 0.975 CV 1
ASSI { 345}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 69 and name HN ))
4.200 2.200 1.800 peak 345 spectrum 1 weight 0.10000E+01 volume 0.54148E-03 ppm1 7.967 ppm2 8.541 CV 1
ASSI { 346}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 70 and name HG2 ))
3.500 3.500 2.500 peak 346 spectrum 1 weight 0.10000E+01 volume 0.76830E-03 ppm1 7.967 ppm2 1.693 CV 1
OR { 346}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 70 and name HG1 ))
ASSI { 347}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 68 and name HB ))
2.500 0.800 0.800 peak 347 spectrum 1 weight 0.10000E+01 volume 0.42474E-02 ppm1 8.544 ppm2 3.704 CV 1
ASSI { 348}
(( segid "SUPF" and resid 69 and name HN ))
( segid "SUPF" and resid 68 and name HG2%)
3.800 1.900 1.900 peak 348 spectrum 1 weight 0.10000E+01 volume 0.17636E-02 ppm1 8.544 ppm2 0.972 CV 1
ASSI { 349}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 69 and name HA ))
2.800 1.000 1.000 peak 349 spectrum 1 weight 0.10000E+01 volume 0.25894E-02 ppm1 8.547 ppm2 4.603 CV 1
ASSI { 350}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 69 and name HB1 ))
2.900 1.100 1.100 peak 350 spectrum 1 weight 0.10000E+01 volume 0.38176E-02 ppm1 8.543 ppm2 2.487 CV 1
ASSI { 351}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 69 and name HB2 ))
2.400 0.700 0.700 peak 351 spectrum 1 weight 0.10000E+01 volume 0.46001E-02 ppm1 8.546 ppm2 3.103 CV 1
ASSI { 352}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 74 and name HN ))
3.100 1.200 1.200 peak 352 spectrum 1 weight 0.10000E+01 volume 0.13511E-02 ppm1 8.549 ppm2 7.697 CV 1
ASSI { 353}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 75 and name HA ))
3.800 1.800 1.800 peak 353 spectrum 1 weight 0.10000E+01 volume 0.87227E-03 ppm1 8.543 ppm2 4.269 CV 1
ASSI { 354}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 76 and name HN ))
4.100 2.100 1.900 peak 354 spectrum 1 weight 0.10000E+01 volume 0.65482E-03 ppm1 8.541 ppm2 9.074 CV 1
ASSI { 355}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 76 and name HG1 ))
3.100 1.200 1.200 peak 355 spectrum 1 weight 0.10000E+01 volume 0.13057E-02 ppm1 8.543 ppm2 1.614 CV 1
OR { 355}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 76 and name HG2 ))
ASSI { 357}
(( segid "SUPF" and resid 70 and name HN ))
(( segid "SUPF" and resid 69 and name HA ))
2.700 0.900 0.900 peak 357 spectrum 1 weight 0.10000E+01 volume 0.21693E-02 ppm1 8.959 ppm2 4.599 CV 1
ASSI { 358}
(( segid "SUPF" and resid 70 and name HN ))
(( segid "SUPF" and resid 70 and name HB2 ))
3.100 1.200 1.200 peak 358 spectrum 1 weight 0.10000E+01 volume 0.14128E-02 ppm1 8.955 ppm2 1.889 CV 1
OR { 358}
(( segid "SUPF" and resid 70 and name HN ))
(( segid "SUPF" and resid 70 and name HB1 ))
ASSI { 359}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HA ))
3.200 1.300 1.300 peak 359 spectrum 1 weight 0.10000E+01 volume 0.13634E-02 ppm1 8.786 ppm2 4.102 CV 1
ASSI { 360}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HB2 ))
3.300 1.400 1.400 peak 360 spectrum 1 weight 0.10000E+01 volume 0.12275E-02 ppm1 8.787 ppm2 1.879 CV 1
OR { 360}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HB1 ))
ASSI { 361}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HG2 ))
4.500 2.500 1.500 peak 361 spectrum 1 weight 0.10000E+01 volume 0.66271E-03 ppm1 8.783 ppm2 1.699 CV 1
OR { 361}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HG1 ))
ASSI { 362}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 71 and name HA ))
2.400 0.700 0.700 peak 362 spectrum 1 weight 0.10000E+01 volume 0.73114E-02 ppm1 8.785 ppm2 4.763 CV 1
ASSI { 363}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 71 and name HB1 ))
3.300 1.400 1.400 peak 363 spectrum 1 weight 0.10000E+01 volume 0.30979E-02 ppm1 8.784 ppm2 3.008 CV 1
ASSI { 364}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 71 and name HB2 ))
2.800 1.000 1.000 peak 364 spectrum 1 weight 0.10000E+01 volume 0.18237E-02 ppm1 8.784 ppm2 2.858 CV 1
ASSI { 365}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 71 and name HD21))
4.000 2.000 2.000 peak 365 spectrum 1 weight 0.10000E+01 volume 0.43456E-03 ppm1 8.781 ppm2 7.907 CV 1
ASSI { 367}
(( segid "SUPF" and resid 71 and name HD21))
(( segid "SUPF" and resid 71 and name HB1 ))
3.100 1.200 1.200 peak 367 spectrum 1 weight 0.10000E+01 volume 0.15723E-02 ppm1 7.910 ppm2 3.015 CV 1
ASSI { 368}
(( segid "SUPF" and resid 71 and name HD22))
(( segid "SUPF" and resid 71 and name HB1 ))
4.300 2.300 1.700 peak 368 spectrum 1 weight 0.10000E+01 volume 0.71933E-03 ppm1 7.008 ppm2 3.010 CV 1
ASSI { 369}
(( segid "SUPF" and resid 71 and name HD21))
(( segid "SUPF" and resid 71 and name HB2 ))
3.700 1.700 1.700 peak 369 spectrum 1 weight 0.10000E+01 volume 0.39329E-03 ppm1 7.912 ppm2 2.855 CV 1
ASSI { 370}
(( segid "SUPF" and resid 71 and name HD22))
(( segid "SUPF" and resid 71 and name HD21))
1.800 0.400 0.400 peak 370 spectrum 1 weight 0.10000E+01 volume 0.17903E-01 ppm1 7.013 ppm2 7.909 CV 1
ASSI { 372}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 71 and name HN ))
2.600 0.800 0.800 peak 372 spectrum 1 weight 0.10000E+01 volume 0.37442E-02 ppm1 8.102 ppm2 8.777 CV 1
ASSI { 373}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 71 and name HA ))
2.700 0.900 0.900 peak 373 spectrum 1 weight 0.10000E+01 volume 0.54625E-02 ppm1 8.103 ppm2 4.764 CV 1
ASSI { 374}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 71 and name HB1 ))
3.200 1.200 1.200 peak 374 spectrum 1 weight 0.10000E+01 volume 0.23087E-02 ppm1 8.105 ppm2 3.016 CV 1
ASSI { 375}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 71 and name HB2 ))
3.000 1.100 1.100 peak 375 spectrum 1 weight 0.10000E+01 volume 0.12837E-02 ppm1 8.105 ppm2 2.862 CV 1
ASSI { 376}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 72 and name HA ))
2.700 0.900 0.900 peak 376 spectrum 1 weight 0.10000E+01 volume 0.32299E-02 ppm1 8.104 ppm2 4.378 CV 1
ASSI { 377}
(( segid "SUPF" and resid 72 and name HN ))
( segid "SUPF" and resid 72 and name HG2%)
2.500 0.800 0.800 peak 377 spectrum 1 weight 0.10000E+01 volume 0.58083E-02 ppm1 8.103 ppm2 1.194 CV 1
ASSI { 378}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 73 and name HN ))
2.400 0.700 0.700 peak 378 spectrum 1 weight 0.10000E+01 volume 0.51131E-02 ppm1 8.104 ppm2 8.310 CV 1
ASSI { 379}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 73 and name HA ))
5.100 3.200 0.900 peak 379 spectrum 1 weight 0.10000E+01 volume 0.50765E-03 ppm1 8.104 ppm2 4.004 CV 1
ASSI { 382}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 69 and name HB2 ))
3.800 1.800 1.800 peak 382 spectrum 1 weight 0.10000E+01 volume 0.84065E-03 ppm1 8.322 ppm2 3.086 CV 1
ASSI { 383}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 71 and name HN ))
3.500 1.500 1.500 peak 383 spectrum 1 weight 0.10000E+01 volume 0.91540E-03 ppm1 8.322 ppm2 8.771 CV 1
ASSI { 385}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 72 and name HA ))
3.000 1.100 1.100 peak 385 spectrum 1 weight 0.10000E+01 volume 0.21216E-02 ppm1 8.324 ppm2 4.384 CV 1
ASSI { 386}
(( segid "SUPF" and resid 73 and name HN ))
( segid "SUPF" and resid 72 and name HG2%)
4.400 2.400 1.600 peak 386 spectrum 1 weight 0.10000E+01 volume 0.77589E-03 ppm1 8.324 ppm2 1.192 CV 1
ASSI { 387}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 73 and name HA ))
2.100 0.600 0.600 peak 387 spectrum 1 weight 0.10000E+01 volume 0.95979E-02 ppm1 8.323 ppm2 3.969 CV 1
ASSI { 388}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 73 and name HG2 ))
3.000 1.100 1.100 peak 388 spectrum 1 weight 0.10000E+01 volume 0.25510E-02 ppm1 8.323 ppm2 2.318 CV 1
OR { 388}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 73 and name HG1 ))
ASSI { 390}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 74 and name HG2 ))
4.300 2.300 1.700 peak 390 spectrum 1 weight 0.10000E+01 volume 0.49058E-03 ppm1 8.323 ppm2 1.423 CV 1
OR { 390}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 74 and name HG1 ))
ASSI { 391}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HE21))
1.500 0.300 0.700 peak 391 spectrum 1 weight 0.10000E+01 volume 0.35302E-01 ppm1 6.745 ppm2 7.432 CV 1
ASSI { 394}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HB1 ))
3.000 1.100 1.100 peak 394 spectrum 1 weight 0.10000E+01 volume 0.49697E-02 ppm1 7.702 ppm2 1.631 CV 1
OR { 394}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HD1 ))
OR { 394}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HD2 ))
ASSI { 396}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 69 and name HB1 ))
3.500 1.500 1.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.10270E-02 ppm1 7.702 ppm2 2.492 CV 1
ASSI { 397}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 69 and name HB2 ))
3.000 1.100 1.100 peak 397 spectrum 1 weight 0.10000E+01 volume 0.18994E-02 ppm1 7.696 ppm2 3.105 CV 1
ASSI { 398}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 72 and name HN ))
3.800 1.800 1.800 peak 398 spectrum 1 weight 0.10000E+01 volume 0.66482E-03 ppm1 7.701 ppm2 8.117 CV 1
ASSI { 399}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 73 and name HN ))
2.700 0.900 0.900 peak 399 spectrum 1 weight 0.10000E+01 volume 0.26444E-02 ppm1 7.697 ppm2 8.317 CV 1
ASSI { 401}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 73 and name HA ))
2.900 1.100 1.100 peak 401 spectrum 1 weight 0.10000E+01 volume 0.21391E-02 ppm1 7.701 ppm2 3.970 CV 1
ASSI { 402}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HA ))
2.700 0.900 0.900 peak 402 spectrum 1 weight 0.10000E+01 volume 0.34310E-02 ppm1 7.700 ppm2 4.405 CV 1
ASSI { 403}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HB2 ))
2.700 0.900 0.900 peak 403 spectrum 1 weight 0.10000E+01 volume 0.23582E-02 ppm1 7.699 ppm2 1.814 CV 1
ASSI { 404}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HG2 ))
2.700 0.900 0.900 peak 404 spectrum 1 weight 0.10000E+01 volume 0.32528E-02 ppm1 7.702 ppm2 1.433 CV 1
OR { 404}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HG1 ))
ASSI { 405}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 74 and name HA ))
2.500 0.800 0.800 peak 405 spectrum 1 weight 0.10000E+01 volume 0.46532E-02 ppm1 8.678 ppm2 4.416 CV 1
ASSI { 406}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 74 and name HB1 ))
3.700 1.700 1.700 peak 406 spectrum 1 weight 0.10000E+01 volume 0.44441E-03 ppm1 8.679 ppm2 1.639 CV 1
ASSI { 407}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 74 and name HB2 ))
3.900 1.900 1.900 peak 407 spectrum 1 weight 0.10000E+01 volume 0.79776E-03 ppm1 8.680 ppm2 1.814 CV 1
ASSI { 408}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 75 and name HA ))
3.100 1.200 1.200 peak 408 spectrum 1 weight 0.10000E+01 volume 0.99184E-03 ppm1 8.683 ppm2 4.238 CV 1
ASSI { 409}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 75 and name HB1 ))
3.300 1.300 1.300 peak 409 spectrum 1 weight 0.10000E+01 volume 0.19397E-02 ppm1 8.679 ppm2 3.951 CV 1
ASSI { 410}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 75 and name HB2 ))
2.900 1.000 1.000 peak 410 spectrum 1 weight 0.10000E+01 volume 0.18742E-02 ppm1 8.680 ppm2 4.133 CV 1
ASSI { 411}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 77 and name HA2 ))
4.200 2.200 1.800 peak 411 spectrum 1 weight 0.10000E+01 volume 0.99714E-03 ppm1 9.068 ppm2 4.082 CV 1
ASSI { 413}
(( segid "SUPF" and resid 76 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.900 1.900 1.900 peak 413 spectrum 1 weight 0.10000E+01 volume 0.39848E-03 ppm1 9.077 ppm2 0.749 CV 1
ASSI { 414}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 68 and name HA ))
2.900 1.000 1.000 peak 414 spectrum 1 weight 0.10000E+01 volume 0.19140E-02 ppm1 9.076 ppm2 4.794 CV 1
ASSI { 415}
(( segid "SUPF" and resid 76 and name HN ))
( segid "SUPF" and resid 68 and name HG2%)
4.600 2.600 1.400 peak 415 spectrum 1 weight 0.10000E+01 volume 0.70921E-03 ppm1 9.080 ppm2 0.966 CV 1
ASSI { 416}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 75 and name HA ))
2.200 0.600 0.600 peak 416 spectrum 1 weight 0.10000E+01 volume 0.54544E-02 ppm1 9.075 ppm2 4.240 CV 1
ASSI { 417}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 75 and name HB1 ))
3.600 1.700 1.700 peak 417 spectrum 1 weight 0.10000E+01 volume 0.71156E-03 ppm1 9.071 ppm2 3.939 CV 1
ASSI { 418}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HA ))
3.200 1.300 1.300 peak 418 spectrum 1 weight 0.10000E+01 volume 0.11436E-02 ppm1 9.072 ppm2 4.522 CV 1
ASSI { 419}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HB1 ))
3.700 1.700 1.700 peak 419 spectrum 1 weight 0.10000E+01 volume 0.16614E-02 ppm1 9.078 ppm2 1.211 CV 1
ASSI { 420}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HB2 ))
3.000 1.100 1.100 peak 420 spectrum 1 weight 0.10000E+01 volume 0.89341E-03 ppm1 9.080 ppm2 2.213 CV 1
ASSI { 421}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HG1 ))
2.800 1.000 1.000 peak 421 spectrum 1 weight 0.10000E+01 volume 0.19737E-02 ppm1 9.071 ppm2 1.603 CV 1
OR { 421}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HG2 ))
ASSI { 422}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 77 and name HN ))
2.700 0.900 0.900 peak 422 spectrum 1 weight 0.10000E+01 volume 0.20322E-02 ppm1 9.076 ppm2 9.585 CV 1
ASSI { 423}
(( segid "SUPF" and resid 77 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
4.000 2.000 2.000 peak 423 spectrum 1 weight 0.10000E+01 volume 0.47501E-03 ppm1 9.578 ppm2 0.732 CV 1
ASSI { 424}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 75 and name HA ))
4.000 2.000 2.000 peak 424 spectrum 1 weight 0.10000E+01 volume 0.57295E-03 ppm1 9.588 ppm2 4.236 CV 1
ASSI { 426}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 76 and name HA ))
3.700 1.800 1.800 peak 426 spectrum 1 weight 0.10000E+01 volume 0.51361E-03 ppm1 9.589 ppm2 4.505 CV 1
ASSI { 427}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 77 and name HA1 ))
3.200 1.300 1.300 peak 427 spectrum 1 weight 0.10000E+01 volume 0.20557E-02 ppm1 9.584 ppm2 3.274 CV 1
ASSI { 428}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 77 and name HA2 ))
2.800 1.000 1.000 peak 428 spectrum 1 weight 0.10000E+01 volume 0.18926E-02 ppm1 9.585 ppm2 4.087 CV 1
ASSI { 429}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 78 and name HN ))
2.800 0.900 0.900 peak 429 spectrum 1 weight 0.10000E+01 volume 0.19484E-02 ppm1 9.582 ppm2 7.172 CV 1
ASSI { 430}
(( segid "SUPF" and resid 78 and name HN ))
( segid "SUPF" and resid 42 and name HD1%)
4.000 2.000 2.000 peak 430 spectrum 1 weight 0.10000E+01 volume 0.61247E-03 ppm1 7.173 ppm2 0.490 CV 1
ASSI { 431}
(( segid "SUPF" and resid 78 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.300 1.400 1.400 peak 431 spectrum 1 weight 0.10000E+01 volume 0.92564E-03 ppm1 7.171 ppm2 0.749 CV 1
ASSI { 432}
(( segid "SUPF" and resid 78 and name HN ))
(( segid "SUPF" and resid 76 and name HB1 ))
4.200 2.200 1.800 peak 432 spectrum 1 weight 0.10000E+01 volume 0.79679E-03 ppm1 7.170 ppm2 1.222 CV 1
ASSI { 434}
(( segid "SUPF" and resid 78 and name HN ))
(( segid "SUPF" and resid 77 and name HA1 ))
3.700 1.700 1.700 peak 434 spectrum 1 weight 0.10000E+01 volume 0.12949E-02 ppm1 7.170 ppm2 3.272 CV 1
ASSI { 435}
(( segid "SUPF" and resid 78 and name HN ))
(( segid "SUPF" and resid 77 and name HA2 ))
3.400 1.500 1.500 peak 435 spectrum 1 weight 0.10000E+01 volume 0.10812E-02 ppm1 7.172 ppm2 4.087 CV 1
ASSI { 436}
(( segid "SUPF" and resid 78 and name HN ))
(( segid "SUPF" and resid 78 and name HA ))
2.900 1.100 1.100 peak 436 spectrum 1 weight 0.10000E+01 volume 0.13058E-02 ppm1 7.171 ppm2 5.181 CV 1
ASSI { 437}
(( segid "SUPF" and resid 78 and name HN ))
( segid "SUPF" and resid 78 and name HD% )
3.300 1.400 1.400 peak 437 spectrum 1 weight 0.10000E+01 volume 0.10507E-02 ppm1 7.175 ppm2 6.725 CV 1
ASSI { 439}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 39 and name HB ))
2.900 1.100 1.100 peak 439 spectrum 1 weight 0.10000E+01 volume 0.12781E-02 ppm1 8.980 ppm2 1.570 CV 1
ASSI { 441}
(( segid "SUPF" and resid 79 and name HN ))
( segid "SUPF" and resid 42 and name HD1%)
2.900 1.100 1.100 peak 441 spectrum 1 weight 0.10000E+01 volume 0.13534E-02 ppm1 8.977 ppm2 0.484 CV 1
ASSI { 442}
(( segid "SUPF" and resid 79 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.900 1.900 1.900 peak 442 spectrum 1 weight 0.10000E+01 volume 0.64259E-03 ppm1 8.984 ppm2 0.758 CV 1
ASSI { 443}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 67 and name HN ))
4.500 2.500 1.500 peak 443 spectrum 1 weight 0.10000E+01 volume 0.56326E-03 ppm1 8.980 ppm2 8.703 CV 1
ASSI { 444}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 78 and name HN ))
4.100 2.100 1.900 peak 444 spectrum 1 weight 0.10000E+01 volume 0.55552E-03 ppm1 8.982 ppm2 7.178 CV 1
ASSI { 445}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 78 and name HA ))
2.400 0.700 0.700 peak 445 spectrum 1 weight 0.10000E+01 volume 0.40899E-02 ppm1 8.980 ppm2 5.172 CV 1
ASSI { 446}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 78 and name HB1 ))
3.700 1.800 1.800 peak 446 spectrum 1 weight 0.10000E+01 volume 0.22961E-02 ppm1 8.983 ppm2 2.933 CV 1
ASSI { 447}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 78 and name HB2 ))
2.800 1.000 1.000 peak 447 spectrum 1 weight 0.10000E+01 volume 0.14547E-02 ppm1 8.981 ppm2 3.215 CV 1
ASSI { 448}
(( segid "SUPF" and resid 79 and name HN ))
( segid "SUPF" and resid 78 and name HD% )
3.400 1.400 1.400 peak 448 spectrum 1 weight 0.10000E+01 volume 0.99641E-03 ppm1 8.977 ppm2 6.725 CV 1
ASSI { 449}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 79 and name HA1 ))
2.800 1.000 1.000 peak 449 spectrum 1 weight 0.10000E+01 volume 0.13437E-02 ppm1 8.978 ppm2 4.271 CV 1
ASSI { 450}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 79 and name HA2 ))
3.000 1.100 1.100 peak 450 spectrum 1 weight 0.10000E+01 volume 0.16358E-02 ppm1 8.981 ppm2 3.964 CV 1
ASSI { 452}
(( segid "SUPF" and resid 80 and name HN ))
( segid "SUPF" and resid 65 and name HG2%)
2.900 1.000 1.000 peak 452 spectrum 1 weight 0.10000E+01 volume 0.29568E-02 ppm1 8.725 ppm2 0.951 CV 1
ASSI { 453}
(( segid "SUPF" and resid 80 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
2.800 2.800 3.200 peak 453 spectrum 1 weight 0.10000E+01 volume 0.11767E-02 ppm1 8.726 ppm2 0.647 CV 1
ASSI { 454}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 79 and name HA1 ))
2.800 0.900 0.900 peak 454 spectrum 1 weight 0.10000E+01 volume 0.29829E-02 ppm1 8.724 ppm2 4.272 CV 1
ASSI { 455}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 79 and name HA2 ))
2.400 0.700 0.700 peak 455 spectrum 1 weight 0.10000E+01 volume 0.42349E-02 ppm1 8.724 ppm2 3.952 CV 1
ASSI { 456}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 80 and name HA ))
3.100 1.200 1.200 peak 456 spectrum 1 weight 0.10000E+01 volume 0.13143E-02 ppm1 8.725 ppm2 5.843 CV 1
ASSI { 457}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 80 and name HB1 ))
4.000 2.000 2.000 peak 457 spectrum 1 weight 0.10000E+01 volume 0.12172E-02 ppm1 8.725 ppm2 2.672 CV 1
ASSI { 458}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 80 and name HB2 ))
3.200 1.300 1.300 peak 458 spectrum 1 weight 0.10000E+01 volume 0.77517E-03 ppm1 8.724 ppm2 2.857 CV 1
ASSI { 459}
(( segid "SUPF" and resid 80 and name HN ))
( segid "SUPF" and resid 80 and name HD% )
3.300 1.400 1.400 peak 459 spectrum 1 weight 0.10000E+01 volume 0.10530E-02 ppm1 8.723 ppm2 7.170 CV 1
ASSI { 460}
(( segid "SUPF" and resid 81 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
4.700 2.700 1.300 peak 460 spectrum 1 weight 0.10000E+01 volume 0.47197E-03 ppm1 9.085 ppm2 1.320 CV 1
ASSI { 461}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 37 and name HA ))
4.000 2.000 2.000 peak 461 spectrum 1 weight 0.10000E+01 volume 0.49910E-03 ppm1 9.079 ppm2 4.249 CV 1
ASSI { 462}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 37 and name HB ))
3.500 1.500 1.500 peak 462 spectrum 1 weight 0.10000E+01 volume 0.76089E-03 ppm1 9.077 ppm2 1.779 CV 1
ASSI { 463}
(( segid "SUPF" and resid 81 and name HN ))
( segid "SUPF" and resid 39 and name HG2%)
3.000 1.200 1.200 peak 463 spectrum 1 weight 0.10000E+01 volume 0.17763E-02 ppm1 9.077 ppm2 0.701 CV 1
ASSI { 464}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 80 and name HA ))
2.300 0.600 0.600 peak 464 spectrum 1 weight 0.10000E+01 volume 0.73258E-02 ppm1 9.078 ppm2 5.841 CV 1
ASSI { 465}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 80 and name HB1 ))
3.100 1.200 1.200 peak 465 spectrum 1 weight 0.10000E+01 volume 0.11666E-02 ppm1 9.076 ppm2 2.673 CV 1
ASSI { 466}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 80 and name HB2 ))
3.900 1.900 1.900 peak 466 spectrum 1 weight 0.10000E+01 volume 0.15347E-02 ppm1 9.075 ppm2 2.861 CV 1
ASSI { 467}
(( segid "SUPF" and resid 81 and name HN ))
( segid "SUPF" and resid 80 and name HD% )
4.000 2.000 2.000 peak 467 spectrum 1 weight 0.10000E+01 volume 0.56306E-03 ppm1 9.082 ppm2 7.163 CV 1
ASSI { 468}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 81 and name HA ))
2.900 1.000 1.000 peak 468 spectrum 1 weight 0.10000E+01 volume 0.15313E-02 ppm1 9.079 ppm2 4.708 CV 1
ASSI { 469}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 81 and name HB ))
2.800 1.000 1.000 peak 469 spectrum 1 weight 0.10000E+01 volume 0.22426E-02 ppm1 9.080 ppm2 1.153 CV 1
ASSI { 470}
(( segid "SUPF" and resid 81 and name HN ))
( segid "SUPF" and resid 81 and name HG2%)
3.000 1.200 1.200 peak 470 spectrum 1 weight 0.10000E+01 volume 0.16209E-02 ppm1 9.079 ppm2 0.406 CV 1
ASSI { 475}
(( segid "SUPF" and resid 82 and name HN ))
(( segid "SUPF" and resid 63 and name HB2 ))
3.800 1.800 1.800 peak 475 spectrum 1 weight 0.10000E+01 volume 0.85637E-03 ppm1 9.517 ppm2 2.006 CV 1
OR { 475}
(( segid "SUPF" and resid 82 and name HN ))
(( segid "SUPF" and resid 63 and name HB1 ))
ASSI { 477}
(( segid "SUPF" and resid 82 and name HN ))
(( segid "SUPF" and resid 81 and name HA ))
2.200 0.600 0.600 peak 477 spectrum 1 weight 0.10000E+01 volume 0.56593E-02 ppm1 9.511 ppm2 4.705 CV 1
ASSI { 478}
(( segid "SUPF" and resid 82 and name HN ))
( segid "SUPF" and resid 81 and name HG1%)
2.800 1.000 1.000 peak 478 spectrum 1 weight 0.10000E+01 volume 0.26250E-02 ppm1 9.511 ppm2 0.570 CV 1
ASSI { 479}
(( segid "SUPF" and resid 82 and name HN ))
( segid "SUPF" and resid 81 and name HG2%)
4.300 2.300 1.700 peak 479 spectrum 1 weight 0.10000E+01 volume 0.10085E-02 ppm1 9.512 ppm2 0.394 CV 1
ASSI { 480}
(( segid "SUPF" and resid 82 and name HN ))
(( segid "SUPF" and resid 82 and name HB ))
2.700 0.900 0.900 peak 480 spectrum 1 weight 0.10000E+01 volume 0.21857E-02 ppm1 9.511 ppm2 3.935 CV 1
ASSI { 481}
(( segid "SUPF" and resid 82 and name HN ))
( segid "SUPF" and resid 82 and name HG2%)
3.900 1.900 1.900 peak 481 spectrum 1 weight 0.10000E+01 volume 0.11424E-02 ppm1 9.513 ppm2 1.160 CV 1
ASSI { 483}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 35 and name HA ))
3.500 1.500 1.500 peak 483 spectrum 1 weight 0.10000E+01 volume 0.86480E-03 ppm1 8.472 ppm2 4.394 CV 1
ASSI { 484}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 35 and name HB ))
2.700 0.900 0.900 peak 484 spectrum 1 weight 0.10000E+01 volume 0.24814E-02 ppm1 8.474 ppm2 4.534 CV 1
ASSI { 485}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 37 and name HN ))
4.200 2.200 1.800 peak 485 spectrum 1 weight 0.10000E+01 volume 0.45943E-03 ppm1 8.466 ppm2 9.917 CV 1
ASSI { 486}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 82 and name HB ))
4.300 2.300 1.700 peak 486 spectrum 1 weight 0.10000E+01 volume 0.44976E-03 ppm1 8.477 ppm2 3.945 CV 1
ASSI { 487}
(( segid "SUPF" and resid 83 and name HN ))
( segid "SUPF" and resid 82 and name HG2%)
3.100 1.200 1.200 peak 487 spectrum 1 weight 0.10000E+01 volume 0.25917E-02 ppm1 8.479 ppm2 1.148 CV 1
ASSI { 489}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 83 and name HB2 ))
2.700 0.900 0.900 peak 489 spectrum 1 weight 0.10000E+01 volume 0.22146E-02 ppm1 8.474 ppm2 1.987 CV 1
ASSI { 490}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 83 and name HG1 ))
3.800 1.800 1.800 peak 490 spectrum 1 weight 0.10000E+01 volume 0.10495E-02 ppm1 8.474 ppm2 2.249 CV 1
ASSI { 491}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 84 and name HA ))
3.700 3.700 2.300 peak 491 spectrum 1 weight 0.10000E+01 volume 0.87149E-03 ppm1 8.478 ppm2 4.110 CV 1
ASSI { 492}
(( segid "SUPF" and resid 83 and name HN ))
( segid "SUPF" and resid 89 and name HB% )
3.900 1.900 1.900 peak 492 spectrum 1 weight 0.10000E+01 volume 0.80631E-03 ppm1 8.475 ppm2 1.567 CV 1
ASSI { 494}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 62 and name HN ))
3.600 1.600 1.600 peak 494 spectrum 1 weight 0.10000E+01 volume 0.83848E-03 ppm1 8.352 ppm2 9.112 CV 1
ASSI { 495}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 83 and name HA ))
2.200 0.600 0.600 peak 495 spectrum 1 weight 0.10000E+01 volume 0.68632E-02 ppm1 8.356 ppm2 5.097 CV 1
ASSI { 496}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 83 and name HB1 ))
2.300 0.600 0.600 peak 496 spectrum 1 weight 0.10000E+01 volume 0.36767E-02 ppm1 8.354 ppm2 2.538 CV 1
ASSI { 497}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 83 and name HB2 ))
4.000 2.000 2.000 peak 497 spectrum 1 weight 0.10000E+01 volume 0.61350E-03 ppm1 8.358 ppm2 2.037 CV 1
ASSI { 498}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 83 and name HG1 ))
5.000 3.100 1.000 peak 498 spectrum 1 weight 0.10000E+01 volume 0.45766E-03 ppm1 8.358 ppm2 2.245 CV 1
ASSI { 499}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HA ))
2.400 0.700 0.700 peak 499 spectrum 1 weight 0.10000E+01 volume 0.54483E-02 ppm1 8.356 ppm2 4.110 CV 1
ASSI { 500}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HB1 ))
2.200 0.600 0.600 peak 500 spectrum 1 weight 0.10000E+01 volume 0.69620E-02 ppm1 8.356 ppm2 1.724 CV 1
ASSI { 501}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HB2 ))
3.000 1.100 1.100 peak 501 spectrum 1 weight 0.10000E+01 volume 0.46049E-02 ppm1 8.356 ppm2 1.904 CV 1
ASSI { 502}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HG1 ))
2.900 1.000 1.000 peak 502 spectrum 1 weight 0.10000E+01 volume 0.27125E-02 ppm1 8.356 ppm2 1.380 CV 1
OR { 502}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HG2 ))
ASSI { 505}
(( segid "SUPF" and resid 85 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
3.500 1.500 1.500 peak 505 spectrum 1 weight 0.10000E+01 volume 0.10150E-02 ppm1 7.708 ppm2 0.808 CV 1
ASSI { 509}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 83 and name HG1 ))
4.500 2.600 1.500 peak 509 spectrum 1 weight 0.10000E+01 volume 0.57278E-03 ppm1 7.706 ppm2 2.236 CV 1
ASSI { 510}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 84 and name HN ))
2.500 0.800 0.800 peak 510 spectrum 1 weight 0.10000E+01 volume 0.40028E-02 ppm1 7.706 ppm2 8.351 CV 1
ASSI { 511}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 84 and name HB2 ))
3.400 1.400 1.400 peak 511 spectrum 1 weight 0.10000E+01 volume 0.19286E-02 ppm1 7.708 ppm2 1.898 CV 1
ASSI { 512}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 84 and name HD1 ))
3.100 1.200 1.200 peak 512 spectrum 1 weight 0.10000E+01 volume 0.18440E-02 ppm1 7.705 ppm2 1.718 CV 1
OR { 512}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 84 and name HD2 ))
ASSI { 513}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 85 and name HA ))
2.800 1.000 1.000 peak 513 spectrum 1 weight 0.10000E+01 volume 0.28144E-02 ppm1 7.707 ppm2 4.886 CV 1
ASSI { 514}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 85 and name HB1 ))
3.500 1.500 1.500 peak 514 spectrum 1 weight 0.10000E+01 volume 0.75210E-03 ppm1 7.709 ppm2 2.981 CV 1
ASSI { 515}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 85 and name HB2 ))
3.300 1.400 1.400 peak 515 spectrum 1 weight 0.10000E+01 volume 0.14672E-02 ppm1 7.710 ppm2 2.739 CV 1
ASSI { 516}
(( segid "SUPF" and resid 86 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
3.500 1.500 1.500 peak 516 spectrum 1 weight 0.10000E+01 volume 0.91847E-03 ppm1 8.745 ppm2 0.801 CV 1
ASSI { 517}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 85 and name HA ))
2.600 0.900 0.900 peak 517 spectrum 1 weight 0.10000E+01 volume 0.37874E-02 ppm1 8.747 ppm2 4.905 CV 1
ASSI { 518}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 85 and name HB1 ))
3.100 1.200 1.200 peak 518 spectrum 1 weight 0.10000E+01 volume 0.21002E-02 ppm1 8.747 ppm2 2.985 CV 1
ASSI { 519}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 85 and name HB2 ))
3.400 1.500 1.500 peak 519 spectrum 1 weight 0.10000E+01 volume 0.11292E-02 ppm1 8.749 ppm2 2.752 CV 1
ASSI { 520}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 86 and name HA ))
3.000 1.100 1.100 peak 520 spectrum 1 weight 0.10000E+01 volume 0.18218E-02 ppm1 8.747 ppm2 4.026 CV 1
ASSI { 521}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 86 and name HB1 ))
2.700 0.900 0.900 peak 521 spectrum 1 weight 0.10000E+01 volume 0.31701E-02 ppm1 8.746 ppm2 1.865 CV 1
OR { 521}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 86 and name HB2 ))
ASSI { 523}
(( segid "SUPF" and resid 86 and name HN ))
( segid "SUPF" and resid 89 and name HB% )
4.600 2.700 1.400 peak 523 spectrum 1 weight 0.10000E+01 volume 0.47881E-03 ppm1 8.750 ppm2 1.574 CV 1
ASSI { 524}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HN ))
2.900 1.100 1.100 peak 524 spectrum 1 weight 0.10000E+01 volume 0.18023E-02 ppm1 8.656 ppm2 8.747 CV 1
ASSI { 525}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HA ))
3.300 1.400 1.400 peak 525 spectrum 1 weight 0.10000E+01 volume 0.12165E-02 ppm1 8.661 ppm2 4.046 CV 1
ASSI { 526}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HB1 ))
2.900 1.100 1.100 peak 526 spectrum 1 weight 0.10000E+01 volume 0.23662E-02 ppm1 8.661 ppm2 1.853 CV 1
OR { 526}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HB2 ))
ASSI { 527}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HD1 ))
2.900 2.900 3.100 peak 527 spectrum 1 weight 0.10000E+01 volume 0.92949E-03 ppm1 8.665 ppm2 2.983 CV 1
OR { 527}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HD2 ))
ASSI { 528}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 87 and name HA ))
2.800 1.000 1.000 peak 528 spectrum 1 weight 0.10000E+01 volume 0.32467E-02 ppm1 8.661 ppm2 4.230 CV 1
ASSI { 529}
(( segid "SUPF" and resid 87 and name HN ))
( segid "SUPF" and resid 87 and name HB% )
2.300 0.700 0.700 peak 529 spectrum 1 weight 0.10000E+01 volume 0.96383E-02 ppm1 8.660 ppm2 1.517 CV 1
ASSI { 530}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 88 and name HN ))
2.700 0.900 0.900 peak 530 spectrum 1 weight 0.10000E+01 volume 0.28928E-02 ppm1 8.660 ppm2 8.357 CV 1
ASSI { 535}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 87 and name HA ))
3.400 1.400 1.400 peak 535 spectrum 1 weight 0.10000E+01 volume 0.14146E-02 ppm1 8.358 ppm2 4.240 CV 1
ASSI { 536}
(( segid "SUPF" and resid 88 and name HN ))
( segid "SUPF" and resid 87 and name HB% )
2.400 0.700 0.700 peak 536 spectrum 1 weight 0.10000E+01 volume 0.62482E-02 ppm1 8.358 ppm2 1.523 CV 1
ASSI { 537}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 88 and name HA ))
2.800 1.000 1.000 peak 537 spectrum 1 weight 0.10000E+01 volume 0.27488E-02 ppm1 8.358 ppm2 4.326 CV 1
ASSI { 538}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 88 and name HB1 ))
3.300 1.400 1.400 peak 538 spectrum 1 weight 0.10000E+01 volume 0.24466E-02 ppm1 8.361 ppm2 3.868 CV 1
ASSI { 539}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 88 and name HB2 ))
2.400 0.700 0.700 peak 539 spectrum 1 weight 0.10000E+01 volume 0.38056E-02 ppm1 8.359 ppm2 4.047 CV 1
ASSI { 540}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 89 and name HN ))
2.600 0.800 0.800 peak 540 spectrum 1 weight 0.10000E+01 volume 0.36072E-02 ppm1 8.359 ppm2 7.538 CV 1
ASSI { 546}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 83 and name HB2 ))
3.500 1.600 1.600 peak 546 spectrum 1 weight 0.10000E+01 volume 0.59057E-03 ppm1 7.545 ppm2 1.993 CV 1
ASSI { 547}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 84 and name HG1 ))
3.400 3.400 2.600 peak 547 spectrum 1 weight 0.10000E+01 volume 0.41823E-03 ppm1 7.542 ppm2 1.382 CV 1
OR { 547}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 84 and name HG2 ))
ASSI { 548}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 85 and name HN ))
3.500 1.500 1.500 peak 548 spectrum 1 weight 0.10000E+01 volume 0.77300E-03 ppm1 7.539 ppm2 7.729 CV 1
ASSI { 550}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 88 and name HB1 ))
3.700 1.700 1.700 peak 550 spectrum 1 weight 0.10000E+01 volume 0.91443E-03 ppm1 7.540 ppm2 3.868 CV 1
ASSI { 551}
(( segid "SUPF" and resid 89 and name HN ))
( segid "SUPF" and resid 89 and name HB% )
2.300 0.700 0.700 peak 551 spectrum 1 weight 0.10000E+01 volume 0.67536E-02 ppm1 7.541 ppm2 1.547 CV 1
ASSI { 552}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 90 and name HN ))
2.600 0.800 0.800 peak 552 spectrum 1 weight 0.10000E+01 volume 0.35465E-02 ppm1 7.539 ppm2 8.538 CV 1
ASSI { 553}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 92 and name HN ))
3.700 1.700 1.700 peak 553 spectrum 1 weight 0.10000E+01 volume 0.77023E-03 ppm1 7.540 ppm2 7.892 CV 1
ASSI { 554}
(( segid "SUPF" and resid 52 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
4.000 2.000 2.000 peak 554 spectrum 1 weight 0.10000E+01 volume 0.11464E-02 ppm1 8.545 ppm2 1.108 CV 1
ASSI { 555}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 87 and name HA ))
3.200 1.300 1.300 peak 555 spectrum 1 weight 0.10000E+01 volume 0.14128E-02 ppm1 8.550 ppm2 4.220 CV 1
ASSI { 557}
(( segid "SUPF" and resid 90 and name HN ))
( segid "SUPF" and resid 89 and name HB% )
2.800 1.000 1.000 peak 557 spectrum 1 weight 0.10000E+01 volume 0.22191E-02 ppm1 8.549 ppm2 1.551 CV 1
ASSI { 559}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 90 and name HA ))
2.800 1.000 1.000 peak 559 spectrum 1 weight 0.10000E+01 volume 0.26690E-02 ppm1 8.552 ppm2 4.004 CV 1
ASSI { 560}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 90 and name HB2 ))
2.800 1.000 1.000 peak 560 spectrum 1 weight 0.10000E+01 volume 0.45224E-02 ppm1 8.549 ppm2 2.064 CV 1
ASSI { 561}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 90 and name HG2 ))
2.400 0.700 0.700 peak 561 spectrum 1 weight 0.10000E+01 volume 0.43596E-02 ppm1 8.549 ppm2 2.541 CV 1
ASSI { 562}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 91 and name HN ))
2.600 0.800 0.800 peak 562 spectrum 1 weight 0.10000E+01 volume 0.35699E-02 ppm1 8.548 ppm2 7.913 CV 1
ASSI { 564}
(( segid "SUPF" and resid 91 and name HN ))
( segid "SUPF" and resid 58 and name HD% )
4.700 2.800 1.300 peak 564 spectrum 1 weight 0.10000E+01 volume 0.48758E-03 ppm1 7.922 ppm2 7.359 CV 1
ASSI { 565}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 88 and name HN ))
3.700 1.700 1.700 peak 565 spectrum 1 weight 0.10000E+01 volume 0.71415E-03 ppm1 7.921 ppm2 8.360 CV 1
ASSI { 566}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 88 and name HA ))
3.200 1.300 1.300 peak 566 spectrum 1 weight 0.10000E+01 volume 0.13901E-02 ppm1 7.917 ppm2 4.313 CV 1
ASSI { 569}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 90 and name HG2 ))
3.600 1.600 1.600 peak 569 spectrum 1 weight 0.10000E+01 volume 0.79788E-03 ppm1 7.921 ppm2 2.533 CV 1
ASSI { 570}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 91 and name HB1 ))
2.700 0.900 0.900 peak 570 spectrum 1 weight 0.10000E+01 volume 0.34057E-02 ppm1 7.919 ppm2 2.342 CV 1
ASSI { 571}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 91 and name HB2 ))
2.100 0.600 0.600 peak 571 spectrum 1 weight 0.10000E+01 volume 0.96871E-02 ppm1 7.920 ppm2 2.061 CV 1
ASSI { 575}
(( segid "SUPF" and resid 92 and name HN ))
( segid "SUPF" and resid 37 and name HD1%)
4.100 2.100 1.900 peak 575 spectrum 1 weight 0.10000E+01 volume 0.53352E-03 ppm1 7.909 ppm2 0.688 CV 1
ASSI { 576}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 89 and name HA ))
3.100 1.200 1.200 peak 576 spectrum 1 weight 0.10000E+01 volume 0.11412E-02 ppm1 7.909 ppm2 4.102 CV 1
ASSI { 577}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 90 and name HN ))
3.800 1.800 1.800 peak 577 spectrum 1 weight 0.10000E+01 volume 0.63530E-03 ppm1 7.903 ppm2 8.541 CV 1
ASSI { 578}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 91 and name HA ))
3.200 1.300 1.300 peak 578 spectrum 1 weight 0.10000E+01 volume 0.15392E-02 ppm1 7.911 ppm2 3.968 CV 1
ASSI { 579}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 91 and name HB1 ))
2.800 1.000 1.000 peak 579 spectrum 1 weight 0.10000E+01 volume 0.19154E-02 ppm1 7.914 ppm2 2.323 CV 1
ASSI { 580}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 91 and name HG1 ))
3.500 1.500 1.500 peak 580 spectrum 1 weight 0.10000E+01 volume 0.20678E-02 ppm1 7.909 ppm2 1.742 CV 1
ASSI { 581}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 92 and name HA ))
2.600 0.900 0.900 peak 581 spectrum 1 weight 0.10000E+01 volume 0.41915E-02 ppm1 7.910 ppm2 2.033 CV 1
ASSI { 582}
(( segid "SUPF" and resid 92 and name HN ))
( segid "SUPF" and resid 92 and name HB% )
2.300 0.600 0.600 peak 582 spectrum 1 weight 0.10000E+01 volume 0.85595E-02 ppm1 7.909 ppm2 1.432 CV 1
ASSI { 583}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 93 and name HN ))
2.600 0.900 0.900 peak 583 spectrum 1 weight 0.10000E+01 volume 0.29984E-02 ppm1 7.912 ppm2 7.139 CV 1
ASSI { 585}
(( segid "SUPF" and resid 93 and name HN ))
( segid "SUPF" and resid 37 and name HD1%)
3.900 1.900 1.900 peak 585 spectrum 1 weight 0.10000E+01 volume 0.40610E-03 ppm1 7.142 ppm2 0.690 CV 1
ASSI { 586}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 90 and name HA ))
3.000 1.100 1.100 peak 586 spectrum 1 weight 0.10000E+01 volume 0.17456E-02 ppm1 7.145 ppm2 3.992 CV 1
ASSI { 588}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 92 and name HA ))
3.400 1.400 1.400 peak 588 spectrum 1 weight 0.10000E+01 volume 0.11861E-02 ppm1 7.139 ppm2 2.030 CV 1
ASSI { 589}
(( segid "SUPF" and resid 93 and name HN ))
( segid "SUPF" and resid 92 and name HB% )
2.900 1.100 1.100 peak 589 spectrum 1 weight 0.10000E+01 volume 0.23797E-02 ppm1 7.146 ppm2 1.424 CV 1
ASSI { 591}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 93 and name HB1 ))
3.000 1.200 1.200 peak 591 spectrum 1 weight 0.10000E+01 volume 0.19672E-02 ppm1 7.142 ppm2 3.059 CV 1
ASSI { 592}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 93 and name HB2 ))
2.600 0.800 0.800 peak 592 spectrum 1 weight 0.10000E+01 volume 0.34665E-02 ppm1 7.143 ppm2 2.798 CV 1
ASSI { 594}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 94 and name HB2 ))
4.800 2.900 1.200 peak 594 spectrum 1 weight 0.10000E+01 volume 0.44215E-03 ppm1 7.145 ppm2 1.867 CV 1
OR { 594}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 94 and name HB1 ))
ASSI { 595}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HB1 ))
3.200 1.300 1.300 peak 595 spectrum 1 weight 0.10000E+01 volume 0.23783E-02 ppm1 7.046 ppm2 1.791 CV 1
OR { 595}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HD1 ))
OR { 595}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HD2 ))
ASSI { 598}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 93 and name HN ))
2.400 0.700 0.700 peak 598 spectrum 1 weight 0.10000E+01 volume 0.55823E-02 ppm1 7.045 ppm2 7.150 CV 1
ASSI { 599}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 93 and name HA ))
3.300 1.400 1.400 peak 599 spectrum 1 weight 0.10000E+01 volume 0.11997E-02 ppm1 7.046 ppm2 4.291 CV 1
ASSI { 600}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 93 and name HB1 ))
4.000 2.000 2.000 peak 600 spectrum 1 weight 0.10000E+01 volume 0.39722E-03 ppm1 7.048 ppm2 3.035 CV 1
ASSI { 601}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 93 and name HB2 ))
4.000 2.000 2.000 peak 601 spectrum 1 weight 0.10000E+01 volume 0.77662E-03 ppm1 7.046 ppm2 2.805 CV 1
ASSI { 602}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HA ))
2.500 0.800 0.800 peak 602 spectrum 1 weight 0.10000E+01 volume 0.50441E-02 ppm1 7.045 ppm2 3.904 CV 1
ASSI { 603}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HB2 ))
2.100 0.600 0.600 peak 603 spectrum 1 weight 0.10000E+01 volume 0.93781E-02 ppm1 7.045 ppm2 1.877 CV 1
ASSI { 604}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HG2 ))
3.200 1.300 1.300 peak 604 spectrum 1 weight 0.10000E+01 volume 0.19878E-02 ppm1 7.045 ppm2 1.573 CV 1
OR { 604}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HG1 ))
ASSI { 605}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 95 and name HN ))
2.700 0.900 0.900 peak 605 spectrum 1 weight 0.10000E+01 volume 0.35441E-02 ppm1 7.044 ppm2 7.774 CV 1
ASSI { 608}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 94 and name HA ))
3.400 1.400 1.400 peak 608 spectrum 1 weight 0.10000E+01 volume 0.11388E-02 ppm1 7.773 ppm2 3.913 CV 1
ASSI { 609}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 94 and name HB1 ))
2.600 0.900 0.900 peak 609 spectrum 1 weight 0.10000E+01 volume 0.53299E-02 ppm1 7.776 ppm2 1.856 CV 1
OR { 609}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 94 and name HB2 ))
ASSI { 610}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 94 and name HG1 ))
4.000 2.000 2.000 peak 610 spectrum 1 weight 0.10000E+01 volume 0.75595E-03 ppm1 7.776 ppm2 1.573 CV 1
ASSI { 611}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 95 and name HA ))
2.900 1.000 1.000 peak 611 spectrum 1 weight 0.10000E+01 volume 0.23205E-02 ppm1 7.774 ppm2 5.143 CV 1
ASSI { 612}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 95 and name HB1 ))
3.000 1.100 1.100 peak 612 spectrum 1 weight 0.10000E+01 volume 0.47195E-02 ppm1 7.776 ppm2 2.499 CV 1
ASSI { 613}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 95 and name HB2 ))
2.400 0.700 0.700 peak 613 spectrum 1 weight 0.10000E+01 volume 0.56368E-02 ppm1 7.776 ppm2 2.825 CV 1
ASSI { 614}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 95 and name HA ))
4.200 2.200 1.800 peak 614 spectrum 1 weight 0.10000E+01 volume 0.60772E-03 ppm1 8.181 ppm2 5.142 CV 1
ASSI { 615}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 96 and name HD1 ))
3.700 1.700 1.700 peak 615 spectrum 1 weight 0.10000E+01 volume 0.20638E-02 ppm1 8.176 ppm2 3.987 CV 1
ASSI { 616}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 96 and name HD2 ))
3.300 1.400 1.400 peak 616 spectrum 1 weight 0.10000E+01 volume 0.75559E-03 ppm1 8.172 ppm2 4.117 CV 1
ASSI { 617}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 96 and name HG1 ))
2.900 1.000 1.000 peak 617 spectrum 1 weight 0.10000E+01 volume 0.25352E-02 ppm1 8.175 ppm2 2.081 CV 1
OR { 617}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 96 and name HG2 ))
ASSI { 618}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 97 and name HA ))
2.700 0.900 0.900 peak 618 spectrum 1 weight 0.10000E+01 volume 0.32324E-02 ppm1 8.178 ppm2 6.001 CV 1
ASSI { 619}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 97 and name HB1 ))
3.300 1.400 1.400 peak 619 spectrum 1 weight 0.10000E+01 volume 0.38383E-02 ppm1 8.178 ppm2 2.485 CV 1
ASSI { 620}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 97 and name HB2 ))
2.800 1.000 1.000 peak 620 spectrum 1 weight 0.10000E+01 volume 0.22962E-02 ppm1 8.178 ppm2 2.795 CV 1
ASSI { 621}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 97 and name HD21))
3.400 1.500 1.500 peak 621 spectrum 1 weight 0.10000E+01 volume 0.14938E-02 ppm1 8.177 ppm2 8.010 CV 1
ASSI { 622}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 98 and name HD1 ))
2.900 1.000 1.000 peak 622 spectrum 1 weight 0.10000E+01 volume 0.18000E-02 ppm1 8.176 ppm2 3.565 CV 1
ASSI { 623}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 98 and name HD2 ))
3.900 1.900 1.900 peak 623 spectrum 1 weight 0.10000E+01 volume 0.11128E-02 ppm1 8.177 ppm2 3.194 CV 1
ASSI { 624}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 107 and name HN ))
4.100 2.100 1.900 peak 624 spectrum 1 weight 0.10000E+01 volume 0.52398E-03 ppm1 8.174 ppm2 8.817 CV 1
ASSI { 625}
(( segid "SUPF" and resid 97 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
4.500 2.600 1.500 peak 625 spectrum 1 weight 0.10000E+01 volume 0.49727E-03 ppm1 8.176 ppm2 1.046 CV 1
OR { 625}
(( segid "SUPF" and resid 97 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 627}
(( segid "SUPF" and resid 97 and name HD21))
(( segid "SUPF" and resid 97 and name HA ))
2.500 0.800 0.800 peak 627 spectrum 1 weight 0.10000E+01 volume 0.29150E-02 ppm1 8.001 ppm2 5.995 CV 1
ASSI { 628}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 97 and name HA ))
4.200 2.200 1.800 peak 628 spectrum 1 weight 0.10000E+01 volume 0.15346E-02 ppm1 6.948 ppm2 5.998 CV 1
ASSI { 629}
(( segid "SUPF" and resid 97 and name HD21))
(( segid "SUPF" and resid 97 and name HB1 ))
2.900 1.100 1.100 peak 629 spectrum 1 weight 0.10000E+01 volume 0.15350E-02 ppm1 8.001 ppm2 2.494 CV 1
ASSI { 630}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 97 and name HB1 ))
4.200 2.200 1.800 peak 630 spectrum 1 weight 0.10000E+01 volume 0.74186E-03 ppm1 6.953 ppm2 2.470 CV 1
ASSI { 631}
(( segid "SUPF" and resid 97 and name HD21))
(( segid "SUPF" and resid 97 and name HB2 ))
3.300 1.400 1.400 peak 631 spectrum 1 weight 0.10000E+01 volume 0.19384E-02 ppm1 8.002 ppm2 2.769 CV 1
ASSI { 632}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 97 and name HB2 ))
4.000 2.000 2.000 peak 632 spectrum 1 weight 0.10000E+01 volume 0.11888E-02 ppm1 6.954 ppm2 2.760 CV 1
ASSI { 633}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 97 and name HD21))
1.700 0.400 0.500 peak 633 spectrum 1 weight 0.10000E+01 volume 0.17214E-01 ppm1 6.950 ppm2 7.996 CV 1
ASSI { 635}
(( segid "SUPF" and resid 97 and name HD21))
(( segid "SUPF" and resid 106 and name HA ))
2.900 1.000 1.000 peak 635 spectrum 1 weight 0.10000E+01 volume 0.18141E-02 ppm1 8.001 ppm2 5.489 CV 1
ASSI { 636}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 106 and name HA ))
3.800 1.800 1.800 peak 636 spectrum 1 weight 0.10000E+01 volume 0.11709E-02 ppm1 6.949 ppm2 5.491 CV 1
ASSI { 638}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 98 and name HA ))
2.200 0.600 0.600 peak 638 spectrum 1 weight 0.10000E+01 volume 0.98889E-02 ppm1 8.011 ppm2 4.448 CV 1
ASSI { 639}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 98 and name HB1 ))
3.700 1.700 1.700 peak 639 spectrum 1 weight 0.10000E+01 volume 0.16991E-02 ppm1 8.011 ppm2 2.127 CV 1
ASSI { 640}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 98 and name HG1 ))
4.300 2.300 1.700 peak 640 spectrum 1 weight 0.10000E+01 volume 0.75029E-03 ppm1 8.009 ppm2 1.960 CV 1
OR { 640}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 641}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 99 and name HA ))
2.800 1.000 1.000 peak 641 spectrum 1 weight 0.10000E+01 volume 0.22913E-02 ppm1 8.014 ppm2 4.282 CV 1
ASSI { 642}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 99 and name HB ))
2.400 0.700 0.700 peak 642 spectrum 1 weight 0.10000E+01 volume 0.62476E-02 ppm1 8.010 ppm2 1.787 CV 1
ASSI { 643}
(( segid "SUPF" and resid 99 and name HN ))
( segid "SUPF" and resid 99 and name HD1%)
3.900 1.900 1.900 peak 643 spectrum 1 weight 0.10000E+01 volume 0.10871E-02 ppm1 8.009 ppm2 0.742 CV 1
ASSI { 644}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 99 and name HG11))
3.500 1.600 1.600 peak 644 spectrum 1 weight 0.10000E+01 volume 0.37837E-02 ppm1 8.010 ppm2 1.486 CV 1
ASSI { 645}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 99 and name HG12))
2.700 0.900 0.900 peak 645 spectrum 1 weight 0.10000E+01 volume 0.23033E-02 ppm1 8.009 ppm2 1.122 CV 1
ASSI { 646}
(( segid "SUPF" and resid 99 and name HN ))
( segid "SUPF" and resid 99 and name HG2%)
4.000 2.000 2.000 peak 646 spectrum 1 weight 0.10000E+01 volume 0.13087E-02 ppm1 8.017 ppm2 0.565 CV 1
ASSI { 647}
(( segid "SUPF" and resid 100 and name HN ))
( segid "SUPF" and resid 99 and name HG2%)
3.100 1.200 1.200 peak 647 spectrum 1 weight 0.10000E+01 volume 0.25765E-02 ppm1 8.490 ppm2 0.571 CV 1
ASSI { 649}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 99 and name HA ))
2.100 0.600 0.600 peak 649 spectrum 1 weight 0.10000E+01 volume 0.87203E-02 ppm1 8.490 ppm2 4.280 CV 1
ASSI { 650}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 100 and name HA ))
3.000 1.100 1.100 peak 650 spectrum 1 weight 0.10000E+01 volume 0.14810E-02 ppm1 8.492 ppm2 3.800 CV 1
ASSI { 651}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 100 and name HB ))
2.600 0.800 0.800 peak 651 spectrum 1 weight 0.10000E+01 volume 0.31475E-02 ppm1 8.489 ppm2 1.270 CV 1
ASSI { 652}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 102 and name HN ))
3.600 1.600 1.600 peak 652 spectrum 1 weight 0.10000E+01 volume 0.73487E-03 ppm1 8.493 ppm2 8.020 CV 1
ASSI { 653}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 102 and name HA2 ))
3.700 1.700 1.700 peak 653 spectrum 1 weight 0.10000E+01 volume 0.11984E-02 ppm1 8.488 ppm2 4.138 CV 1
ASSI { 654}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 103 and name HN ))
3.100 1.200 1.200 peak 654 spectrum 1 weight 0.10000E+01 volume 0.13585E-02 ppm1 8.488 ppm2 7.734 CV 1
ASSI { 655}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 105 and name HN ))
3.500 1.500 1.500 peak 655 spectrum 1 weight 0.10000E+01 volume 0.88624E-03 ppm1 8.483 ppm2 8.854 CV 1
ASSI { 656}
(( segid "SUPF" and resid 101 and name HN ))
( segid "SUPF" and resid 50 and name HG2%)
3.700 1.700 1.700 peak 656 spectrum 1 weight 0.10000E+01 volume 0.83360E-03 ppm1 8.970 ppm2 1.293 CV 1
ASSI { 657}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 100 and name HN ))
4.500 2.500 1.500 peak 657 spectrum 1 weight 0.10000E+01 volume 0.42441E-03 ppm1 8.969 ppm2 8.504 CV 1
ASSI { 658}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 100 and name HA ))
2.200 0.600 0.600 peak 658 spectrum 1 weight 0.10000E+01 volume 0.83119E-02 ppm1 8.971 ppm2 3.790 CV 1
ASSI { 659}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 100 and name HG11))
5.000 3.100 1.000 peak 659 spectrum 1 weight 0.10000E+01 volume 0.49355E-03 ppm1 8.969 ppm2 0.775 CV 1
ASSI { 660}
(( segid "SUPF" and resid 101 and name HN ))
( segid "SUPF" and resid 100 and name HG2%)
2.800 1.000 1.000 peak 660 spectrum 1 weight 0.10000E+01 volume 0.25673E-02 ppm1 8.972 ppm2 0.461 CV 1
ASSI { 661}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 101 and name HA ))
2.200 0.600 0.600 peak 661 spectrum 1 weight 0.10000E+01 volume 0.85462E-02 ppm1 8.970 ppm2 4.245 CV 1
ASSI { 662}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 101 and name HB1 ))
3.600 1.600 1.600 peak 662 spectrum 1 weight 0.10000E+01 volume 0.12384E-02 ppm1 8.973 ppm2 2.196 CV 1
ASSI { 663}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 101 and name HB2 ))
3.400 1.400 1.400 peak 663 spectrum 1 weight 0.10000E+01 volume 0.93732E-03 ppm1 8.969 ppm2 2.982 CV 1
ASSI { 666}
(( segid "SUPF" and resid 102 and name HN ))
( segid "SUPF" and resid 99 and name HD1%)
5.200 3.400 0.800 peak 666 spectrum 1 weight 0.10000E+01 volume 0.46373E-03 ppm1 8.045 ppm2 0.730 CV 1
ASSI { 667}
(( segid "SUPF" and resid 102 and name HN ))
( segid "SUPF" and resid 99 and name HG2%)
2.600 0.900 0.900 peak 667 spectrum 1 weight 0.10000E+01 volume 0.39399E-02 ppm1 8.042 ppm2 0.567 CV 1
ASSI { 669}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 100 and name HA ))
3.300 1.300 1.300 peak 669 spectrum 1 weight 0.10000E+01 volume 0.14582E-02 ppm1 8.041 ppm2 3.789 CV 1
ASSI { 670}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 101 and name HN ))
2.900 1.000 1.000 peak 670 spectrum 1 weight 0.10000E+01 volume 0.19518E-02 ppm1 8.041 ppm2 8.973 CV 1
ASSI { 671}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 101 and name HA ))
2.800 1.000 1.000 peak 671 spectrum 1 weight 0.10000E+01 volume 0.34405E-02 ppm1 8.043 ppm2 4.245 CV 1
ASSI { 672}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 102 and name HA1 ))
2.800 1.000 1.000 peak 672 spectrum 1 weight 0.10000E+01 volume 0.54476E-02 ppm1 8.043 ppm2 3.467 CV 1
ASSI { 673}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 102 and name HA2 ))
2.500 0.800 0.800 peak 673 spectrum 1 weight 0.10000E+01 volume 0.38163E-02 ppm1 8.043 ppm2 4.119 CV 1
ASSI { 676}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 43 and name HG1 ))
4.300 2.300 1.700 peak 676 spectrum 1 weight 0.10000E+01 volume 0.36088E-03 ppm1 7.748 ppm2 1.959 CV 1
ASSI { 677}
(( segid "SUPF" and resid 103 and name HN ))
( segid "SUPF" and resid 99 and name HG2%)
2.900 1.000 1.000 peak 677 spectrum 1 weight 0.10000E+01 volume 0.30176E-02 ppm1 7.747 ppm2 0.568 CV 1
ASSI { 678}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 100 and name HA ))
4.100 2.100 1.900 peak 678 spectrum 1 weight 0.10000E+01 volume 0.49521E-03 ppm1 7.746 ppm2 3.791 CV 1
ASSI { 679}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 102 and name HN ))
2.700 0.900 0.900 peak 679 spectrum 1 weight 0.10000E+01 volume 0.28741E-02 ppm1 7.749 ppm2 8.030 CV 1
ASSI { 680}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 102 and name HA1 ))
3.500 1.500 1.500 peak 680 spectrum 1 weight 0.10000E+01 volume 0.93642E-03 ppm1 7.748 ppm2 3.482 CV 1
ASSI { 681}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 102 and name HA2 ))
3.600 1.600 1.600 peak 681 spectrum 1 weight 0.10000E+01 volume 0.96497E-03 ppm1 7.751 ppm2 4.116 CV 1
ASSI { 682}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 103 and name HA ))
2.700 0.900 0.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.32669E-02 ppm1 7.750 ppm2 4.660 CV 1
ASSI { 683}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 103 and name HB1 ))
2.600 0.800 0.800 peak 683 spectrum 1 weight 0.10000E+01 volume 0.37494E-02 ppm1 7.750 ppm2 1.826 CV 1
ASSI { 684}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 103 and name HB2 ))
2.600 0.900 0.900 peak 684 spectrum 1 weight 0.10000E+01 volume 0.42214E-02 ppm1 7.750 ppm2 1.636 CV 1
ASSI { 685}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 104 and name HN ))
3.400 1.500 1.500 peak 685 spectrum 1 weight 0.10000E+01 volume 0.23868E-02 ppm1 7.747 ppm2 8.477 CV 1
ASSI { 686}
(( segid "SUPF" and resid 104 and name HN ))
( segid "SUPF" and resid 99 and name HD1%)
4.200 2.200 1.800 peak 686 spectrum 1 weight 0.10000E+01 volume 0.46981E-03 ppm1 8.475 ppm2 0.717 CV 1
ASSI { 688}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HA ))
2.100 0.500 0.500 peak 688 spectrum 1 weight 0.10000E+01 volume 0.12130E-01 ppm1 8.470 ppm2 4.656 CV 1
ASSI { 689}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HB1 ))
3.400 1.500 1.500 peak 689 spectrum 1 weight 0.10000E+01 volume 0.14812E-02 ppm1 8.472 ppm2 1.834 CV 1
ASSI { 690}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HB2 ))
2.900 1.000 1.000 peak 690 spectrum 1 weight 0.10000E+01 volume 0.72102E-02 ppm1 8.472 ppm2 1.610 CV 1
ASSI { 691}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HD2 ))
3.300 1.400 1.400 peak 691 spectrum 1 weight 0.10000E+01 volume 0.12051E-02 ppm1 8.472 ppm2 3.133 CV 1
OR { 691}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HD1 ))
ASSI { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HB1 ))
2.400 0.700 0.700 peak 692 spectrum 1 weight 0.10000E+01 volume 0.66578E-02 ppm1 8.472 ppm2 1.678 CV 1
OR { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HB2 ))
OR { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HG1 ))
OR { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HG2 ))
OR { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HD2 ))
ASSI { 693}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HA ))
2.700 0.900 0.900 peak 693 spectrum 1 weight 0.10000E+01 volume 0.24621E-02 ppm1 8.472 ppm2 4.191 CV 1
ASSI { 694}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HG1 ))
4.000 2.000 2.000 peak 694 spectrum 1 weight 0.10000E+01 volume 0.13334E-02 ppm1 8.468 ppm2 1.342 CV 1
OR { 694}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HG2 ))
ASSI { 696}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HB2 ))
4.000 2.000 2.000 peak 696 spectrum 1 weight 0.10000E+01 volume 0.10670E-02 ppm1 8.840 ppm2 1.612 CV 1
ASSI { 697}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 99 and name HA ))
3.200 1.300 1.300 peak 697 spectrum 1 weight 0.10000E+01 volume 0.13025E-02 ppm1 8.845 ppm2 4.308 CV 1
ASSI { 698}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 41 and name HA1 ))
4.000 2.000 2.000 peak 698 spectrum 1 weight 0.10000E+01 volume 0.75854E-03 ppm1 8.840 ppm2 4.011 CV 1
ASSI { 699}
(( segid "SUPF" and resid 105 and name HN ))
( segid "SUPF" and resid 99 and name HD1%)
4.200 2.200 1.800 peak 699 spectrum 1 weight 0.10000E+01 volume 0.57091E-03 ppm1 8.840 ppm2 0.709 CV 1
ASSI { 701}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HN ))
3.900 1.900 1.900 peak 701 spectrum 1 weight 0.10000E+01 volume 0.12054E-02 ppm1 8.845 ppm2 8.475 CV 1
ASSI { 702}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HG1 ))
3.700 1.700 1.700 peak 702 spectrum 1 weight 0.10000E+01 volume 0.71722E-03 ppm1 8.838 ppm2 1.683 CV 1
OR { 702}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HG2 ))
OR { 702}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HB1 ))
OR { 702}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HB2 ))
ASSI { 703}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HA ))
2.100 0.600 0.600 peak 703 spectrum 1 weight 0.10000E+01 volume 0.95841E-02 ppm1 8.841 ppm2 4.174 CV 1
ASSI { 704}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 105 and name HA ))
3.000 1.100 1.100 peak 704 spectrum 1 weight 0.10000E+01 volume 0.16983E-02 ppm1 8.840 ppm2 4.692 CV 1
ASSI { 705}
(( segid "SUPF" and resid 105 and name HN ))
( segid "SUPF" and resid 105 and name HB% )
2.500 0.800 0.800 peak 705 spectrum 1 weight 0.10000E+01 volume 0.51547E-02 ppm1 8.841 ppm2 1.278 CV 1
ASSI { 707}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 39 and name HA ))
3.700 1.700 1.700 peak 707 spectrum 1 weight 0.10000E+01 volume 0.89064E-03 ppm1 8.214 ppm2 4.508 CV 1
ASSI { 710}
(( segid "SUPF" and resid 106 and name HN ))
( segid "SUPF" and resid 39 and name HG1%)
3.400 1.400 1.400 peak 710 spectrum 1 weight 0.10000E+01 volume 0.91395E-03 ppm1 8.210 ppm2 0.731 CV 1
ASSI { 711}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 40 and name HN ))
3.100 1.200 1.200 peak 711 spectrum 1 weight 0.10000E+01 volume 0.12507E-02 ppm1 8.211 ppm2 8.939 CV 1
ASSI { 712}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 40 and name HA1 ))
3.700 1.700 1.700 peak 712 spectrum 1 weight 0.10000E+01 volume 0.63295E-03 ppm1 8.212 ppm2 3.743 CV 1
ASSI { 713}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 105 and name HA ))
2.400 0.700 0.700 peak 713 spectrum 1 weight 0.10000E+01 volume 0.61820E-02 ppm1 8.211 ppm2 4.676 CV 1
ASSI { 714}
(( segid "SUPF" and resid 106 and name HN ))
( segid "SUPF" and resid 105 and name HB% )
2.400 0.700 0.700 peak 714 spectrum 1 weight 0.10000E+01 volume 0.77656E-02 ppm1 8.211 ppm2 1.278 CV 1
ASSI { 715}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 106 and name HA ))
2.900 1.100 1.100 peak 715 spectrum 1 weight 0.10000E+01 volume 0.18895E-02 ppm1 8.210 ppm2 5.495 CV 1
ASSI { 716}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 106 and name HB1 ))
3.100 1.200 1.200 peak 716 spectrum 1 weight 0.10000E+01 volume 0.26842E-02 ppm1 8.211 ppm2 2.542 CV 1
ASSI { 717}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 106 and name HB2 ))
2.900 1.100 1.100 peak 717 spectrum 1 weight 0.10000E+01 volume 0.18496E-02 ppm1 8.209 ppm2 2.701 CV 1
ASSI { 718}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 107 and name HN ))
3.900 1.900 1.900 peak 718 spectrum 1 weight 0.10000E+01 volume 0.79131E-03 ppm1 8.213 ppm2 8.801 CV 1
ASSI { 719}
(( segid "SUPF" and resid 106 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
4.100 2.100 1.900 peak 719 spectrum 1 weight 0.10000E+01 volume 0.82300E-03 ppm1 8.208 ppm2 1.081 CV 1
ASSI { 720}
(( segid "SUPF" and resid 106 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
3.700 1.700 1.700 peak 720 spectrum 1 weight 0.10000E+01 volume 0.66108E-03 ppm1 8.210 ppm2 1.015 CV 1
ASSI { 721}
(( segid "SUPF" and resid 106 and name HD21))
(( segid "SUPF" and resid 106 and name HB1 ))
3.200 1.200 1.200 peak 721 spectrum 1 weight 0.10000E+01 volume 0.11041E-02 ppm1 7.626 ppm2 2.529 CV 1
ASSI { 722}
(( segid "SUPF" and resid 106 and name HD21))
(( segid "SUPF" and resid 106 and name HB2 ))
3.300 1.400 1.400 peak 722 spectrum 1 weight 0.10000E+01 volume 0.10489E-02 ppm1 7.627 ppm2 2.702 CV 1
ASSI { 723}
(( segid "SUPF" and resid 106 and name HD22))
(( segid "SUPF" and resid 106 and name HB2 ))
4.400 2.500 1.600 peak 723 spectrum 1 weight 0.10000E+01 volume 0.62398E-03 ppm1 6.843 ppm2 2.711 CV 1
ASSI { 724}
(( segid "SUPF" and resid 106 and name HD22))
(( segid "SUPF" and resid 106 and name HD21))
1.700 0.400 0.500 peak 724 spectrum 1 weight 0.10000E+01 volume 0.22402E-01 ppm1 6.845 ppm2 7.622 CV 1
ASSI { 727}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 106 and name HB2 ))
4.000 2.000 2.000 peak 727 spectrum 1 weight 0.10000E+01 volume 0.12199E-02 ppm1 8.825 ppm2 2.720 CV 1
ASSI { 728}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 96 and name HA ))
3.400 1.400 1.400 peak 728 spectrum 1 weight 0.10000E+01 volume 0.81577E-03 ppm1 8.827 ppm2 4.690 CV 1
ASSI { 729}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 97 and name HA ))
3.900 1.900 1.900 peak 729 spectrum 1 weight 0.10000E+01 volume 0.54451E-03 ppm1 8.826 ppm2 5.993 CV 1
ASSI { 730}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 97 and name HD21))
4.100 2.100 1.900 peak 730 spectrum 1 weight 0.10000E+01 volume 0.47945E-03 ppm1 8.827 ppm2 7.994 CV 1
ASSI { 731}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 97 and name HD22))
3.300 3.300 2.700 peak 731 spectrum 1 weight 0.10000E+01 volume 0.45164E-03 ppm1 8.819 ppm2 6.937 CV 1
ASSI { 732}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 106 and name HA ))
2.200 0.600 0.600 peak 732 spectrum 1 weight 0.10000E+01 volume 0.78529E-02 ppm1 8.825 ppm2 5.490 CV 1
ASSI { 733}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 107 and name HA ))
3.000 1.100 1.100 peak 733 spectrum 1 weight 0.10000E+01 volume 0.13945E-02 ppm1 8.825 ppm2 5.334 CV 1
ASSI { 734}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 107 and name HB ))
2.700 0.900 0.900 peak 734 spectrum 1 weight 0.10000E+01 volume 0.27477E-02 ppm1 8.824 ppm2 2.035 CV 1
ASSI { 735}
(( segid "SUPF" and resid 107 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
2.800 0.900 0.900 peak 735 spectrum 1 weight 0.10000E+01 volume 0.29988E-02 ppm1 8.824 ppm2 1.042 CV 1
OR { 735}
(( segid "SUPF" and resid 107 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 736}
(( segid "SUPF" and resid 108 and name HN ))
( segid "SUPF" and resid 37 and name HG2%)
2.700 0.900 0.900 peak 736 spectrum 1 weight 0.10000E+01 volume 0.28706E-02 ppm1 8.790 ppm2 0.720 CV 1
ASSI { 737}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 38 and name HN ))
3.100 1.200 1.200 peak 737 spectrum 1 weight 0.10000E+01 volume 0.12524E-02 ppm1 8.790 ppm2 9.420 CV 1
ASSI { 738}
(( segid "SUPF" and resid 108 and name HN ))
( segid "SUPF" and resid 38 and name HD% )
3.500 1.500 1.500 peak 738 spectrum 1 weight 0.10000E+01 volume 0.79848E-03 ppm1 8.789 ppm2 6.982 CV 1
ASSI { 739}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 39 and name HA ))
3.600 1.700 1.700 peak 739 spectrum 1 weight 0.10000E+01 volume 0.99997E-03 ppm1 8.794 ppm2 4.520 CV 1
ASSI { 740}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 107 and name HA ))
2.100 0.600 0.600 peak 740 spectrum 1 weight 0.10000E+01 volume 0.97539E-02 ppm1 8.791 ppm2 5.357 CV 1
ASSI { 741}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 107 and name HB ))
4.000 2.000 2.000 peak 741 spectrum 1 weight 0.10000E+01 volume 0.81252E-03 ppm1 8.792 ppm2 2.023 CV 1
ASSI { 742}
(( segid "SUPF" and resid 108 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
2.900 1.000 1.000 peak 742 spectrum 1 weight 0.10000E+01 volume 0.30334E-02 ppm1 8.792 ppm2 1.054 CV 1
OR { 742}
(( segid "SUPF" and resid 108 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
ASSI { 743}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 108 and name HA ))
2.700 0.900 0.900 peak 743 spectrum 1 weight 0.10000E+01 volume 0.27052E-02 ppm1 8.793 ppm2 4.927 CV 1
ASSI { 744}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 108 and name HB1 ))
3.100 1.200 1.200 peak 744 spectrum 1 weight 0.10000E+01 volume 0.14500E-02 ppm1 8.793 ppm2 3.006 CV 1
ASSI { 745}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 108 and name HB2 ))
3.800 1.800 1.800 peak 745 spectrum 1 weight 0.10000E+01 volume 0.63217E-03 ppm1 8.797 ppm2 2.804 CV 1
ASSI { 748}
(( segid "SUPF" and resid 108 and name HD21))
(( segid "SUPF" and resid 108 and name HB1 ))
3.200 1.300 1.300 peak 748 spectrum 1 weight 0.10000E+01 volume 0.98521E-03 ppm1 7.064 ppm2 2.997 CV 1
ASSI { 749}
(( segid "SUPF" and resid 108 and name HD22))
(( segid "SUPF" and resid 108 and name HB1 ))
4.200 2.200 1.800 peak 749 spectrum 1 weight 0.10000E+01 volume 0.91763E-03 ppm1 6.975 ppm2 3.003 CV 1
ASSI { 750}
(( segid "SUPF" and resid 108 and name HD21))
(( segid "SUPF" and resid 108 and name HB2 ))
3.200 1.300 1.300 peak 750 spectrum 1 weight 0.10000E+01 volume 0.13137E-02 ppm1 7.065 ppm2 2.798 CV 1
ASSI { 751}
(( segid "SUPF" and resid 108 and name HD22))
(( segid "SUPF" and resid 108 and name HB2 ))
4.500 2.600 1.500 peak 751 spectrum 1 weight 0.10000E+01 volume 0.58504E-03 ppm1 6.975 ppm2 2.805 CV 1
ASSI { 752}
(( segid "SUPF" and resid 108 and name HD22))
( segid "SUPF" and resid 112 and name HD1%)
4.200 2.200 1.800 peak 752 spectrum 1 weight 0.10000E+01 volume 0.34211E-03 ppm1 6.974 ppm2 0.892 CV 1
ASSI { 754}
(( segid "SUPF" and resid 109 and name HN ))
( segid "SUPF" and resid 109 and name HD1%)
4.300 2.400 1.700 peak 754 spectrum 1 weight 0.10000E+01 volume 0.86902E-03 ppm1 9.232 ppm2 1.290 CV 1
ASSI { 756}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 108 and name HA ))
2.400 0.700 0.700 peak 756 spectrum 1 weight 0.10000E+01 volume 0.55017E-02 ppm1 9.232 ppm2 4.918 CV 1
ASSI { 757}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 108 and name HB1 ))
3.300 1.300 1.300 peak 757 spectrum 1 weight 0.10000E+01 volume 0.18904E-02 ppm1 9.231 ppm2 3.017 CV 1
ASSI { 758}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 108 and name HB2 ))
3.100 1.200 1.200 peak 758 spectrum 1 weight 0.10000E+01 volume 0.24089E-02 ppm1 9.232 ppm2 2.794 CV 1
ASSI { 759}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 108 and name HD21))
3.900 1.900 1.900 peak 759 spectrum 1 weight 0.10000E+01 volume 0.43314E-03 ppm1 9.228 ppm2 7.068 CV 1
ASSI { 760}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 109 and name HA ))
3.100 1.200 1.200 peak 760 spectrum 1 weight 0.10000E+01 volume 0.97479E-03 ppm1 9.231 ppm2 4.465 CV 1
ASSI { 761}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 109 and name HB1 ))
2.500 0.800 0.800 peak 761 spectrum 1 weight 0.10000E+01 volume 0.39216E-02 ppm1 9.231 ppm2 1.783 CV 1
OR { 761}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 109 and name HB2 ))
ASSI { 762}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 109 and name HG ))
2.400 0.700 0.700 peak 762 spectrum 1 weight 0.10000E+01 volume 0.40922E-02 ppm1 9.230 ppm2 2.029 CV 1
ASSI { 763}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 110 and name HA ))
3.300 1.400 1.400 peak 763 spectrum 1 weight 0.10000E+01 volume 0.93257E-03 ppm1 9.228 ppm2 4.171 CV 1
ASSI { 764}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 37 and name HA ))
2.900 1.100 1.100 peak 764 spectrum 1 weight 0.10000E+01 volume 0.14922E-02 ppm1 9.227 ppm2 4.264 CV 1
ASSI { 766}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 109 and name HA ))
2.400 0.700 0.700 peak 766 spectrum 1 weight 0.10000E+01 volume 0.37983E-02 ppm1 9.225 ppm2 4.466 CV 1
ASSI { 767}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 109 and name HB2 ))
3.300 1.400 1.400 peak 767 spectrum 1 weight 0.10000E+01 volume 0.10399E-02 ppm1 9.224 ppm2 1.794 CV 1
OR { 767}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 109 and name HB1 ))
ASSI { 768}
(( segid "SUPF" and resid 110 and name HN ))
( segid "SUPF" and resid 109 and name HD2%)
4.000 2.000 2.000 peak 768 spectrum 1 weight 0.10000E+01 volume 0.12440E-02 ppm1 9.225 ppm2 0.856 CV 1
ASSI { 769}
(( segid "SUPF" and resid 110 and name HN ))
( segid "SUPF" and resid 110 and name HB% )
2.600 0.800 0.800 peak 769 spectrum 1 weight 0.10000E+01 volume 0.36429E-02 ppm1 9.225 ppm2 1.490 CV 1
ASSI { 772}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 109 and name HB2 ))
3.200 1.300 1.300 peak 772 spectrum 1 weight 0.10000E+01 volume 0.98304E-03 ppm1 8.887 ppm2 1.795 CV 1
OR { 772}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 109 and name HB1 ))
ASSI { 773}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 110 and name HN ))
3.100 1.200 1.200 peak 773 spectrum 1 weight 0.10000E+01 volume 0.92479E-03 ppm1 8.890 ppm2 9.250 CV 1
ASSI { 774}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 110 and name HA ))
3.700 1.700 1.700 peak 774 spectrum 1 weight 0.10000E+01 volume 0.63199E-03 ppm1 8.886 ppm2 4.143 CV 1
ASSI { 775}
(( segid "SUPF" and resid 111 and name HN ))
( segid "SUPF" and resid 110 and name HB% )
2.900 1.100 1.100 peak 775 spectrum 1 weight 0.10000E+01 volume 0.21462E-02 ppm1 8.888 ppm2 1.497 CV 1
ASSI { 776}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 111 and name HA ))
2.900 1.000 1.000 peak 776 spectrum 1 weight 0.10000E+01 volume 0.26653E-02 ppm1 8.886 ppm2 4.446 CV 1
ASSI { 777}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 111 and name HB1 ))
2.500 0.800 0.800 peak 777 spectrum 1 weight 0.10000E+01 volume 0.29997E-02 ppm1 8.887 ppm2 2.852 CV 1
ASSI { 778}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 111 and name HB2 ))
3.900 1.900 1.900 peak 778 spectrum 1 weight 0.10000E+01 volume 0.17394E-02 ppm1 8.885 ppm2 3.182 CV 1
ASSI { 779}
(( segid "SUPF" and resid 111 and name HN ))
( segid "SUPF" and resid 111 and name HD% )
2.800 1.000 1.000 peak 779 spectrum 1 weight 0.10000E+01 volume 0.27903E-02 ppm1 8.886 ppm2 7.071 CV 1
ASSI { 780}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 111 and name HN ))
3.100 1.200 1.200 peak 780 spectrum 1 weight 0.10000E+01 volume 0.91510E-03 ppm1 7.147 ppm2 8.873 CV 1
ASSI { 781}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 111 and name HA ))
3.300 1.400 1.400 peak 781 spectrum 1 weight 0.10000E+01 volume 0.10306E-02 ppm1 7.146 ppm2 4.430 CV 1
ASSI { 782}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 112 and name HA ))
3.100 1.200 1.200 peak 782 spectrum 1 weight 0.10000E+01 volume 0.12449E-02 ppm1 7.151 ppm2 3.940 CV 1
ASSI { 783}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 112 and name HB1 ))
3.700 1.800 1.800 peak 783 spectrum 1 weight 0.10000E+01 volume 0.18669E-02 ppm1 7.147 ppm2 1.539 CV 1
ASSI { 784}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 112 and name HB2 ))
3.200 1.200 1.200 peak 784 spectrum 1 weight 0.10000E+01 volume 0.75216E-03 ppm1 7.146 ppm2 1.428 CV 1
ASSI { 785}
(( segid "SUPF" and resid 112 and name HN ))
( segid "SUPF" and resid 112 and name HD1%)
4.200 2.200 1.800 peak 785 spectrum 1 weight 0.10000E+01 volume 0.98304E-03 ppm1 7.143 ppm2 0.894 CV 1
ASSI { 786}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 112 and name HG ))
2.900 1.000 1.000 peak 786 spectrum 1 weight 0.10000E+01 volume 0.16495E-02 ppm1 7.141 ppm2 0.721 CV 1
ASSI { 788}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 110 and name HA ))
3.500 1.600 1.600 peak 788 spectrum 1 weight 0.10000E+01 volume 0.66217E-03 ppm1 7.467 ppm2 4.143 CV 1
ASSI { 789}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 112 and name HN ))
2.900 1.000 1.000 peak 789 spectrum 1 weight 0.10000E+01 volume 0.17376E-02 ppm1 7.472 ppm2 7.157 CV 1
ASSI { 790}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 112 and name HA ))
3.200 1.300 1.300 peak 790 spectrum 1 weight 0.10000E+01 volume 0.15134E-02 ppm1 7.472 ppm2 3.954 CV 1
ASSI { 791}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 112 and name HB1 ))
4.100 2.100 1.900 peak 791 spectrum 1 weight 0.10000E+01 volume 0.68765E-03 ppm1 7.469 ppm2 1.541 CV 1
ASSI { 792}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 112 and name HB2 ))
3.600 1.600 1.600 peak 792 spectrum 1 weight 0.10000E+01 volume 0.46531E-03 ppm1 7.474 ppm2 1.442 CV 1
ASSI { 793}
(( segid "SUPF" and resid 113 and name HN ))
( segid "SUPF" and resid 112 and name HD2%)
3.400 1.400 1.400 peak 793 spectrum 1 weight 0.10000E+01 volume 0.42475E-03 ppm1 7.463 ppm2 0.673 CV 1
ASSI { 794}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 113 and name HA1 ))
2.800 1.000 1.000 peak 794 spectrum 1 weight 0.10000E+01 volume 0.28706E-02 ppm1 7.472 ppm2 3.869 CV 1
ASSI { 795}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 113 and name HA2 ))
2.700 0.900 0.900 peak 795 spectrum 1 weight 0.10000E+01 volume 0.35480E-02 ppm1 7.471 ppm2 3.651 CV 1
ASSI { 797}
(( segid "SUPF" and resid 114 and name HN ))
(( segid "SUPF" and resid 113 and name HN ))
4.000 2.000 2.000 peak 797 spectrum 1 weight 0.10000E+01 volume 0.48423E-03 ppm1 7.959 ppm2 7.475 CV 1
ASSI { 798}
(( segid "SUPF" and resid 114 and name HN ))
(( segid "SUPF" and resid 113 and name HA2 ))
2.700 0.900 0.900 peak 798 spectrum 1 weight 0.10000E+01 volume 0.25383E-02 ppm1 7.955 ppm2 3.653 CV 1
ASSI { 799}
(( segid "SUPF" and resid 114 and name HN ))
( segid "SUPF" and resid 114 and name HB% )
2.700 0.900 0.900 peak 799 spectrum 1 weight 0.10000E+01 volume 0.34809E-02 ppm1 7.953 ppm2 1.166 CV 1
ASSI { 800}
(( segid "SUPF" and resid 114 and name HN ))
(( segid "SUPF" and resid 115 and name HN ))
4.300 2.300 1.700 peak 800 spectrum 1 weight 0.10000E+01 volume 0.63783E-03 ppm1 7.951 ppm2 7.666 CV 1
ASSI { 801}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 114 and name HA ))
2.600 0.800 0.800 peak 801 spectrum 1 weight 0.10000E+01 volume 0.40635E-02 ppm1 7.665 ppm2 3.841 CV 1
ASSI { 802}
(( segid "SUPF" and resid 115 and name HN ))
( segid "SUPF" and resid 114 and name HB% )
3.300 1.300 1.300 peak 802 spectrum 1 weight 0.10000E+01 volume 0.16809E-02 ppm1 7.668 ppm2 1.166 CV 1
ASSI { 803}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HA ))
3.000 1.100 1.100 peak 803 spectrum 1 weight 0.10000E+01 volume 0.17462E-02 ppm1 7.666 ppm2 4.462 CV 1
ASSI { 804}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HB1 ))
3.500 1.600 1.600 peak 804 spectrum 1 weight 0.10000E+01 volume 0.72716E-03 ppm1 7.671 ppm2 1.732 CV 1
ASSI { 805}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HB2 ))
3.100 1.200 1.200 peak 805 spectrum 1 weight 0.10000E+01 volume 0.18605E-02 ppm1 7.665 ppm2 1.571 CV 1
ASSI { 806}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HG2 ))
3.400 1.400 1.400 peak 806 spectrum 1 weight 0.10000E+01 volume 0.97112E-03 ppm1 7.667 ppm2 1.364 CV 1
OR { 806}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HG1 ))
ASSI { 808}
(( segid "SUPF" and resid 117 and name HN ))
(( segid "SUPF" and resid 116 and name HA ))
2.500 0.800 0.800 peak 808 spectrum 1 weight 0.10000E+01 volume 0.58018E-02 ppm1 8.509 ppm2 4.386 CV 1
ASSI { 809}
(( segid "SUPF" and resid 117 and name HN ))
(( segid "SUPF" and resid 117 and name HG2 ))
3.700 1.700 1.700 peak 809 spectrum 1 weight 0.10000E+01 volume 0.54446E-03 ppm1 8.510 ppm2 1.664 CV 1
OR { 809}
(( segid "SUPF" and resid 117 and name HN ))
(( segid "SUPF" and resid 117 and name HG1 ))
ASSI { 810}
(( segid "SUPF" and resid 118 and name HN ))
(( segid "SUPF" and resid 117 and name HA ))
3.100 1.200 1.200 peak 810 spectrum 1 weight 0.10000E+01 volume 0.15664E-02 ppm1 8.167 ppm2 4.366 CV 1
ASSI { 812}
(( segid "SUPF" and resid 119 and name HD22))
(( segid "SUPF" and resid 119 and name HD21))
1.800 0.400 0.400 peak 812 spectrum 1 weight 0.10000E+01 volume 0.16863E-01 ppm1 6.907 ppm2 7.606 CV 1
ASSI { 814}
(( segid "SUPF" and resid 120 and name HN ))
(( segid "SUPF" and resid 120 and name HA ))
3.600 1.600 1.600 peak 814 spectrum 1 weight 0.10000E+01 volume 0.70265E-03 ppm1 8.082 ppm2 4.136 CV 1
ASSI { 815}
(( segid "SUPF" and resid 120 and name HN ))
(( segid "SUPF" and resid 120 and name HB ))
3.400 1.400 1.400 peak 815 spectrum 1 weight 0.10000E+01 volume 0.98142E-03 ppm1 8.086 ppm2 2.117 CV 1
ASSI { 816}
(( segid "SUPF" and resid 120 and name HN ))
( segid "SUPF" and resid 120 and name HG2%)
3.500 1.500 1.500 peak 816 spectrum 1 weight 0.10000E+01 volume 0.94238E-03 ppm1 8.082 ppm2 0.919 CV 1
OR { 816}
(( segid "SUPF" and resid 120 and name HN ))
( segid "SUPF" and resid 120 and name HG1%)
ASSI { 817}
(( segid "SUPF" and resid 121 and name HE22))
(( segid "SUPF" and resid 121 and name HE21))
1.700 0.300 0.500 peak 817 spectrum 1 weight 0.10000E+01 volume 0.28395E-01 ppm1 6.816 ppm2 7.520 CV 1
!
!Unambiguous restraints
!
ASSI { 4}
( segid "SUPF" and resid 66 and name HG2%)
(( segid "SUPF" and resid 51 and name HB1 ))
3.400 1.400 1.400 peak 4 spectrum 1 weight 0.10000E+01 volume 0.10405E-02 ppm1 0.629 ppm2 1.737 CV 1
ASSI { 18}
(( segid "SUPF" and resid 33 and name HG1 ))
( segid "SUPF" and resid 111 and name HD% )
4.100 2.100 1.900 peak 18 spectrum 1 weight 0.10000E+01 volume 0.45752E-03 ppm1 1.539 ppm2 7.071 CV 1
ASSI { 25}
(( segid "SUPF" and resid 76 and name HA ))
(( segid "SUPF" and resid 76 and name HB1 ))
2.600 0.900 0.900 peak 25 spectrum 1 weight 0.10000E+01 volume 0.28543E-02 ppm1 4.514 ppm2 1.220 CV 1
ASSI { 29}
(( segid "SUPF" and resid 57 and name HA ))
(( segid "SUPF" and resid 57 and name HG2 ))
3.700 1.700 1.700 peak 29 spectrum 1 weight 0.10000E+01 volume 0.10597E-02 ppm1 4.079 ppm2 0.205 CV 1
ASSI { 30}
(( segid "SUPF" and resid 101 and name HA ))
( segid "SUPF" and resid 100 and name HG2%)
4.200 2.200 1.800 peak 30 spectrum 1 weight 0.10000E+01 volume 0.77643E-03 ppm1 4.244 ppm2 0.470 CV 1
ASSI { 37}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HB1 ))
3.300 1.400 1.400 peak 37 spectrum 1 weight 0.10000E+01 volume 0.28021E-02 ppm1 4.515 ppm2 1.691 CV 1
ASSI { 38}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HB2 ))
2.900 1.000 1.000 peak 38 spectrum 1 weight 0.10000E+01 volume 0.14449E-02 ppm1 4.519 ppm2 1.975 CV 1
ASSI { 40}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HD1 ))
3.400 1.400 1.400 peak 40 spectrum 1 weight 0.10000E+01 volume 0.15077E-02 ppm1 4.520 ppm2 1.397 CV 1
OR { 40}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HD2 ))
OR { 40}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 36 and name HG2 ))
ASSI { 42}
(( segid "SUPF" and resid 50 and name HB ))
( segid "SUPF" and resid 46 and name HG2%)
2.300 0.700 0.700 peak 42 spectrum 1 weight 0.10000E+01 volume 0.53638E-02 ppm1 4.450 ppm2 1.131 CV 1
ASSI { 44}
( segid "SUPF" and resid 72 and name HG2%)
(( segid "SUPF" and resid 69 and name HB1 ))
3.900 1.900 1.900 peak 44 spectrum 1 weight 0.10000E+01 volume 0.75782E-03 ppm1 1.189 ppm2 2.482 CV 1
ASSI { 46}
( segid "SUPF" and resid 72 and name HG2%)
(( segid "SUPF" and resid 69 and name HB2 ))
4.200 2.200 1.800 peak 46 spectrum 1 weight 0.10000E+01 volume 0.70536E-03 ppm1 1.195 ppm2 3.105 CV 1
ASSI { 51}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 48 and name HB1 ))
4.000 2.000 2.000 peak 51 spectrum 1 weight 0.10000E+01 volume 0.67138E-03 ppm1 0.960 ppm2 2.968 CV 1
OR { 51}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 48 and name HB1 ))
ASSI { 52}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 63 and name HG2 ))
2.900 1.000 1.000 peak 52 spectrum 1 weight 0.10000E+01 volume 0.27429E-02 ppm1 0.958 ppm2 2.052 CV 1
OR { 52}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 63 and name HG2 ))
OR { 52}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 63 and name HB1 ))
ASSI { 56}
(( segid "SUPF" and resid 86 and name HA ))
(( segid "SUPF" and resid 86 and name HG1 ))
2.900 1.100 1.100 peak 56 spectrum 1 weight 0.10000E+01 volume 0.20128E-02 ppm1 4.024 ppm2 1.778 CV 1
ASSI { 59}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HB1 ))
2.900 1.100 1.100 peak 59 spectrum 1 weight 0.10000E+01 volume 0.37991E-02 ppm1 4.184 ppm2 1.693 CV 1
OR { 59}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HD2 ))
OR { 59}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HD1 ))
ASSI { 61}
(( segid "SUPF" and resid 86 and name HA ))
( segid "SUPF" and resid 89 and name HB% )
2.500 0.800 0.800 peak 61 spectrum 1 weight 0.10000E+01 volume 0.48387E-02 ppm1 4.031 ppm2 1.552 CV 1
ASSI { 63}
(( segid "SUPF" and resid 39 and name HB ))
( segid "SUPF" and resid 42 and name HD1%)
2.900 1.000 1.000 peak 63 spectrum 1 weight 0.10000E+01 volume 0.16882E-02 ppm1 1.584 ppm2 0.499 CV 1
ASSI { 66}
(( segid "SUPF" and resid 84 and name HB2 ))
(( segid "SUPF" and resid 60 and name HB2 ))
3.500 3.500 2.500 peak 66 spectrum 1 weight 0.10000E+01 volume 0.13469E-02 ppm1 1.902 ppm2 2.604 CV 1
ASSI { 68}
(( segid "SUPF" and resid 84 and name HB1 ))
(( segid "SUPF" and resid 60 and name HB2 ))
2.800 1.000 1.000 peak 68 spectrum 1 weight 0.10000E+01 volume 0.20316E-02 ppm1 1.733 ppm2 2.602 CV 1
ASSI { 74}
(( segid "SUPF" and resid 103 and name HB1 ))
(( segid "SUPF" and resid 43 and name HD1 ))
2.800 1.000 1.000 peak 74 spectrum 1 weight 0.10000E+01 volume 0.11452E-02 ppm1 1.828 ppm2 3.610 CV 1
ASSI { 75}
(( segid "SUPF" and resid 104 and name HB1 ))
(( segid "SUPF" and resid 104 and name HA ))
2.800 1.000 1.000 peak 75 spectrum 1 weight 0.10000E+01 volume 0.38454E-02 ppm1 1.697 ppm2 4.186 CV 1
ASSI { 76}
(( segid "SUPF" and resid 104 and name HB2 ))
(( segid "SUPF" and resid 104 and name HA ))
2.400 0.700 0.700 peak 76 spectrum 1 weight 0.10000E+01 volume 0.45076E-02 ppm1 1.598 ppm2 4.185 CV 1
ASSI { 77}
(( segid "SUPF" and resid 76 and name HB2 ))
(( segid "SUPF" and resid 76 and name HB1 ))
2.000 0.500 0.500 peak 77 spectrum 1 weight 0.10000E+01 volume 0.56993E-02 ppm1 2.217 ppm2 1.222 CV 1
ASSI { 81}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 61 and name HA ))
3.600 1.600 1.600 peak 81 spectrum 1 weight 0.10000E+01 volume 0.16223E-02 ppm1 0.590 ppm2 4.161 CV 1
ASSI { 82}
( segid "SUPF" and resid 109 and name HD2%)
(( segid "SUPF" and resid 37 and name HA ))
3.100 1.200 1.200 peak 82 spectrum 1 weight 0.10000E+01 volume 0.29197E-02 ppm1 0.851 ppm2 4.255 CV 1
ASSI { 83}
( segid "SUPF" and resid 50 and name HG2%)
(( segid "SUPF" and resid 50 and name HB ))
2.100 0.500 0.500 peak 83 spectrum 1 weight 0.10000E+01 volume 0.12957E-01 ppm1 1.288 ppm2 4.452 CV 1
ASSI { 85}
( segid "SUPF" and resid 32 and name HG2%)
(( segid "SUPF" and resid 32 and name HB ))
2.200 0.600 0.600 peak 85 spectrum 1 weight 0.10000E+01 volume 0.11495E-01 ppm1 1.092 ppm2 4.514 CV 1
ASSI { 89}
(( segid "SUPF" and resid 90 and name HB1 ))
(( segid "SUPF" and resid 90 and name HA ))
2.500 0.800 0.800 peak 89 spectrum 1 weight 0.10000E+01 volume 0.44555E-02 ppm1 2.220 ppm2 3.998 CV 1
ASSI { 90}
(( segid "SUPF" and resid 90 and name HB2 ))
(( segid "SUPF" and resid 87 and name HA ))
3.300 1.400 1.400 peak 90 spectrum 1 weight 0.10000E+01 volume 0.22987E-02 ppm1 2.080 ppm2 4.228 CV 1
ASSI { 94}
(( segid "SUPF" and resid 43 and name HG1 ))
(( segid "SUPF" and resid 43 and name HD2 ))
3.100 1.200 1.200 peak 94 spectrum 1 weight 0.10000E+01 volume 0.23483E-02 ppm1 1.932 ppm2 3.826 CV 1
ASSI { 95}
(( segid "SUPF" and resid 43 and name HG2 ))
(( segid "SUPF" and resid 43 and name HD2 ))
2.600 0.800 0.800 peak 95 spectrum 1 weight 0.10000E+01 volume 0.20749E-02 ppm1 1.818 ppm2 3.827 CV 1
ASSI { 100}
( segid "SUPF" and resid 51 and name HD2%)
(( segid "SUPF" and resid 48 and name HA ))
3.200 1.300 1.300 peak 100 spectrum 1 weight 0.10000E+01 volume 0.17688E-02 ppm1 0.649 ppm2 4.012 CV 1
ASSI { 102}
(( segid "SUPF" and resid 100 and name HG11))
(( segid "SUPF" and resid 100 and name HA ))
3.000 1.100 1.100 peak 102 spectrum 1 weight 0.10000E+01 volume 0.21532E-02 ppm1 0.785 ppm2 3.789 CV 1
ASSI { 104}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 35 and name HB ))
2.200 0.600 0.600 peak 104 spectrum 1 weight 0.10000E+01 volume 0.12307E-01 ppm1 0.804 ppm2 4.528 CV 1
ASSI { 106}
( segid "SUPF" and resid 32 and name HG2%)
(( segid "SUPF" and resid 32 and name HA ))
2.300 0.600 0.600 peak 106 spectrum 1 weight 0.10000E+01 volume 0.10595E-01 ppm1 1.086 ppm2 4.594 CV 1
ASSI { 107}
( segid "SUPF" and resid 82 and name HG2%)
(( segid "SUPF" and resid 36 and name HA ))
2.800 1.000 1.000 peak 107 spectrum 1 weight 0.10000E+01 volume 0.38394E-02 ppm1 1.159 ppm2 5.017 CV 1
ASSI { 108}
( segid "SUPF" and resid 82 and name HG2%)
(( segid "SUPF" and resid 82 and name HA ))
2.300 0.700 0.700 peak 108 spectrum 1 weight 0.10000E+01 volume 0.74981E-02 ppm1 1.155 ppm2 5.096 CV 1
ASSI { 109}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 109 and name HA ))
3.100 1.200 1.200 peak 109 spectrum 1 weight 0.10000E+01 volume 0.13775E-02 ppm1 0.725 ppm2 4.472 CV 1
ASSI { 110}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 37 and name HB ))
2.300 0.700 0.700 peak 110 spectrum 1 weight 0.10000E+01 volume 0.65380E-02 ppm1 0.722 ppm2 1.786 CV 1
ASSI { 111}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 37 and name HG11))
3.400 1.500 1.500 peak 111 spectrum 1 weight 0.10000E+01 volume 0.26801E-02 ppm1 0.722 ppm2 1.639 CV 1
ASSI { 115}
( segid "SUPF" and resid 89 and name HB% )
( segid "SUPF" and resid 37 and name HD1%)
2.600 0.800 0.800 peak 115 spectrum 1 weight 0.10000E+01 volume 0.52794E-02 ppm1 1.554 ppm2 0.683 CV 1
OR { 115}
( segid "SUPF" and resid 89 and name HB% )
( segid "SUPF" and resid 37 and name HG2%)
ASSI { 118}
( segid "SUPF" and resid 66 and name HG2%)
(( segid "SUPF" and resid 47 and name HA ))
2.500 0.800 0.800 peak 118 spectrum 1 weight 0.10000E+01 volume 0.51613E-02 ppm1 0.633 ppm2 4.862 CV 1
ASSI { 119}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 106 and name HA ))
3.800 1.800 1.800 peak 119 spectrum 1 weight 0.10000E+01 volume 0.13434E-02 ppm1 1.052 ppm2 5.497 CV 1
OR { 119}
( segid "SUPF" and resid 107 and name HG1%)
(( segid "SUPF" and resid 106 and name HA ))
ASSI { 121}
(( segid "SUPF" and resid 76 and name HD2 ))
(( segid "SUPF" and resid 76 and name HB2 ))
3.000 1.100 1.100 peak 121 spectrum 1 weight 0.10000E+01 volume 0.16784E-02 ppm1 3.240 ppm2 2.211 CV 1
ASSI { 122}
(( segid "SUPF" and resid 80 and name HB2 ))
(( segid "SUPF" and resid 36 and name HG2 ))
4.300 2.300 1.700 peak 122 spectrum 1 weight 0.10000E+01 volume 0.12045E-02 ppm1 2.874 ppm2 1.394 CV 1
OR { 122}
(( segid "SUPF" and resid 80 and name HB2 ))
(( segid "SUPF" and resid 36 and name HD1 ))
OR { 122}
(( segid "SUPF" and resid 80 and name HB2 ))
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 133}
(( segid "SUPF" and resid 60 and name HB1 ))
(( segid "SUPF" and resid 84 and name HD2 ))
2.500 0.800 0.800 peak 133 spectrum 1 weight 0.10000E+01 volume 0.49723E-02 ppm1 2.566 ppm2 1.721 CV 1
OR { 133}
(( segid "SUPF" and resid 60 and name HB1 ))
(( segid "SUPF" and resid 84 and name HB1 ))
OR { 133}
(( segid "SUPF" and resid 60 and name HB2 ))
(( segid "SUPF" and resid 84 and name HB1 ))
OR { 133}
(( segid "SUPF" and resid 60 and name HB2 ))
(( segid "SUPF" and resid 84 and name HD2 ))
OR { 133}
(( segid "SUPF" and resid 60 and name HB1 ))
(( segid "SUPF" and resid 84 and name HD1 ))
OR { 133}
(( segid "SUPF" and resid 60 and name HB2 ))
(( segid "SUPF" and resid 84 and name HD1 ))
ASSI { 135}
(( segid "SUPF" and resid 97 and name HB2 ))
(( segid "SUPF" and resid 104 and name HD1 ))
3.700 1.700 1.700 peak 135 spectrum 1 weight 0.10000E+01 volume 0.19794E-02 ppm1 2.788 ppm2 1.677 CV 1
OR { 135}
(( segid "SUPF" and resid 97 and name HB2 ))
(( segid "SUPF" and resid 104 and name HD2 ))
OR { 135}
(( segid "SUPF" and resid 97 and name HB2 ))
(( segid "SUPF" and resid 104 and name HB1 ))
ASSI { 137}
(( segid "SUPF" and resid 35 and name HA ))
( segid "SUPF" and resid 89 and name HB% )
2.300 0.600 0.600 peak 137 spectrum 1 weight 0.10000E+01 volume 0.80017E-02 ppm1 4.399 ppm2 1.552 CV 1
ASSI { 140}
(( segid "SUPF" and resid 43 and name HA ))
(( segid "SUPF" and resid 43 and name HB1 ))
2.300 0.600 0.600 peak 140 spectrum 1 weight 0.10000E+01 volume 0.63199E-02 ppm1 4.380 ppm2 2.055 CV 1
ASSI { 144}
(( segid "SUPF" and resid 26 and name HA ))
( segid "SUPF" and resid 26 and name HB% )
2.800 1.000 1.000 peak 144 spectrum 1 weight 0.10000E+01 volume 0.30612E-02 ppm1 4.357 ppm2 1.407 CV 1
ASSI { 150}
(( segid "SUPF" and resid 29 and name HA ))
(( segid "SUPF" and resid 29 and name HB1 ))
2.800 1.000 1.000 peak 150 spectrum 1 weight 0.10000E+01 volume 0.39604E-02 ppm1 4.434 ppm2 3.899 CV 1
ASSI { 151}
(( segid "SUPF" and resid 29 and name HA ))
(( segid "SUPF" and resid 29 and name HB2 ))
2.700 0.900 0.900 peak 151 spectrum 1 weight 0.10000E+01 volume 0.33197E-02 ppm1 4.428 ppm2 3.859 CV 1
ASSI { 152}
(( segid "SUPF" and resid 29 and name HB2 ))
(( segid "SUPF" and resid 29 and name HA ))
2.300 0.700 0.700 peak 152 spectrum 1 weight 0.10000E+01 volume 0.94281E-02 ppm1 3.884 ppm2 4.431 CV 1
OR { 152}
(( segid "SUPF" and resid 29 and name HB1 ))
(( segid "SUPF" and resid 29 and name HA ))
ASSI { 153}
(( segid "SUPF" and resid 30 and name HA ))
(( segid "SUPF" and resid 30 and name HB1 ))
2.500 0.800 0.800 peak 153 spectrum 1 weight 0.10000E+01 volume 0.49475E-02 ppm1 4.314 ppm2 1.876 CV 1
ASSI { 154}
(( segid "SUPF" and resid 30 and name HA ))
(( segid "SUPF" and resid 30 and name HB2 ))
2.600 0.800 0.800 peak 154 spectrum 1 weight 0.10000E+01 volume 0.44266E-02 ppm1 4.322 ppm2 1.792 CV 1
ASSI { 155}
(( segid "SUPF" and resid 30 and name HA ))
(( segid "SUPF" and resid 30 and name HD1 ))
3.700 1.700 1.700 peak 155 spectrum 1 weight 0.10000E+01 volume 0.16723E-02 ppm1 4.322 ppm2 3.200 CV 1
OR { 155}
(( segid "SUPF" and resid 30 and name HA ))
(( segid "SUPF" and resid 30 and name HD2 ))
ASSI { 157}
(( segid "SUPF" and resid 30 and name HB1 ))
(( segid "SUPF" and resid 30 and name HD1 ))
2.500 0.800 0.800 peak 157 spectrum 1 weight 0.10000E+01 volume 0.58826E-02 ppm1 1.851 ppm2 3.197 CV 1
OR { 157}
(( segid "SUPF" and resid 30 and name HB1 ))
(( segid "SUPF" and resid 30 and name HD2 ))
ASSI { 159}
(( segid "SUPF" and resid 30 and name HB2 ))
(( segid "SUPF" and resid 30 and name HD1 ))
2.600 0.900 0.900 peak 159 spectrum 1 weight 0.10000E+01 volume 0.53113E-02 ppm1 1.805 ppm2 3.195 CV 1
OR { 159}
(( segid "SUPF" and resid 30 and name HB2 ))
(( segid "SUPF" and resid 30 and name HD2 ))
ASSI { 160}
(( segid "SUPF" and resid 31 and name HA ))
(( segid "SUPF" and resid 31 and name HB1 ))
2.500 0.800 0.800 peak 160 spectrum 1 weight 0.10000E+01 volume 0.58769E-02 ppm1 4.633 ppm2 2.661 CV 1
ASSI { 161}
(( segid "SUPF" and resid 31 and name HA ))
(( segid "SUPF" and resid 31 and name HB2 ))
2.700 0.900 0.900 peak 161 spectrum 1 weight 0.10000E+01 volume 0.47682E-02 ppm1 4.633 ppm2 2.795 CV 1
ASSI { 163}
(( segid "SUPF" and resid 31 and name HB1 ))
(( segid "SUPF" and resid 31 and name HB2 ))
1.700 0.400 0.500 peak 163 spectrum 1 weight 0.10000E+01 volume 0.24787E-01 ppm1 2.662 ppm2 2.792 CV 1
ASSI { 168}
(( segid "SUPF" and resid 32 and name HB ))
(( segid "SUPF" and resid 32 and name HA ))
2.400 0.700 0.700 peak 168 spectrum 1 weight 0.10000E+01 volume 0.60928E-02 ppm1 4.514 ppm2 4.597 CV 1
ASSI { 170}
(( segid "SUPF" and resid 33 and name HA ))
(( segid "SUPF" and resid 33 and name HB1 ))
3.200 1.300 1.300 peak 170 spectrum 1 weight 0.10000E+01 volume 0.18469E-02 ppm1 3.861 ppm2 1.403 CV 1
ASSI { 171}
(( segid "SUPF" and resid 33 and name HA ))
(( segid "SUPF" and resid 111 and name HB1 ))
3.600 1.600 1.600 peak 171 spectrum 1 weight 0.10000E+01 volume 0.58973E-03 ppm1 3.871 ppm2 2.858 CV 1
ASSI { 172}
(( segid "SUPF" and resid 33 and name HA ))
( segid "SUPF" and resid 111 and name HD% )
4.100 2.100 1.900 peak 172 spectrum 1 weight 0.10000E+01 volume 0.51194E-03 ppm1 3.861 ppm2 7.071 CV 1
ASSI { 174}
(( segid "SUPF" and resid 33 and name HB1 ))
(( segid "SUPF" and resid 33 and name HB2 ))
1.900 0.400 0.400 peak 174 spectrum 1 weight 0.10000E+01 volume 0.97280E-02 ppm1 1.398 ppm2 1.819 CV 1
ASSI { 175}
(( segid "SUPF" and resid 33 and name HB1 ))
( segid "SUPF" and resid 34 and name HD% )
3.400 1.400 1.400 peak 175 spectrum 1 weight 0.10000E+01 volume 0.86787E-03 ppm1 1.397 ppm2 7.199 CV 1
ASSI { 176}
(( segid "SUPF" and resid 33 and name HB2 ))
(( segid "SUPF" and resid 33 and name HA ))
2.600 0.900 0.900 peak 176 spectrum 1 weight 0.10000E+01 volume 0.36470E-02 ppm1 1.822 ppm2 3.861 CV 1
ASSI { 177}
(( segid "SUPF" and resid 33 and name HB2 ))
( segid "SUPF" and resid 34 and name HD% )
4.000 2.000 2.000 peak 177 spectrum 1 weight 0.10000E+01 volume 0.71542E-03 ppm1 1.824 ppm2 7.201 CV 1
ASSI { 178}
( segid "SUPF" and resid 33 and name HE% )
( segid "SUPF" and resid 34 and name HD% )
3.400 1.400 1.400 peak 178 spectrum 1 weight 0.10000E+01 volume 0.16026E-02 ppm1 1.587 ppm2 7.204 CV 1
ASSI { 179}
( segid "SUPF" and resid 33 and name HE% )
( segid "SUPF" and resid 34 and name HE% )
3.300 1.400 1.400 peak 179 spectrum 1 weight 0.10000E+01 volume 0.12839E-02 ppm1 1.587 ppm2 7.284 CV 1
ASSI { 180}
( segid "SUPF" and resid 33 and name HE% )
( segid "SUPF" and resid 111 and name HD% )
3.200 1.300 1.300 peak 180 spectrum 1 weight 0.10000E+01 volume 0.13904E-02 ppm1 1.588 ppm2 7.075 CV 1
ASSI { 181}
( segid "SUPF" and resid 33 and name HE% )
( segid "SUPF" and resid 111 and name HE% )
3.400 1.400 1.400 peak 181 spectrum 1 weight 0.10000E+01 volume 0.14806E-02 ppm1 1.587 ppm2 6.752 CV 1
ASSI { 182}
(( segid "SUPF" and resid 33 and name HG2 ))
( segid "SUPF" and resid 34 and name HD% )
3.900 1.900 1.900 peak 182 spectrum 1 weight 0.10000E+01 volume 0.45761E-03 ppm1 1.242 ppm2 7.201 CV 1
ASSI { 183}
(( segid "SUPF" and resid 33 and name HG2 ))
( segid "SUPF" and resid 111 and name HD% )
4.000 2.000 2.000 peak 183 spectrum 1 weight 0.10000E+01 volume 0.43507E-03 ppm1 1.247 ppm2 7.076 CV 1
ASSI { 184}
(( segid "SUPF" and resid 34 and name HA ))
(( segid "SUPF" and resid 86 and name HD2 ))
4.400 2.400 1.600 peak 184 spectrum 1 weight 0.10000E+01 volume 0.60020E-03 ppm1 4.888 ppm2 3.002 CV 1
OR { 184}
(( segid "SUPF" and resid 34 and name HA ))
(( segid "SUPF" and resid 86 and name HD1 ))
ASSI { 185}
(( segid "SUPF" and resid 34 and name HA ))
(( segid "SUPF" and resid 34 and name HB1 ))
2.800 1.000 1.000 peak 185 spectrum 1 weight 0.10000E+01 volume 0.23524E-02 ppm1 4.894 ppm2 2.794 CV 1
ASSI { 186}
(( segid "SUPF" and resid 34 and name HA ))
(( segid "SUPF" and resid 34 and name HB2 ))
3.100 1.200 1.200 peak 186 spectrum 1 weight 0.10000E+01 volume 0.25704E-02 ppm1 4.882 ppm2 3.461 CV 1
ASSI { 187}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 34 and name HD% )
2.600 0.800 0.800 peak 187 spectrum 1 weight 0.10000E+01 volume 0.48604E-02 ppm1 4.882 ppm2 7.199 CV 1
ASSI { 188}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 34 and name HE% )
4.300 2.300 1.700 peak 188 spectrum 1 weight 0.10000E+01 volume 0.85119E-03 ppm1 4.883 ppm2 7.284 CV 1
ASSI { 189}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 109 and name HD1%)
3.100 1.200 1.200 peak 189 spectrum 1 weight 0.10000E+01 volume 0.18760E-02 ppm1 4.884 ppm2 1.267 CV 1
ASSI { 190}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 109 and name HD2%)
2.900 1.100 1.100 peak 190 spectrum 1 weight 0.10000E+01 volume 0.20585E-02 ppm1 4.885 ppm2 0.847 CV 1
ASSI { 191}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 111 and name HD% )
3.800 1.800 1.800 peak 191 spectrum 1 weight 0.10000E+01 volume 0.47412E-03 ppm1 4.883 ppm2 7.072 CV 1
ASSI { 192}
(( segid "SUPF" and resid 34 and name HA ))
( segid "SUPF" and resid 111 and name HE% )
4.000 2.000 2.000 peak 192 spectrum 1 weight 0.10000E+01 volume 0.48545E-03 ppm1 4.878 ppm2 6.750 CV 1
ASSI { 193}
(( segid "SUPF" and resid 34 and name HB1 ))
(( segid "SUPF" and resid 34 and name HB2 ))
2.000 0.500 0.500 peak 193 spectrum 1 weight 0.10000E+01 volume 0.64344E-02 ppm1 2.797 ppm2 3.459 CV 1
ASSI { 194}
(( segid "SUPF" and resid 34 and name HB1 ))
( segid "SUPF" and resid 34 and name HD% )
2.700 0.900 0.900 peak 194 spectrum 1 weight 0.10000E+01 volume 0.37497E-02 ppm1 2.797 ppm2 7.199 CV 1
ASSI { 195}
(( segid "SUPF" and resid 34 and name HB1 ))
( segid "SUPF" and resid 34 and name HE% )
4.600 2.700 1.400 peak 195 spectrum 1 weight 0.10000E+01 volume 0.57048E-03 ppm1 2.794 ppm2 7.283 CV 1
ASSI { 196}
(( segid "SUPF" and resid 34 and name HB1 ))
( segid "SUPF" and resid 35 and name HG2%)
4.000 2.000 2.000 peak 196 spectrum 1 weight 0.10000E+01 volume 0.69518E-03 ppm1 2.797 ppm2 0.815 CV 1
ASSI { 200}
(( segid "SUPF" and resid 34 and name HB2 ))
( segid "SUPF" and resid 34 and name HD% )
2.600 0.800 0.800 peak 200 spectrum 1 weight 0.10000E+01 volume 0.35351E-02 ppm1 3.461 ppm2 7.199 CV 1
ASSI { 201}
(( segid "SUPF" and resid 34 and name HB2 ))
( segid "SUPF" and resid 34 and name HE% )
4.700 2.800 1.300 peak 201 spectrum 1 weight 0.10000E+01 volume 0.54535E-03 ppm1 3.457 ppm2 7.286 CV 1
ASSI { 202}
(( segid "SUPF" and resid 34 and name HB2 ))
( segid "SUPF" and resid 35 and name HG2%)
3.400 1.500 1.500 peak 202 spectrum 1 weight 0.10000E+01 volume 0.68464E-03 ppm1 3.464 ppm2 0.811 CV 1
ASSI { 203}
(( segid "SUPF" and resid 34 and name HB2 ))
(( segid "SUPF" and resid 86 and name HB1 ))
3.700 1.700 1.700 peak 203 spectrum 1 weight 0.10000E+01 volume 0.89420E-03 ppm1 3.463 ppm2 1.879 CV 1
OR { 203}
(( segid "SUPF" and resid 34 and name HB2 ))
(( segid "SUPF" and resid 86 and name HB2 ))
ASSI { 208}
( segid "SUPF" and resid 34 and name HD% )
( segid "SUPF" and resid 34 and name HE% )
1.900 0.500 0.500 peak 208 spectrum 1 weight 0.10000E+01 volume 0.22869E-01 ppm1 7.201 ppm2 7.283 CV 1
ASSI { 212}
(( segid "SUPF" and resid 35 and name HA ))
( segid "SUPF" and resid 35 and name HG2%)
2.300 0.700 0.700 peak 212 spectrum 1 weight 0.10000E+01 volume 0.95937E-02 ppm1 4.402 ppm2 0.812 CV 1
ASSI { 213}
(( segid "SUPF" and resid 35 and name HB ))
(( segid "SUPF" and resid 35 and name HA ))
2.400 0.700 0.700 peak 213 spectrum 1 weight 0.10000E+01 volume 0.50598E-02 ppm1 4.533 ppm2 4.399 CV 1
ASSI { 215}
(( segid "SUPF" and resid 35 and name HB ))
(( segid "SUPF" and resid 83 and name HB1 ))
4.200 2.200 1.800 peak 215 spectrum 1 weight 0.10000E+01 volume 0.77975E-03 ppm1 4.528 ppm2 2.548 CV 1
ASSI { 216}
(( segid "SUPF" and resid 35 and name HB ))
( segid "SUPF" and resid 89 and name HB% )
3.500 1.500 1.500 peak 216 spectrum 1 weight 0.10000E+01 volume 0.18263E-02 ppm1 4.526 ppm2 1.553 CV 1
ASSI { 218}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 82 and name HA ))
4.400 2.400 1.600 peak 218 spectrum 1 weight 0.10000E+01 volume 0.70747E-03 ppm1 0.817 ppm2 5.098 CV 1
ASSI { 219}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 86 and name HA ))
2.400 0.700 0.700 peak 219 spectrum 1 weight 0.10000E+01 volume 0.63988E-02 ppm1 0.813 ppm2 4.029 CV 1
ASSI { 220}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 86 and name HD2 ))
3.500 1.500 1.500 peak 220 spectrum 1 weight 0.10000E+01 volume 0.13461E-02 ppm1 0.812 ppm2 2.983 CV 1
OR { 220}
( segid "SUPF" and resid 35 and name HG2%)
(( segid "SUPF" and resid 86 and name HD1 ))
ASSI { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HB2 ))
2.600 0.800 0.800 peak 221 spectrum 1 weight 0.10000E+01 volume 0.38343E-02 ppm1 5.019 ppm2 1.394 CV 1
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HG2 ))
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HB1 ))
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HG1 ))
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HD1 ))
OR { 221}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 222}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HB1 ))
3.000 1.100 1.100 peak 222 spectrum 1 weight 0.10000E+01 volume 0.25489E-02 ppm1 5.017 ppm2 1.691 CV 1
ASSI { 223}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HB2 ))
2.800 1.000 1.000 peak 223 spectrum 1 weight 0.10000E+01 volume 0.15611E-02 ppm1 5.019 ppm2 1.975 CV 1
ASSI { 224}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 36 and name HG1 ))
2.900 1.000 1.000 peak 224 spectrum 1 weight 0.10000E+01 volume 0.15243E-02 ppm1 5.017 ppm2 1.117 CV 1
ASSI { 225}
(( segid "SUPF" and resid 36 and name HA ))
( segid "SUPF" and resid 80 and name HD% )
4.800 2.800 1.200 peak 225 spectrum 1 weight 0.10000E+01 volume 0.24425E-03 ppm1 5.022 ppm2 7.166 CV 1
ASSI { 226}
(( segid "SUPF" and resid 36 and name HA ))
(( segid "SUPF" and resid 82 and name HA ))
2.300 0.600 0.600 peak 226 spectrum 1 weight 0.10000E+01 volume 0.64711E-02 ppm1 5.022 ppm2 5.100 CV 1
ASSI { 230}
(( segid "SUPF" and resid 36 and name HB1 ))
(( segid "SUPF" and resid 36 and name HG1 ))
3.200 1.300 1.300 peak 230 spectrum 1 weight 0.10000E+01 volume 0.16962E-02 ppm1 1.691 ppm2 1.092 CV 1
ASSI { 231}
(( segid "SUPF" and resid 36 and name HB1 ))
(( segid "SUPF" and resid 82 and name HA ))
4.400 2.400 1.600 peak 231 spectrum 1 weight 0.10000E+01 volume 0.89197E-03 ppm1 1.689 ppm2 5.099 CV 1
ASSI { 232}
(( segid "SUPF" and resid 36 and name HB1 ))
( segid "SUPF" and resid 82 and name HG2%)
3.800 1.800 1.800 peak 232 spectrum 1 weight 0.10000E+01 volume 0.17556E-02 ppm1 1.699 ppm2 1.147 CV 1
ASSI { 234}
(( segid "SUPF" and resid 36 and name HB2 ))
( segid "SUPF" and resid 32 and name HG2%)
3.900 1.900 1.900 peak 234 spectrum 1 weight 0.10000E+01 volume 0.96931E-03 ppm1 1.967 ppm2 1.095 CV 1
ASSI { 237}
(( segid "SUPF" and resid 36 and name HB2 ))
( segid "SUPF" and resid 82 and name HG2%)
2.900 1.100 1.100 peak 237 spectrum 1 weight 0.10000E+01 volume 0.21768E-02 ppm1 1.987 ppm2 1.149 CV 1
ASSI { 238}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 36 and name HA ))
3.200 1.300 1.300 peak 238 spectrum 1 weight 0.10000E+01 volume 0.22837E-02 ppm1 1.403 ppm2 5.018 CV 1
OR { 238}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 36 and name HA ))
ASSI { 241}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 36 and name HG1 ))
2.400 0.700 0.700 peak 241 spectrum 1 weight 0.10000E+01 volume 0.64578E-02 ppm1 1.401 ppm2 1.114 CV 1
OR { 241}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 36 and name HG1 ))
ASSI { 242}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 80 and name HB1 ))
3.900 1.900 1.900 peak 242 spectrum 1 weight 0.10000E+01 volume 0.69765E-03 ppm1 1.405 ppm2 2.671 CV 1
OR { 242}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 80 and name HB1 ))
ASSI { 243}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 80 and name HB2 ))
4.300 2.400 1.700 peak 243 spectrum 1 weight 0.10000E+01 volume 0.10358E-02 ppm1 1.402 ppm2 2.872 CV 1
OR { 243}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 80 and name HB2 ))
ASSI { 244}
(( segid "SUPF" and resid 36 and name HD1 ))
( segid "SUPF" and resid 80 and name HD% )
3.800 1.800 1.800 peak 244 spectrum 1 weight 0.10000E+01 volume 0.12624E-02 ppm1 1.413 ppm2 7.159 CV 1
OR { 244}
(( segid "SUPF" and resid 36 and name HD2 ))
( segid "SUPF" and resid 80 and name HD% )
ASSI { 245}
(( segid "SUPF" and resid 36 and name HD2 ))
( segid "SUPF" and resid 80 and name HE% )
4.500 2.600 1.500 peak 245 spectrum 1 weight 0.10000E+01 volume 0.45619E-03 ppm1 1.409 ppm2 7.560 CV 1
OR { 245}
(( segid "SUPF" and resid 36 and name HD1 ))
( segid "SUPF" and resid 80 and name HE% )
ASSI { 246}
(( segid "SUPF" and resid 36 and name HD1 ))
(( segid "SUPF" and resid 82 and name HA ))
4.000 2.000 2.000 peak 246 spectrum 1 weight 0.10000E+01 volume 0.77324E-03 ppm1 1.404 ppm2 5.095 CV 1
OR { 246}
(( segid "SUPF" and resid 36 and name HD2 ))
(( segid "SUPF" and resid 82 and name HA ))
ASSI { 248}
(( segid "SUPF" and resid 36 and name HE1 ))
(( segid "SUPF" and resid 36 and name HD1 ))
2.500 0.800 0.800 peak 248 spectrum 1 weight 0.10000E+01 volume 0.45004E-02 ppm1 2.476 ppm2 1.396 CV 1
OR { 248}
(( segid "SUPF" and resid 36 and name HE1 ))
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 249}
(( segid "SUPF" and resid 36 and name HE1 ))
(( segid "SUPF" and resid 36 and name HG1 ))
3.300 1.300 1.300 peak 249 spectrum 1 weight 0.10000E+01 volume 0.98166E-03 ppm1 2.468 ppm2 1.101 CV 1
ASSI { 250}
(( segid "SUPF" and resid 36 and name HE1 ))
( segid "SUPF" and resid 80 and name HD% )
3.400 1.500 1.500 peak 250 spectrum 1 weight 0.10000E+01 volume 0.93160E-03 ppm1 2.472 ppm2 7.166 CV 1
ASSI { 251}
(( segid "SUPF" and resid 36 and name HE1 ))
( segid "SUPF" and resid 80 and name HE% )
4.300 2.300 1.700 peak 251 spectrum 1 weight 0.10000E+01 volume 0.38631E-03 ppm1 2.473 ppm2 7.560 CV 1
ASSI { 252}
(( segid "SUPF" and resid 36 and name HE1 ))
( segid "SUPF" and resid 110 and name HB% )
4.500 2.500 1.500 peak 252 spectrum 1 weight 0.10000E+01 volume 0.53993E-03 ppm1 2.460 ppm2 1.487 CV 1
ASSI { 253}
(( segid "SUPF" and resid 36 and name HE2 ))
(( segid "SUPF" and resid 36 and name HD2 ))
2.600 0.800 0.800 peak 253 spectrum 1 weight 0.10000E+01 volume 0.40769E-02 ppm1 2.329 ppm2 1.397 CV 1
OR { 253}
(( segid "SUPF" and resid 36 and name HE2 ))
(( segid "SUPF" and resid 36 and name HD1 ))
ASSI { 254}
(( segid "SUPF" and resid 36 and name HE2 ))
(( segid "SUPF" and resid 36 and name HG1 ))
3.200 1.300 1.300 peak 254 spectrum 1 weight 0.10000E+01 volume 0.12283E-02 ppm1 2.327 ppm2 1.107 CV 1
ASSI { 255}
(( segid "SUPF" and resid 36 and name HE2 ))
( segid "SUPF" and resid 80 and name HD% )
3.000 1.100 1.100 peak 255 spectrum 1 weight 0.10000E+01 volume 0.11882E-02 ppm1 2.331 ppm2 7.165 CV 1
ASSI { 256}
(( segid "SUPF" and resid 36 and name HE2 ))
( segid "SUPF" and resid 80 and name HE% )
3.500 1.600 1.600 peak 256 spectrum 1 weight 0.10000E+01 volume 0.48367E-03 ppm1 2.332 ppm2 7.557 CV 1
ASSI { 257}
(( segid "SUPF" and resid 36 and name HE2 ))
( segid "SUPF" and resid 110 and name HB% )
3.400 1.500 1.500 peak 257 spectrum 1 weight 0.10000E+01 volume 0.82697E-03 ppm1 2.337 ppm2 1.487 CV 1
ASSI { 258}
(( segid "SUPF" and resid 36 and name HG1 ))
( segid "SUPF" and resid 80 and name HD% )
3.000 1.100 1.100 peak 258 spectrum 1 weight 0.10000E+01 volume 0.13374E-02 ppm1 1.114 ppm2 7.168 CV 1
ASSI { 259}
(( segid "SUPF" and resid 36 and name HG2 ))
( segid "SUPF" and resid 80 and name HD% )
3.400 1.500 1.500 peak 259 spectrum 1 weight 0.10000E+01 volume 0.77890E-03 ppm1 1.396 ppm2 7.166 CV 1
ASSI { 260}
(( segid "SUPF" and resid 37 and name HA ))
(( segid "SUPF" and resid 37 and name HB ))
2.800 1.000 1.000 peak 260 spectrum 1 weight 0.10000E+01 volume 0.23926E-02 ppm1 4.262 ppm2 1.786 CV 1
ASSI { 261}
(( segid "SUPF" and resid 37 and name HA ))
( segid "SUPF" and resid 37 and name HD1%)
3.800 1.800 1.800 peak 261 spectrum 1 weight 0.10000E+01 volume 0.19773E-02 ppm1 4.258 ppm2 0.686 CV 1
ASSI { 262}
(( segid "SUPF" and resid 37 and name HA ))
(( segid "SUPF" and resid 37 and name HG11))
3.000 1.100 1.100 peak 262 spectrum 1 weight 0.10000E+01 volume 0.19288E-02 ppm1 4.260 ppm2 1.638 CV 1
ASSI { 264}
(( segid "SUPF" and resid 37 and name HA ))
( segid "SUPF" and resid 37 and name HG2%)
2.400 0.700 0.700 peak 264 spectrum 1 weight 0.10000E+01 volume 0.54812E-02 ppm1 4.256 ppm2 0.720 CV 1
ASSI { 265}
(( segid "SUPF" and resid 37 and name HA ))
(( segid "SUPF" and resid 109 and name HA ))
2.300 0.700 0.700 peak 265 spectrum 1 weight 0.10000E+01 volume 0.56841E-02 ppm1 4.255 ppm2 4.474 CV 1
ASSI { 269}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 37 and name HB ))
2.600 0.900 0.900 peak 269 spectrum 1 weight 0.10000E+01 volume 0.34729E-02 ppm1 0.681 ppm2 1.786 CV 1
ASSI { 270}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 37 and name HG11))
2.400 0.700 0.700 peak 270 spectrum 1 weight 0.10000E+01 volume 0.54947E-02 ppm1 0.683 ppm2 1.637 CV 1
ASSI { 271}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 55 and name HD% )
3.200 1.200 1.200 peak 271 spectrum 1 weight 0.10000E+01 volume 0.13999E-02 ppm1 0.685 ppm2 7.831 CV 1
ASSI { 272}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 55 and name HE% )
2.800 1.000 1.000 peak 272 spectrum 1 weight 0.10000E+01 volume 0.21144E-02 ppm1 0.680 ppm2 7.323 CV 1
ASSI { 273}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 55 and name HZ ))
4.700 2.700 1.300 peak 273 spectrum 1 weight 0.10000E+01 volume 0.30435E-03 ppm1 0.674 ppm2 7.201 CV 1
ASSI { 274}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 58 and name HD% )
5.000 3.100 1.000 peak 274 spectrum 1 weight 0.10000E+01 volume 0.22482E-03 ppm1 0.680 ppm2 7.380 CV 1
ASSI { 275}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 81 and name HB ))
3.100 1.200 1.200 peak 275 spectrum 1 weight 0.10000E+01 volume 0.17185E-02 ppm1 0.689 ppm2 1.178 CV 1
ASSI { 277}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 83 and name HB2 ))
3.700 1.700 1.700 peak 277 spectrum 1 weight 0.10000E+01 volume 0.15748E-02 ppm1 0.679 ppm2 2.018 CV 1
ASSI { 278}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 83 and name HE% )
3.400 1.500 1.500 peak 278 spectrum 1 weight 0.10000E+01 volume 0.16304E-02 ppm1 0.684 ppm2 1.938 CV 1
ASSI { 279}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 83 and name HG1 ))
2.900 1.100 1.100 peak 279 spectrum 1 weight 0.10000E+01 volume 0.20938E-02 ppm1 0.684 ppm2 2.260 CV 1
ASSI { 280}
( segid "SUPF" and resid 37 and name HD1%)
(( segid "SUPF" and resid 89 and name HA ))
2.400 0.700 0.700 peak 280 spectrum 1 weight 0.10000E+01 volume 0.49011E-02 ppm1 0.684 ppm2 4.099 CV 1
ASSI { 281}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 89 and name HB% )
2.600 0.800 0.800 peak 281 spectrum 1 weight 0.10000E+01 volume 0.45271E-02 ppm1 0.683 ppm2 1.549 CV 1
ASSI { 282}
( segid "SUPF" and resid 37 and name HD1%)
( segid "SUPF" and resid 92 and name HB% )
2.200 0.600 0.600 peak 282 spectrum 1 weight 0.10000E+01 volume 0.88070E-02 ppm1 0.683 ppm2 1.436 CV 1
ASSI { 285}
(( segid "SUPF" and resid 37 and name HG11))
(( segid "SUPF" and resid 37 and name HG12))
2.000 0.500 0.500 peak 285 spectrum 1 weight 0.10000E+01 volume 0.55514E-02 ppm1 1.640 ppm2 0.602 CV 1
ASSI { 286}
(( segid "SUPF" and resid 37 and name HG11))
( segid "SUPF" and resid 39 and name HG2%)
3.600 3.600 2.400 peak 286 spectrum 1 weight 0.10000E+01 volume 0.20066E-02 ppm1 1.631 ppm2 0.718 CV 1
ASSI { 287}
(( segid "SUPF" and resid 37 and name HG12))
(( segid "SUPF" and resid 37 and name HA ))
2.700 0.900 0.900 peak 287 spectrum 1 weight 0.10000E+01 volume 0.19678E-02 ppm1 0.610 ppm2 4.255 CV 1
ASSI { 288}
(( segid "SUPF" and resid 37 and name HG12))
(( segid "SUPF" and resid 37 and name HB ))
3.400 1.400 1.400 peak 288 spectrum 1 weight 0.10000E+01 volume 0.12420E-02 ppm1 0.609 ppm2 1.786 CV 1
ASSI { 290}
(( segid "SUPF" and resid 37 and name HG12))
( segid "SUPF" and resid 39 and name HG2%)
3.400 3.400 2.600 peak 290 spectrum 1 weight 0.10000E+01 volume 0.32729E-02 ppm1 0.617 ppm2 0.716 CV 1
ASSI { 291}
(( segid "SUPF" and resid 37 and name HG12))
(( segid "SUPF" and resid 109 and name HA ))
3.500 1.500 1.500 peak 291 spectrum 1 weight 0.10000E+01 volume 0.55914E-03 ppm1 0.616 ppm2 4.477 CV 1
ASSI { 292}
(( segid "SUPF" and resid 37 and name HG12))
( segid "SUPF" and resid 109 and name HD2%)
2.600 0.800 0.800 peak 292 spectrum 1 weight 0.10000E+01 volume 0.25647E-02 ppm1 0.615 ppm2 0.846 CV 1
ASSI { 294}
( segid "SUPF" and resid 37 and name HG2%)
( segid "SUPF" and resid 55 and name HD% )
4.300 2.300 1.700 peak 294 spectrum 1 weight 0.10000E+01 volume 0.51717E-03 ppm1 0.721 ppm2 7.834 CV 1
ASSI { 295}
( segid "SUPF" and resid 37 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
2.900 1.100 1.100 peak 295 spectrum 1 weight 0.10000E+01 volume 0.20705E-02 ppm1 0.723 ppm2 7.323 CV 1
ASSI { 296}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 55 and name HZ ))
3.400 1.400 1.400 peak 296 spectrum 1 weight 0.10000E+01 volume 0.13074E-02 ppm1 0.722 ppm2 7.199 CV 1
ASSI { 297}
( segid "SUPF" and resid 37 and name HG2%)
(( segid "SUPF" and resid 107 and name HA ))
3.600 1.600 1.600 peak 297 spectrum 1 weight 0.10000E+01 volume 0.12951E-02 ppm1 0.723 ppm2 5.364 CV 1
ASSI { 298}
(( segid "SUPF" and resid 38 and name HA ))
(( segid "SUPF" and resid 38 and name HB2 ))
2.600 0.800 0.800 peak 298 spectrum 1 weight 0.10000E+01 volume 0.34037E-02 ppm1 4.742 ppm2 3.009 CV 1
OR { 298}
(( segid "SUPF" and resid 38 and name HA ))
(( segid "SUPF" and resid 38 and name HB1 ))
ASSI { 299}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
2.700 0.900 0.900 peak 299 spectrum 1 weight 0.10000E+01 volume 0.33767E-02 ppm1 4.739 ppm2 6.993 CV 1
ASSI { 300}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 38 and name HE% )
4.600 2.600 1.400 peak 300 spectrum 1 weight 0.10000E+01 volume 0.44381E-03 ppm1 4.740 ppm2 6.919 CV 1
ASSI { 301}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 39 and name HG2%)
3.700 1.700 1.700 peak 301 spectrum 1 weight 0.10000E+01 volume 0.87751E-03 ppm1 4.737 ppm2 0.711 CV 1
ASSI { 302}
(( segid "SUPF" and resid 38 and name HA ))
(( segid "SUPF" and resid 80 and name HA ))
2.800 1.000 1.000 peak 302 spectrum 1 weight 0.10000E+01 volume 0.23609E-02 ppm1 4.740 ppm2 5.847 CV 1
ASSI { 303}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 80 and name HD% )
2.600 0.800 0.800 peak 303 spectrum 1 weight 0.10000E+01 volume 0.30510E-02 ppm1 4.741 ppm2 7.166 CV 1
ASSI { 304}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 80 and name HE% )
3.400 1.400 1.400 peak 304 spectrum 1 weight 0.10000E+01 volume 0.11428E-02 ppm1 4.742 ppm2 7.558 CV 1
ASSI { 305}
(( segid "SUPF" and resid 38 and name HA ))
( segid "SUPF" and resid 110 and name HB% )
3.900 1.900 1.900 peak 305 spectrum 1 weight 0.10000E+01 volume 0.71012E-03 ppm1 4.740 ppm2 1.484 CV 1
ASSI { 306}
(( segid "SUPF" and resid 38 and name HB2 ))
( segid "SUPF" and resid 80 and name HD% )
3.500 1.600 1.600 peak 306 spectrum 1 weight 0.10000E+01 volume 0.10759E-02 ppm1 3.004 ppm2 7.164 CV 1
OR { 306}
(( segid "SUPF" and resid 38 and name HB1 ))
( segid "SUPF" and resid 80 and name HD% )
ASSI { 307}
(( segid "SUPF" and resid 38 and name HB2 ))
(( segid "SUPF" and resid 110 and name HA ))
2.600 0.800 0.800 peak 307 spectrum 1 weight 0.10000E+01 volume 0.41746E-02 ppm1 3.006 ppm2 4.142 CV 1
OR { 307}
(( segid "SUPF" and resid 38 and name HB1 ))
(( segid "SUPF" and resid 110 and name HA ))
ASSI { 308}
(( segid "SUPF" and resid 38 and name HB1 ))
( segid "SUPF" and resid 38 and name HD% )
2.400 0.700 0.700 peak 308 spectrum 1 weight 0.10000E+01 volume 0.51297E-02 ppm1 3.041 ppm2 6.994 CV 1
ASSI { 310}
(( segid "SUPF" and resid 38 and name HB2 ))
( segid "SUPF" and resid 38 and name HD% )
2.500 0.800 0.800 peak 310 spectrum 1 weight 0.10000E+01 volume 0.52090E-02 ppm1 2.983 ppm2 6.994 CV 1
ASSI { 313}
( segid "SUPF" and resid 38 and name HD% )
( segid "SUPF" and resid 80 and name HE% )
2.600 0.900 0.900 peak 313 spectrum 1 weight 0.10000E+01 volume 0.25997E-02 ppm1 6.999 ppm2 7.557 CV 1
ASSI { 317}
( segid "SUPF" and resid 38 and name HE% )
(( segid "SUPF" and resid 38 and name HB1 ))
4.400 2.400 1.600 peak 317 spectrum 1 weight 0.10000E+01 volume 0.71457E-03 ppm1 6.942 ppm2 3.004 CV 1
OR { 317}
( segid "SUPF" and resid 38 and name HE% )
(( segid "SUPF" and resid 38 and name HB2 ))
ASSI { 324}
(( segid "SUPF" and resid 39 and name HA ))
(( segid "SUPF" and resid 39 and name HB ))
2.900 1.000 1.000 peak 324 spectrum 1 weight 0.10000E+01 volume 0.20475E-02 ppm1 4.531 ppm2 1.584 CV 1
ASSI { 325}
(( segid "SUPF" and resid 39 and name HA ))
( segid "SUPF" and resid 39 and name HG1%)
2.400 0.700 0.700 peak 325 spectrum 1 weight 0.10000E+01 volume 0.50944E-02 ppm1 4.530 ppm2 0.744 CV 1
ASSI { 326}
(( segid "SUPF" and resid 39 and name HA ))
( segid "SUPF" and resid 39 and name HG2%)
2.400 0.700 0.700 peak 326 spectrum 1 weight 0.10000E+01 volume 0.48875E-02 ppm1 4.528 ppm2 0.711 CV 1
ASSI { 327}
(( segid "SUPF" and resid 39 and name HA ))
( segid "SUPF" and resid 107 and name HG1%)
3.400 1.500 1.500 peak 327 spectrum 1 weight 0.10000E+01 volume 0.15024E-02 ppm1 4.521 ppm2 1.089 CV 1
ASSI { 328}
(( segid "SUPF" and resid 39 and name HA ))
( segid "SUPF" and resid 107 and name HG2%)
3.000 1.100 1.100 peak 328 spectrum 1 weight 0.10000E+01 volume 0.20726E-02 ppm1 4.530 ppm2 1.035 CV 1
ASSI { 330}
(( segid "SUPF" and resid 39 and name HB ))
( segid "SUPF" and resid 39 and name HG1%)
2.200 0.600 0.600 peak 330 spectrum 1 weight 0.10000E+01 volume 0.84649E-02 ppm1 1.586 ppm2 0.743 CV 1
ASSI { 331}
(( segid "SUPF" and resid 39 and name HB ))
( segid "SUPF" and resid 39 and name HG2%)
2.100 0.600 0.600 peak 331 spectrum 1 weight 0.10000E+01 volume 0.87745E-02 ppm1 1.586 ppm2 0.713 CV 1
ASSI { 332}
( segid "SUPF" and resid 39 and name HG2%)
( segid "SUPF" and resid 55 and name HD% )
3.700 1.700 1.700 peak 332 spectrum 1 weight 0.10000E+01 volume 0.14253E-02 ppm1 0.719 ppm2 7.831 CV 1
OR { 332}
( segid "SUPF" and resid 39 and name HG1%)
( segid "SUPF" and resid 55 and name HD% )
ASSI { 333}
( segid "SUPF" and resid 39 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
2.400 0.700 0.700 peak 333 spectrum 1 weight 0.10000E+01 volume 0.71006E-02 ppm1 0.724 ppm2 7.323 CV 1
OR { 333}
( segid "SUPF" and resid 39 and name HG1%)
( segid "SUPF" and resid 55 and name HE% )
ASSI { 334}
( segid "SUPF" and resid 39 and name HG2%)
(( segid "SUPF" and resid 55 and name HZ ))
2.400 0.700 0.700 peak 334 spectrum 1 weight 0.10000E+01 volume 0.50942E-02 ppm1 0.721 ppm2 7.199 CV 1
OR { 334}
( segid "SUPF" and resid 39 and name HG1%)
(( segid "SUPF" and resid 55 and name HZ ))
ASSI { 335}
( segid "SUPF" and resid 39 and name HG1%)
(( segid "SUPF" and resid 78 and name HA ))
4.100 2.100 1.900 peak 335 spectrum 1 weight 0.10000E+01 volume 0.11859E-02 ppm1 0.736 ppm2 5.193 CV 1
OR { 335}
( segid "SUPF" and resid 39 and name HG2%)
(( segid "SUPF" and resid 78 and name HA ))
ASSI { 336}
( segid "SUPF" and resid 39 and name HG2%)
(( segid "SUPF" and resid 80 and name HA ))
3.100 1.200 1.200 peak 336 spectrum 1 weight 0.10000E+01 volume 0.15340E-02 ppm1 0.716 ppm2 5.846 CV 1
OR { 336}
( segid "SUPF" and resid 39 and name HG1%)
(( segid "SUPF" and resid 80 and name HA ))
ASSI { 337}
( segid "SUPF" and resid 39 and name HG2%)
(( segid "SUPF" and resid 107 and name HA ))
3.000 1.100 1.100 peak 337 spectrum 1 weight 0.10000E+01 volume 0.24268E-02 ppm1 0.727 ppm2 5.364 CV 1
OR { 337}
( segid "SUPF" and resid 39 and name HG1%)
(( segid "SUPF" and resid 107 and name HA ))
ASSI { 338}
( segid "SUPF" and resid 39 and name HG1%)
( segid "SUPF" and resid 100 and name HD1%)
2.300 0.600 0.600 peak 338 spectrum 1 weight 0.10000E+01 volume 0.74258E-02 ppm1 0.737 ppm2 0.222 CV 1
ASSI { 339}
( segid "SUPF" and resid 39 and name HG2%)
( segid "SUPF" and resid 81 and name HG2%)
2.100 0.600 0.600 peak 339 spectrum 1 weight 0.10000E+01 volume 0.10219E-01 ppm1 0.726 ppm2 0.403 CV 1
ASSI { 340}
(( segid "SUPF" and resid 40 and name HA1 ))
( segid "SUPF" and resid 38 and name HD% )
4.000 2.000 2.000 peak 340 spectrum 1 weight 0.10000E+01 volume 0.53866E-03 ppm1 3.756 ppm2 6.991 CV 1
ASSI { 341}
(( segid "SUPF" and resid 40 and name HA1 ))
( segid "SUPF" and resid 38 and name HE% )
2.800 1.000 1.000 peak 341 spectrum 1 weight 0.10000E+01 volume 0.19993E-02 ppm1 3.749 ppm2 6.918 CV 1
ASSI { 344}
(( segid "SUPF" and resid 40 and name HA2 ))
( segid "SUPF" and resid 38 and name HE% )
3.700 1.700 1.700 peak 344 spectrum 1 weight 0.10000E+01 volume 0.12260E-02 ppm1 4.601 ppm2 6.917 CV 1
ASSI { 345}
(( segid "SUPF" and resid 40 and name HA2 ))
(( segid "SUPF" and resid 40 and name HA1 ))
2.100 0.500 0.500 peak 345 spectrum 1 weight 0.10000E+01 volume 0.50717E-02 ppm1 4.606 ppm2 3.751 CV 1
ASSI { 347}
(( segid "SUPF" and resid 40 and name HA2 ))
(( segid "SUPF" and resid 78 and name HB1 ))
2.900 1.100 1.100 peak 347 spectrum 1 weight 0.10000E+01 volume 0.10834E-02 ppm1 4.615 ppm2 2.952 CV 1
ASSI { 348}
(( segid "SUPF" and resid 40 and name HA2 ))
(( segid "SUPF" and resid 78 and name HB2 ))
2.700 0.900 0.900 peak 348 spectrum 1 weight 0.10000E+01 volume 0.19470E-02 ppm1 4.607 ppm2 3.239 CV 1
ASSI { 349}
(( segid "SUPF" and resid 40 and name HA2 ))
( segid "SUPF" and resid 78 and name HD% )
5.000 3.100 1.000 peak 349 spectrum 1 weight 0.10000E+01 volume 0.37625E-03 ppm1 4.597 ppm2 6.737 CV 1
ASSI { 350}
(( segid "SUPF" and resid 41 and name HA1 ))
(( segid "SUPF" and resid 41 and name HA2 ))
2.000 0.500 0.500 peak 350 spectrum 1 weight 0.10000E+01 volume 0.83131E-02 ppm1 4.021 ppm2 3.733 CV 1
ASSI { 352}
(( segid "SUPF" and resid 41 and name HA2 ))
( segid "SUPF" and resid 105 and name HB% )
5.200 3.300 0.800 peak 352 spectrum 1 weight 0.10000E+01 volume 0.41893E-03 ppm1 3.722 ppm2 1.279 CV 1
ASSI { 354}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 42 and name HB2 ))
3.300 1.300 1.300 peak 354 spectrum 1 weight 0.10000E+01 volume 0.13492E-02 ppm1 4.305 ppm2 1.012 CV 1
ASSI { 356}
(( segid "SUPF" and resid 42 and name HA ))
( segid "SUPF" and resid 42 and name HD2%)
2.200 0.600 0.600 peak 356 spectrum 1 weight 0.10000E+01 volume 0.73325E-02 ppm1 4.302 ppm2 0.645 CV 1
ASSI { 357}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 43 and name HD1 ))
2.200 0.600 0.600 peak 357 spectrum 1 weight 0.10000E+01 volume 0.41671E-02 ppm1 4.301 ppm2 3.610 CV 1
ASSI { 358}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 43 and name HD2 ))
2.600 0.900 0.900 peak 358 spectrum 1 weight 0.10000E+01 volume 0.35590E-02 ppm1 4.297 ppm2 3.824 CV 1
ASSI { 359}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 43 and name HG1 ))
4.500 2.500 1.500 peak 359 spectrum 1 weight 0.10000E+01 volume 0.87474E-03 ppm1 4.300 ppm2 1.936 CV 1
ASSI { 360}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 43 and name HG2 ))
4.400 2.400 1.600 peak 360 spectrum 1 weight 0.10000E+01 volume 0.12621E-02 ppm1 4.302 ppm2 1.824 CV 1
ASSI { 361}
(( segid "SUPF" and resid 42 and name HA ))
(( segid "SUPF" and resid 103 and name HB2 ))
4.600 2.700 1.400 peak 361 spectrum 1 weight 0.10000E+01 volume 0.66120E-03 ppm1 4.301 ppm2 1.646 CV 1
ASSI { 362}
(( segid "SUPF" and resid 42 and name HB1 ))
(( segid "SUPF" and resid 42 and name HA ))
2.800 1.000 1.000 peak 362 spectrum 1 weight 0.10000E+01 volume 0.15434E-02 ppm1 1.262 ppm2 4.302 CV 1
ASSI { 363}
(( segid "SUPF" and resid 42 and name HB1 ))
(( segid "SUPF" and resid 42 and name HB2 ))
2.100 0.500 0.500 peak 363 spectrum 1 weight 0.10000E+01 volume 0.37155E-02 ppm1 1.259 ppm2 1.008 CV 1
ASSI { 364}
(( segid "SUPF" and resid 42 and name HB1 ))
( segid "SUPF" and resid 42 and name HD1%)
2.500 0.800 0.800 peak 364 spectrum 1 weight 0.10000E+01 volume 0.39107E-02 ppm1 1.262 ppm2 0.499 CV 1
ASSI { 365}
(( segid "SUPF" and resid 42 and name HB1 ))
( segid "SUPF" and resid 42 and name HD2%)
2.500 0.800 0.800 peak 365 spectrum 1 weight 0.10000E+01 volume 0.36524E-02 ppm1 1.265 ppm2 0.645 CV 1
ASSI { 372}
(( segid "SUPF" and resid 42 and name HB2 ))
( segid "SUPF" and resid 42 and name HD1%)
2.500 0.800 0.800 peak 372 spectrum 1 weight 0.10000E+01 volume 0.41917E-02 ppm1 1.010 ppm2 0.499 CV 1
ASSI { 373}
(( segid "SUPF" and resid 42 and name HB2 ))
( segid "SUPF" and resid 42 and name HD2%)
3.400 1.400 1.400 peak 373 spectrum 1 weight 0.10000E+01 volume 0.28535E-02 ppm1 1.008 ppm2 0.645 CV 1
ASSI { 374}
(( segid "SUPF" and resid 42 and name HB2 ))
(( segid "SUPF" and resid 43 and name HD1 ))
5.300 3.500 0.700 peak 374 spectrum 1 weight 0.10000E+01 volume 0.38410E-03 ppm1 1.008 ppm2 3.604 CV 1
ASSI { 377}
(( segid "SUPF" and resid 42 and name HB2 ))
(( segid "SUPF" and resid 77 and name HA1 ))
3.900 1.900 1.900 peak 377 spectrum 1 weight 0.10000E+01 volume 0.75083E-03 ppm1 1.007 ppm2 3.286 CV 1
ASSI { 378}
(( segid "SUPF" and resid 42 and name HB2 ))
(( segid "SUPF" and resid 77 and name HA2 ))
3.100 1.200 1.200 peak 378 spectrum 1 weight 0.10000E+01 volume 0.78143E-03 ppm1 1.011 ppm2 4.077 CV 1
ASSI { 379}
(( segid "SUPF" and resid 42 and name HB2 ))
(( segid "SUPF" and resid 78 and name HA ))
3.200 1.300 1.300 peak 379 spectrum 1 weight 0.10000E+01 volume 0.50911E-03 ppm1 1.003 ppm2 5.197 CV 1
ASSI { 381}
( segid "SUPF" and resid 42 and name HD1%)
(( segid "SUPF" and resid 42 and name HA ))
3.800 1.800 1.800 peak 381 spectrum 1 weight 0.10000E+01 volume 0.17634E-02 ppm1 0.504 ppm2 4.300 CV 1
ASSI { 382}
( segid "SUPF" and resid 42 and name HD1%)
(( segid "SUPF" and resid 43 and name HD2 ))
4.200 2.200 1.800 peak 382 spectrum 1 weight 0.10000E+01 volume 0.69445E-03 ppm1 0.503 ppm2 3.822 CV 1
ASSI { 384}
( segid "SUPF" and resid 42 and name HD1%)
(( segid "SUPF" and resid 78 and name HA ))
2.400 0.700 0.700 peak 384 spectrum 1 weight 0.10000E+01 volume 0.36714E-02 ppm1 0.506 ppm2 5.196 CV 1
ASSI { 386}
( segid "SUPF" and resid 42 and name HD2%)
(( segid "SUPF" and resid 43 and name HD2 ))
3.000 1.100 1.100 peak 386 spectrum 1 weight 0.10000E+01 volume 0.24036E-02 ppm1 0.643 ppm2 3.825 CV 1
ASSI { 387}
( segid "SUPF" and resid 42 and name HD2%)
(( segid "SUPF" and resid 46 and name HB ))
3.400 1.400 1.400 peak 387 spectrum 1 weight 0.10000E+01 volume 0.23330E-02 ppm1 0.641 ppm2 3.685 CV 1
ASSI { 388}
(( segid "SUPF" and resid 43 and name HA ))
(( segid "SUPF" and resid 43 and name HB2 ))
2.800 1.000 1.000 peak 388 spectrum 1 weight 0.10000E+01 volume 0.47138E-02 ppm1 4.384 ppm2 1.651 CV 1
ASSI { 393}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 42 and name HB1 ))
3.300 1.400 1.400 peak 393 spectrum 1 weight 0.10000E+01 volume 0.21990E-02 ppm1 3.601 ppm2 1.275 CV 1
ASSI { 394}
(( segid "SUPF" and resid 43 and name HD1 ))
( segid "SUPF" and resid 42 and name HD1%)
5.200 3.300 0.800 peak 394 spectrum 1 weight 0.10000E+01 volume 0.47310E-03 ppm1 3.603 ppm2 0.484 CV 1
ASSI { 395}
(( segid "SUPF" and resid 43 and name HD1 ))
( segid "SUPF" and resid 42 and name HD2%)
3.400 1.400 1.400 peak 395 spectrum 1 weight 0.10000E+01 volume 0.21564E-02 ppm1 3.609 ppm2 0.644 CV 1
ASSI { 396}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HA ))
3.700 1.700 1.700 peak 396 spectrum 1 weight 0.10000E+01 volume 0.53738E-03 ppm1 3.610 ppm2 4.387 CV 1
ASSI { 397}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HB2 ))
3.600 1.600 1.600 peak 397 spectrum 1 weight 0.10000E+01 volume 0.18209E-02 ppm1 3.608 ppm2 1.649 CV 1
ASSI { 398}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HD2 ))
2.000 0.500 0.500 peak 398 spectrum 1 weight 0.10000E+01 volume 0.50628E-02 ppm1 3.607 ppm2 3.825 CV 1
ASSI { 399}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HG1 ))
2.400 0.700 0.700 peak 399 spectrum 1 weight 0.10000E+01 volume 0.34372E-02 ppm1 3.601 ppm2 1.933 CV 1
ASSI { 400}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 43 and name HG2 ))
2.900 1.000 1.000 peak 400 spectrum 1 weight 0.10000E+01 volume 0.29979E-02 ppm1 3.614 ppm2 1.820 CV 1
ASSI { 401}
(( segid "SUPF" and resid 43 and name HD1 ))
( segid "SUPF" and resid 46 and name HG2%)
4.900 3.100 1.100 peak 401 spectrum 1 weight 0.10000E+01 volume 0.48285E-03 ppm1 3.597 ppm2 1.129 CV 1
ASSI { 402}
(( segid "SUPF" and resid 43 and name HD1 ))
(( segid "SUPF" and resid 101 and name HB1 ))
3.800 1.800 1.800 peak 402 spectrum 1 weight 0.10000E+01 volume 0.48222E-03 ppm1 3.601 ppm2 2.197 CV 1
ASSI { 404}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 42 and name HB1 ))
2.600 0.800 0.800 peak 404 spectrum 1 weight 0.10000E+01 volume 0.18604E-02 ppm1 3.826 ppm2 1.270 CV 1
ASSI { 405}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 42 and name HB2 ))
4.400 2.400 1.600 peak 405 spectrum 1 weight 0.10000E+01 volume 0.70716E-03 ppm1 3.822 ppm2 1.012 CV 1
ASSI { 408}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 43 and name HA ))
4.000 2.000 2.000 peak 408 spectrum 1 weight 0.10000E+01 volume 0.55014E-03 ppm1 3.819 ppm2 4.381 CV 1
ASSI { 409}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 43 and name HB1 ))
4.200 2.200 1.800 peak 409 spectrum 1 weight 0.10000E+01 volume 0.75174E-03 ppm1 3.827 ppm2 2.050 CV 1
ASSI { 410}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 43 and name HB2 ))
3.200 1.300 1.300 peak 410 spectrum 1 weight 0.10000E+01 volume 0.13081E-02 ppm1 3.824 ppm2 1.649 CV 1
ASSI { 414}
(( segid "SUPF" and resid 43 and name HD2 ))
( segid "SUPF" and resid 46 and name HG2%)
3.700 1.700 1.700 peak 414 spectrum 1 weight 0.10000E+01 volume 0.68638E-03 ppm1 3.819 ppm2 1.127 CV 1
ASSI { 415}
(( segid "SUPF" and resid 43 and name HD2 ))
(( segid "SUPF" and resid 101 and name HB1 ))
3.700 1.700 1.700 peak 415 spectrum 1 weight 0.10000E+01 volume 0.52037E-03 ppm1 3.824 ppm2 2.197 CV 1
ASSI { 417}
(( segid "SUPF" and resid 44 and name HA ))
(( segid "SUPF" and resid 44 and name HB2 ))
2.900 1.100 1.100 peak 417 spectrum 1 weight 0.10000E+01 volume 0.35276E-02 ppm1 4.159 ppm2 3.014 CV 1
ASSI { 419}
(( segid "SUPF" and resid 44 and name HA ))
( segid "SUPF" and resid 44 and name HE% )
4.500 2.500 1.500 peak 419 spectrum 1 weight 0.10000E+01 volume 0.61549E-03 ppm1 4.157 ppm2 6.821 CV 1
ASSI { 420}
(( segid "SUPF" and resid 44 and name HB1 ))
(( segid "SUPF" and resid 44 and name HA ))
2.400 0.700 0.700 peak 420 spectrum 1 weight 0.10000E+01 volume 0.51104E-02 ppm1 3.234 ppm2 4.150 CV 1
ASSI { 421}
(( segid "SUPF" and resid 44 and name HB1 ))
(( segid "SUPF" and resid 44 and name HB2 ))
1.900 0.400 0.400 peak 421 spectrum 1 weight 0.10000E+01 volume 0.10648E-01 ppm1 3.238 ppm2 3.015 CV 1
ASSI { 422}
(( segid "SUPF" and resid 44 and name HB1 ))
( segid "SUPF" and resid 44 and name HD% )
2.800 1.000 1.000 peak 422 spectrum 1 weight 0.10000E+01 volume 0.27307E-02 ppm1 3.239 ppm2 7.160 CV 1
ASSI { 423}
(( segid "SUPF" and resid 44 and name HB1 ))
(( segid "SUPF" and resid 75 and name HB1 ))
4.300 2.300 1.700 peak 423 spectrum 1 weight 0.10000E+01 volume 0.57304E-03 ppm1 3.243 ppm2 3.947 CV 1
ASSI { 426}
(( segid "SUPF" and resid 44 and name HB2 ))
( segid "SUPF" and resid 44 and name HD% )
2.700 0.900 0.900 peak 426 spectrum 1 weight 0.10000E+01 volume 0.30128E-02 ppm1 3.014 ppm2 7.160 CV 1
ASSI { 427}
(( segid "SUPF" and resid 44 and name HB2 ))
( segid "SUPF" and resid 44 and name HE% )
4.800 2.900 1.200 peak 427 spectrum 1 weight 0.10000E+01 volume 0.50571E-03 ppm1 3.012 ppm2 6.822 CV 1
ASSI { 429}
( segid "SUPF" and resid 44 and name HD% )
(( segid "SUPF" and resid 44 and name HA ))
2.600 0.800 0.800 peak 429 spectrum 1 weight 0.10000E+01 volume 0.50009E-02 ppm1 7.160 ppm2 4.156 CV 1
ASSI { 432}
( segid "SUPF" and resid 44 and name HD% )
( segid "SUPF" and resid 44 and name HE% )
1.900 0.400 0.400 peak 432 spectrum 1 weight 0.10000E+01 volume 0.26640E-01 ppm1 7.158 ppm2 6.822 CV 1
ASSI { 433}
( segid "SUPF" and resid 44 and name HD% )
(( segid "SUPF" and resid 75 and name HB1 ))
3.700 1.700 1.700 peak 433 spectrum 1 weight 0.10000E+01 volume 0.12839E-02 ppm1 7.160 ppm2 3.948 CV 1
ASSI { 435}
( segid "SUPF" and resid 44 and name HE% )
(( segid "SUPF" and resid 45 and name HD2 ))
2.800 2.800 3.200 peak 435 spectrum 1 weight 0.10000E+01 volume 0.13171E-02 ppm1 6.831 ppm2 6.979 CV 1
ASSI { 436}
(( segid "SUPF" and resid 45 and name HA ))
(( segid "SUPF" and resid 45 and name HB1 ))
2.500 0.800 0.800 peak 436 spectrum 1 weight 0.10000E+01 volume 0.53782E-02 ppm1 4.669 ppm2 2.912 CV 1
ASSI { 437}
(( segid "SUPF" and resid 45 and name HA ))
(( segid "SUPF" and resid 45 and name HB2 ))
2.700 0.900 0.900 peak 437 spectrum 1 weight 0.10000E+01 volume 0.53721E-02 ppm1 4.671 ppm2 3.350 CV 1
ASSI { 438}
(( segid "SUPF" and resid 45 and name HA ))
(( segid "SUPF" and resid 45 and name HD2 ))
6.000 6.000 0.000 peak 438 spectrum 1 weight 0.10000E+01 volume 0.19404E-04 ppm1 4.699 ppm2 6.977 CV 1
ASSI { 440}
(( segid "SUPF" and resid 45 and name HB1 ))
(( segid "SUPF" and resid 45 and name HB2 ))
2.000 0.500 0.500 peak 440 spectrum 1 weight 0.10000E+01 volume 0.93305E-02 ppm1 2.914 ppm2 3.349 CV 1
ASSI { 441}
(( segid "SUPF" and resid 45 and name HB1 ))
(( segid "SUPF" and resid 45 and name HD2 ))
3.400 1.400 1.400 peak 441 spectrum 1 weight 0.10000E+01 volume 0.10362E-02 ppm1 2.908 ppm2 6.975 CV 1
ASSI { 442}
(( segid "SUPF" and resid 45 and name HB2 ))
( segid "SUPF" and resid 44 and name HD% )
5.200 3.400 0.800 peak 442 spectrum 1 weight 0.10000E+01 volume 0.23865E-03 ppm1 3.352 ppm2 7.170 CV 1
ASSI { 445}
(( segid "SUPF" and resid 45 and name HB2 ))
(( segid "SUPF" and resid 45 and name HD2 ))
3.400 1.400 1.400 peak 445 spectrum 1 weight 0.10000E+01 volume 0.13704E-02 ppm1 3.351 ppm2 6.976 CV 1
ASSI { 448}
(( segid "SUPF" and resid 45 and name HE1 ))
(( segid "SUPF" and resid 43 and name HB1 ))
4.300 2.300 1.700 peak 448 spectrum 1 weight 0.10000E+01 volume 0.42009E-03 ppm1 7.963 ppm2 2.049 CV 1
ASSI { 449}
(( segid "SUPF" and resid 45 and name HE1 ))
(( segid "SUPF" and resid 43 and name HB2 ))
4.000 2.000 2.000 peak 449 spectrum 1 weight 0.10000E+01 volume 0.53686E-03 ppm1 7.960 ppm2 1.657 CV 1
ASSI { 450}
(( segid "SUPF" and resid 46 and name HA ))
(( segid "SUPF" and resid 45 and name HD2 ))
3.000 3.000 3.000 peak 450 spectrum 1 weight 0.10000E+01 volume 0.89353E-03 ppm1 4.054 ppm2 6.974 CV 1
ASSI { 451}
(( segid "SUPF" and resid 46 and name HA ))
(( segid "SUPF" and resid 46 and name HB ))
2.800 1.000 1.000 peak 451 spectrum 1 weight 0.10000E+01 volume 0.27354E-02 ppm1 4.050 ppm2 3.687 CV 1
ASSI { 453}
(( segid "SUPF" and resid 46 and name HA ))
( segid "SUPF" and resid 50 and name HG2%)
3.300 1.300 1.300 peak 453 spectrum 1 weight 0.10000E+01 volume 0.17927E-02 ppm1 4.050 ppm2 1.288 CV 1
ASSI { 454}
(( segid "SUPF" and resid 46 and name HB ))
( segid "SUPF" and resid 66 and name HG1%)
3.600 1.600 1.600 peak 454 spectrum 1 weight 0.10000E+01 volume 0.61344E-03 ppm1 3.690 ppm2 0.756 CV 1
ASSI { 455}
(( segid "SUPF" and resid 46 and name HB ))
(( segid "SUPF" and resid 42 and name HB1 ))
2.600 0.900 0.900 peak 455 spectrum 1 weight 0.10000E+01 volume 0.25616E-02 ppm1 3.689 ppm2 1.269 CV 1
ASSI { 456}
(( segid "SUPF" and resid 46 and name HB ))
(( segid "SUPF" and resid 42 and name HB2 ))
3.600 1.600 1.600 peak 456 spectrum 1 weight 0.10000E+01 volume 0.12002E-02 ppm1 3.685 ppm2 1.012 CV 1
ASSI { 457}
(( segid "SUPF" and resid 46 and name HB ))
( segid "SUPF" and resid 42 and name HD1%)
3.000 1.100 1.100 peak 457 spectrum 1 weight 0.10000E+01 volume 0.26017E-02 ppm1 3.687 ppm2 0.499 CV 1
ASSI { 460}
(( segid "SUPF" and resid 46 and name HB ))
( segid "SUPF" and resid 46 and name HG2%)
2.200 0.600 0.600 peak 460 spectrum 1 weight 0.10000E+01 volume 0.97328E-02 ppm1 3.686 ppm2 1.132 CV 1
ASSI { 462}
( segid "SUPF" and resid 46 and name HG2%)
(( segid "SUPF" and resid 46 and name HA ))
2.200 0.600 0.600 peak 462 spectrum 1 weight 0.10000E+01 volume 0.90684E-02 ppm1 1.136 ppm2 4.053 CV 1
ASSI { 464}
( segid "SUPF" and resid 46 and name HG2%)
(( segid "SUPF" and resid 101 and name HB1 ))
3.800 1.800 1.800 peak 464 spectrum 1 weight 0.10000E+01 volume 0.10496E-02 ppm1 1.138 ppm2 2.199 CV 1
ASSI { 465}
( segid "SUPF" and resid 46 and name HG2%)
(( segid "SUPF" and resid 101 and name HB2 ))
3.500 1.600 1.600 peak 465 spectrum 1 weight 0.10000E+01 volume 0.77144E-03 ppm1 1.134 ppm2 2.998 CV 1
ASSI { 466}
(( segid "SUPF" and resid 47 and name HA ))
( segid "SUPF" and resid 46 and name HG2%)
3.900 1.900 1.900 peak 466 spectrum 1 weight 0.10000E+01 volume 0.60031E-03 ppm1 4.869 ppm2 1.134 CV 1
ASSI { 467}
(( segid "SUPF" and resid 47 and name HA ))
(( segid "SUPF" and resid 47 and name HB1 ))
2.200 0.600 0.600 peak 467 spectrum 1 weight 0.10000E+01 volume 0.82101E-02 ppm1 4.862 ppm2 3.982 CV 1
ASSI { 468}
(( segid "SUPF" and resid 47 and name HA ))
(( segid "SUPF" and resid 47 and name HB2 ))
2.500 0.800 0.800 peak 468 spectrum 1 weight 0.10000E+01 volume 0.88793E-02 ppm1 4.861 ppm2 4.422 CV 1
ASSI { 469}
(( segid "SUPF" and resid 47 and name HA ))
(( segid "SUPF" and resid 66 and name HB ))
3.500 1.500 1.500 peak 469 spectrum 1 weight 0.10000E+01 volume 0.66669E-03 ppm1 4.861 ppm2 1.876 CV 1
ASSI { 470}
(( segid "SUPF" and resid 47 and name HA ))
( segid "SUPF" and resid 66 and name HG1%)
3.700 1.700 1.700 peak 470 spectrum 1 weight 0.10000E+01 volume 0.93028E-03 ppm1 4.866 ppm2 0.759 CV 1
ASSI { 473}
(( segid "SUPF" and resid 47 and name HB1 ))
(( segid "SUPF" and resid 47 and name HB2 ))
1.700 0.400 0.500 peak 473 spectrum 1 weight 0.10000E+01 volume 0.13924E-01 ppm1 3.982 ppm2 4.421 CV 1
ASSI { 474}
(( segid "SUPF" and resid 47 and name HB1 ))
( segid "SUPF" and resid 66 and name HG2%)
4.400 2.400 1.600 peak 474 spectrum 1 weight 0.10000E+01 volume 0.54059E-03 ppm1 3.966 ppm2 0.630 CV 1
ASSI { 477}
(( segid "SUPF" and resid 47 and name HB2 ))
( segid "SUPF" and resid 66 and name HG2%)
3.900 1.900 1.900 peak 477 spectrum 1 weight 0.10000E+01 volume 0.83251E-03 ppm1 4.433 ppm2 0.635 CV 1
ASSI { 478}
(( segid "SUPF" and resid 48 and name HA ))
(( segid "SUPF" and resid 48 and name HB1 ))
2.300 0.700 0.700 peak 478 spectrum 1 weight 0.10000E+01 volume 0.55243E-02 ppm1 4.017 ppm2 2.965 CV 1
ASSI { 479}
(( segid "SUPF" and resid 48 and name HA ))
(( segid "SUPF" and resid 48 and name HB2 ))
2.600 0.800 0.800 peak 479 spectrum 1 weight 0.10000E+01 volume 0.38634E-02 ppm1 4.017 ppm2 2.762 CV 1
ASSI { 481}
(( segid "SUPF" and resid 48 and name HA ))
( segid "SUPF" and resid 66 and name HG2%)
2.400 0.700 0.700 peak 481 spectrum 1 weight 0.10000E+01 volume 0.45053E-02 ppm1 4.016 ppm2 0.629 CV 1
ASSI { 483}
(( segid "SUPF" and resid 48 and name HB1 ))
(( segid "SUPF" and resid 48 and name HB2 ))
1.800 0.400 0.400 peak 483 spectrum 1 weight 0.10000E+01 volume 0.11013E-01 ppm1 2.970 ppm2 2.763 CV 1
ASSI { 484}
(( segid "SUPF" and resid 48 and name HB1 ))
( segid "SUPF" and resid 66 and name HG2%)
4.000 2.000 2.000 peak 484 spectrum 1 weight 0.10000E+01 volume 0.10783E-02 ppm1 2.975 ppm2 0.632 CV 1
ASSI { 487}
(( segid "SUPF" and resid 48 and name HB2 ))
( segid "SUPF" and resid 66 and name HG2%)
5.100 3.300 0.900 peak 487 spectrum 1 weight 0.10000E+01 volume 0.48638E-03 ppm1 2.763 ppm2 0.629 CV 1
ASSI { 488}
(( segid "SUPF" and resid 49 and name HA ))
(( segid "SUPF" and resid 52 and name HB1 ))
2.700 0.900 0.900 peak 488 spectrum 1 weight 0.10000E+01 volume 0.22704E-02 ppm1 4.147 ppm2 3.507 CV 1
ASSI { 489}
(( segid "SUPF" and resid 49 and name HA ))
(( segid "SUPF" and resid 52 and name HB2 ))
3.500 1.500 1.500 peak 489 spectrum 1 weight 0.10000E+01 volume 0.25461E-02 ppm1 4.147 ppm2 3.571 CV 1
ASSI { 490}
(( segid "SUPF" and resid 49 and name HB1 ))
(( segid "SUPF" and resid 49 and name HA ))
2.300 0.700 0.700 peak 490 spectrum 1 weight 0.10000E+01 volume 0.72427E-02 ppm1 1.908 ppm2 4.140 CV 1
ASSI { 491}
(( segid "SUPF" and resid 49 and name HB2 ))
(( segid "SUPF" and resid 49 and name HA ))
2.400 0.700 0.700 peak 491 spectrum 1 weight 0.10000E+01 volume 0.56871E-02 ppm1 1.828 ppm2 4.144 CV 1
ASSI { 492}
(( segid "SUPF" and resid 50 and name HA ))
( segid "SUPF" and resid 46 and name HG2%)
4.300 2.300 1.700 peak 492 spectrum 1 weight 0.10000E+01 volume 0.11573E-02 ppm1 4.163 ppm2 1.131 CV 1
ASSI { 493}
(( segid "SUPF" and resid 50 and name HA ))
(( segid "SUPF" and resid 50 and name HB ))
2.400 0.700 0.700 peak 493 spectrum 1 weight 0.10000E+01 volume 0.76535E-02 ppm1 4.156 ppm2 4.453 CV 1
ASSI { 494}
(( segid "SUPF" and resid 50 and name HA ))
( segid "SUPF" and resid 50 and name HG2%)
2.300 0.700 0.700 peak 494 spectrum 1 weight 0.10000E+01 volume 0.92781E-02 ppm1 4.156 ppm2 1.287 CV 1
ASSI { 495}
(( segid "SUPF" and resid 50 and name HA ))
(( segid "SUPF" and resid 53 and name HB1 ))
2.700 0.900 0.900 peak 495 spectrum 1 weight 0.10000E+01 volume 0.23259E-02 ppm1 4.152 ppm2 2.088 CV 1
ASSI { 500}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 42 and name HD2%)
2.900 2.900 3.100 peak 500 spectrum 1 weight 0.10000E+01 volume 0.41469E-02 ppm1 4.173 ppm2 0.654 CV 1
ASSI { 501}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 50 and name HG2%)
3.200 1.300 1.300 peak 501 spectrum 1 weight 0.10000E+01 volume 0.12898E-02 ppm1 4.181 ppm2 1.287 CV 1
ASSI { 502}
(( segid "SUPF" and resid 51 and name HA ))
(( segid "SUPF" and resid 51 and name HB2 ))
2.200 0.600 0.600 peak 502 spectrum 1 weight 0.10000E+01 volume 0.67331E-02 ppm1 4.177 ppm2 1.582 CV 1
ASSI { 504}
(( segid "SUPF" and resid 51 and name HA ))
(( segid "SUPF" and resid 54 and name HB1 ))
3.100 1.200 1.200 peak 504 spectrum 1 weight 0.10000E+01 volume 0.87576E-03 ppm1 4.180 ppm2 2.840 CV 1
ASSI { 505}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 55 and name HD% )
3.400 1.500 1.500 peak 505 spectrum 1 weight 0.10000E+01 volume 0.94208E-03 ppm1 4.176 ppm2 7.831 CV 1
ASSI { 507}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 100 and name HD1%)
3.700 1.700 1.700 peak 507 spectrum 1 weight 0.10000E+01 volume 0.71024E-03 ppm1 4.179 ppm2 0.224 CV 1
ASSI { 508}
(( segid "SUPF" and resid 51 and name HA ))
( segid "SUPF" and resid 100 and name HG2%)
3.100 1.200 1.200 peak 508 spectrum 1 weight 0.10000E+01 volume 0.13265E-02 ppm1 4.176 ppm2 0.473 CV 1
ASSI { 509}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 46 and name HG2%)
3.900 1.900 1.900 peak 509 spectrum 1 weight 0.10000E+01 volume 0.13150E-02 ppm1 1.742 ppm2 1.133 CV 1
ASSI { 510}
(( segid "SUPF" and resid 51 and name HB1 ))
(( segid "SUPF" and resid 48 and name HA ))
2.800 1.000 1.000 peak 510 spectrum 1 weight 0.10000E+01 volume 0.16235E-02 ppm1 1.742 ppm2 4.015 CV 1
ASSI { 511}
(( segid "SUPF" and resid 51 and name HB1 ))
(( segid "SUPF" and resid 51 and name HA ))
3.000 1.100 1.100 peak 511 spectrum 1 weight 0.10000E+01 volume 0.27667E-02 ppm1 1.738 ppm2 4.173 CV 1
ASSI { 512}
(( segid "SUPF" and resid 51 and name HB1 ))
(( segid "SUPF" and resid 51 and name HB2 ))
1.700 0.300 0.500 peak 512 spectrum 1 weight 0.10000E+01 volume 0.14132E-01 ppm1 1.736 ppm2 1.576 CV 1
ASSI { 513}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 51 and name HD1%)
2.900 1.100 1.100 peak 513 spectrum 1 weight 0.10000E+01 volume 0.55961E-02 ppm1 1.749 ppm2 0.837 CV 1
ASSI { 514}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 51 and name HD2%)
2.400 0.700 0.700 peak 514 spectrum 1 weight 0.10000E+01 volume 0.49501E-02 ppm1 1.744 ppm2 0.654 CV 1
ASSI { 515}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 55 and name HD% )
4.200 2.300 1.800 peak 515 spectrum 1 weight 0.10000E+01 volume 0.58087E-03 ppm1 1.741 ppm2 7.833 CV 1
ASSI { 516}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 64 and name HB% )
2.900 1.100 1.100 peak 516 spectrum 1 weight 0.10000E+01 volume 0.18481E-02 ppm1 1.745 ppm2 1.342 CV 1
ASSI { 517}
(( segid "SUPF" and resid 51 and name HB1 ))
( segid "SUPF" and resid 81 and name HG2%)
3.600 1.600 1.600 peak 517 spectrum 1 weight 0.10000E+01 volume 0.18265E-02 ppm1 1.745 ppm2 0.403 CV 1
ASSI { 518}
(( segid "SUPF" and resid 51 and name HB2 ))
( segid "SUPF" and resid 46 and name HG2%)
2.800 1.000 1.000 peak 518 spectrum 1 weight 0.10000E+01 volume 0.19202E-02 ppm1 1.583 ppm2 1.132 CV 1
ASSI { 521}
(( segid "SUPF" and resid 51 and name HB2 ))
( segid "SUPF" and resid 51 and name HD1%)
2.400 0.700 0.700 peak 521 spectrum 1 weight 0.10000E+01 volume 0.37397E-02 ppm1 1.580 ppm2 0.835 CV 1
ASSI { 522}
(( segid "SUPF" and resid 51 and name HB2 ))
( segid "SUPF" and resid 51 and name HD2%)
2.300 0.600 0.600 peak 522 spectrum 1 weight 0.10000E+01 volume 0.74698E-02 ppm1 1.565 ppm2 0.653 CV 1
ASSI { 524}
(( segid "SUPF" and resid 51 and name HG ))
(( segid "SUPF" and resid 48 and name HA ))
3.600 3.600 2.400 peak 524 spectrum 1 weight 0.10000E+01 volume 0.14456E-02 ppm1 1.573 ppm2 4.010 CV 1
ASSI { 525}
(( segid "SUPF" and resid 51 and name HG ))
( segid "SUPF" and resid 64 and name HB% )
3.000 1.100 1.100 peak 525 spectrum 1 weight 0.10000E+01 volume 0.17366E-02 ppm1 1.577 ppm2 1.342 CV 1
ASSI { 526}
( segid "SUPF" and resid 51 and name HD1%)
(( segid "SUPF" and resid 51 and name HA ))
2.300 0.600 0.600 peak 526 spectrum 1 weight 0.10000E+01 volume 0.61127E-02 ppm1 0.836 ppm2 4.173 CV 1
ASSI { 527}
( segid "SUPF" and resid 51 and name HD1%)
( segid "SUPF" and resid 55 and name HD% )
2.800 1.000 1.000 peak 527 spectrum 1 weight 0.10000E+01 volume 0.24695E-02 ppm1 0.837 ppm2 7.832 CV 1
ASSI { 528}
( segid "SUPF" and resid 51 and name HD1%)
( segid "SUPF" and resid 55 and name HE% )
2.400 0.700 0.700 peak 528 spectrum 1 weight 0.10000E+01 volume 0.46537E-02 ppm1 0.837 ppm2 7.323 CV 1
ASSI { 529}
( segid "SUPF" and resid 51 and name HD1%)
(( segid "SUPF" and resid 55 and name HZ ))
4.100 2.100 1.900 peak 529 spectrum 1 weight 0.10000E+01 volume 0.94028E-03 ppm1 0.838 ppm2 7.198 CV 1
ASSI { 530}
( segid "SUPF" and resid 51 and name HD2%)
(( segid "SUPF" and resid 51 and name HA ))
3.300 1.400 1.400 peak 530 spectrum 1 weight 0.10000E+01 volume 0.41855E-02 ppm1 0.649 ppm2 4.172 CV 1
ASSI { 531}
( segid "SUPF" and resid 51 and name HD2%)
( segid "SUPF" and resid 55 and name HD% )
4.100 2.100 1.900 peak 531 spectrum 1 weight 0.10000E+01 volume 0.10048E-02 ppm1 0.662 ppm2 7.833 CV 1
ASSI { 532}
( segid "SUPF" and resid 51 and name HD2%)
( segid "SUPF" and resid 55 and name HE% )
3.600 1.700 1.700 peak 532 spectrum 1 weight 0.10000E+01 volume 0.19486E-02 ppm1 0.664 ppm2 7.324 CV 1
ASSI { 534}
(( segid "SUPF" and resid 51 and name HG ))
( segid "SUPF" and resid 55 and name HD% )
3.400 1.400 1.400 peak 534 spectrum 1 weight 0.10000E+01 volume 0.63699E-03 ppm1 1.582 ppm2 7.831 CV 1
ASSI { 535}
(( segid "SUPF" and resid 52 and name HA ))
(( segid "SUPF" and resid 52 and name HB1 ))
2.800 1.000 1.000 peak 535 spectrum 1 weight 0.10000E+01 volume 0.43692E-02 ppm1 3.823 ppm2 3.508 CV 1
ASSI { 536}
(( segid "SUPF" and resid 52 and name HA ))
(( segid "SUPF" and resid 52 and name HB2 ))
2.400 0.700 0.700 peak 536 spectrum 1 weight 0.10000E+01 volume 0.44231E-02 ppm1 3.825 ppm2 3.573 CV 1
ASSI { 537}
(( segid "SUPF" and resid 52 and name HA ))
(( segid "SUPF" and resid 52 and name HD2 ))
3.400 1.400 1.400 peak 537 spectrum 1 weight 0.10000E+01 volume 0.10108E-02 ppm1 3.825 ppm2 7.247 CV 1
ASSI { 538}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 55 and name HD% )
4.100 2.100 1.900 peak 538 spectrum 1 weight 0.10000E+01 volume 0.45195E-03 ppm1 3.814 ppm2 7.833 CV 1
ASSI { 539}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
3.400 1.500 1.500 peak 539 spectrum 1 weight 0.10000E+01 volume 0.78228E-03 ppm1 3.827 ppm2 1.493 CV 1
OR { 539}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 61 and name HG2%)
OR { 539}
(( segid "SUPF" and resid 52 and name HA ))
(( segid "SUPF" and resid 61 and name HG11))
ASSI { 540}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
2.400 0.700 0.700 peak 540 spectrum 1 weight 0.10000E+01 volume 0.54897E-02 ppm1 3.821 ppm2 0.413 CV 1
ASSI { 541}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 61 and name HG2%)
3.300 1.400 1.400 peak 541 spectrum 1 weight 0.10000E+01 volume 0.19611E-02 ppm1 3.815 ppm2 0.580 CV 1
ASSI { 542}
(( segid "SUPF" and resid 52 and name HA ))
( segid "SUPF" and resid 64 and name HB% )
2.500 0.800 0.800 peak 542 spectrum 1 weight 0.10000E+01 volume 0.38284E-02 ppm1 3.822 ppm2 1.343 CV 1
ASSI { 543}
(( segid "SUPF" and resid 52 and name HB1 ))
(( segid "SUPF" and resid 49 and name HA ))
2.700 0.900 0.900 peak 543 spectrum 1 weight 0.10000E+01 volume 0.33201E-02 ppm1 3.544 ppm2 4.144 CV 1
OR { 543}
(( segid "SUPF" and resid 52 and name HB2 ))
(( segid "SUPF" and resid 49 and name HA ))
ASSI { 544}
(( segid "SUPF" and resid 52 and name HB2 ))
(( segid "SUPF" and resid 52 and name HA ))
2.400 0.700 0.700 peak 544 spectrum 1 weight 0.10000E+01 volume 0.64344E-02 ppm1 3.547 ppm2 3.819 CV 1
OR { 544}
(( segid "SUPF" and resid 52 and name HB1 ))
(( segid "SUPF" and resid 52 and name HA ))
ASSI { 545}
(( segid "SUPF" and resid 52 and name HB2 ))
( segid "SUPF" and resid 61 and name HD1%)
3.800 1.800 1.800 peak 545 spectrum 1 weight 0.10000E+01 volume 0.99750E-03 ppm1 3.546 ppm2 0.412 CV 1
OR { 545}
(( segid "SUPF" and resid 52 and name HB1 ))
( segid "SUPF" and resid 61 and name HD1%)
ASSI { 546}
(( segid "SUPF" and resid 52 and name HB2 ))
( segid "SUPF" and resid 64 and name HB% )
2.600 0.800 0.800 peak 546 spectrum 1 weight 0.10000E+01 volume 0.32595E-02 ppm1 3.524 ppm2 1.343 CV 1
OR { 546}
(( segid "SUPF" and resid 52 and name HB1 ))
( segid "SUPF" and resid 64 and name HB% )
ASSI { 547}
(( segid "SUPF" and resid 52 and name HB1 ))
(( segid "SUPF" and resid 52 and name HD2 ))
3.400 1.400 1.400 peak 547 spectrum 1 weight 0.10000E+01 volume 0.24585E-02 ppm1 3.521 ppm2 7.246 CV 1
ASSI { 550}
(( segid "SUPF" and resid 52 and name HD2 ))
(( segid "SUPF" and resid 52 and name HB2 ))
3.300 1.400 1.400 peak 550 spectrum 1 weight 0.10000E+01 volume 0.62139E-03 ppm1 7.246 ppm2 3.564 CV 1
ASSI { 555}
(( segid "SUPF" and resid 52 and name HE1 ))
( segid "SUPF" and resid 61 and name HD1%)
4.000 2.000 2.000 peak 555 spectrum 1 weight 0.10000E+01 volume 0.43750E-03 ppm1 8.485 ppm2 0.415 CV 1
ASSI { 556}
(( segid "SUPF" and resid 53 and name HA ))
(( segid "SUPF" and resid 53 and name HB1 ))
2.500 0.800 0.800 peak 556 spectrum 1 weight 0.10000E+01 volume 0.87835E-02 ppm1 4.090 ppm2 2.086 CV 1
ASSI { 557}
(( segid "SUPF" and resid 53 and name HA ))
(( segid "SUPF" and resid 53 and name HB2 ))
2.500 0.800 0.800 peak 557 spectrum 1 weight 0.10000E+01 volume 0.36841E-02 ppm1 4.078 ppm2 2.254 CV 1
ASSI { 559}
(( segid "SUPF" and resid 53 and name HA ))
(( segid "SUPF" and resid 53 and name HG2 ))
2.800 1.000 1.000 peak 559 spectrum 1 weight 0.10000E+01 volume 0.40547E-02 ppm1 4.089 ppm2 2.613 CV 1
ASSI { 562}
(( segid "SUPF" and resid 53 and name HB1 ))
(( segid "SUPF" and resid 53 and name HG2 ))
2.600 0.800 0.800 peak 562 spectrum 1 weight 0.10000E+01 volume 0.38509E-02 ppm1 2.101 ppm2 2.616 CV 1
ASSI { 563}
(( segid "SUPF" and resid 53 and name HB2 ))
(( segid "SUPF" and resid 50 and name HA ))
2.900 1.000 1.000 peak 563 spectrum 1 weight 0.10000E+01 volume 0.46567E-02 ppm1 2.259 ppm2 4.155 CV 1
ASSI { 565}
(( segid "SUPF" and resid 53 and name HB2 ))
(( segid "SUPF" and resid 53 and name HG2 ))
2.800 1.000 1.000 peak 565 spectrum 1 weight 0.10000E+01 volume 0.38438E-02 ppm1 2.263 ppm2 2.620 CV 1
ASSI { 566}
(( segid "SUPF" and resid 53 and name HG1 ))
(( segid "SUPF" and resid 50 and name HA ))
4.000 2.000 2.000 peak 566 spectrum 1 weight 0.10000E+01 volume 0.11896E-02 ppm1 2.328 ppm2 4.155 CV 1
ASSI { 567}
(( segid "SUPF" and resid 53 and name HG1 ))
(( segid "SUPF" and resid 53 and name HA ))
2.600 0.800 0.800 peak 567 spectrum 1 weight 0.10000E+01 volume 0.49401E-02 ppm1 2.331 ppm2 4.089 CV 1
ASSI { 568}
(( segid "SUPF" and resid 53 and name HG1 ))
(( segid "SUPF" and resid 53 and name HG2 ))
1.800 0.400 0.400 peak 568 spectrum 1 weight 0.10000E+01 volume 0.15748E-01 ppm1 2.340 ppm2 2.621 CV 1
ASSI { 569}
(( segid "SUPF" and resid 53 and name HG2 ))
(( segid "SUPF" and resid 50 and name HA ))
3.900 1.900 1.900 peak 569 spectrum 1 weight 0.10000E+01 volume 0.12328E-02 ppm1 2.622 ppm2 4.151 CV 1
ASSI { 571}
(( segid "SUPF" and resid 54 and name HA ))
(( segid "SUPF" and resid 54 and name HB1 ))
3.200 1.300 1.300 peak 571 spectrum 1 weight 0.10000E+01 volume 0.22458E-02 ppm1 4.126 ppm2 2.837 CV 1
ASSI { 572}
(( segid "SUPF" and resid 54 and name HA ))
(( segid "SUPF" and resid 54 and name HB2 ))
2.600 0.800 0.800 peak 572 spectrum 1 weight 0.10000E+01 volume 0.35378E-02 ppm1 4.127 ppm2 3.221 CV 1
ASSI { 573}
(( segid "SUPF" and resid 54 and name HA ))
( segid "SUPF" and resid 54 and name HD% )
2.900 1.000 1.000 peak 573 spectrum 1 weight 0.10000E+01 volume 0.26147E-02 ppm1 4.127 ppm2 6.274 CV 1
ASSI { 574}
(( segid "SUPF" and resid 54 and name HA ))
( segid "SUPF" and resid 54 and name HE% )
4.100 2.100 1.900 peak 574 spectrum 1 weight 0.10000E+01 volume 0.87185E-03 ppm1 4.121 ppm2 6.477 CV 1
ASSI { 577}
(( segid "SUPF" and resid 54 and name HB1 ))
( segid "SUPF" and resid 54 and name HD% )
2.700 0.900 0.900 peak 577 spectrum 1 weight 0.10000E+01 volume 0.22824E-02 ppm1 2.841 ppm2 6.275 CV 1
ASSI { 579}
(( segid "SUPF" and resid 54 and name HB1 ))
( segid "SUPF" and resid 55 and name HD% )
3.200 1.300 1.300 peak 579 spectrum 1 weight 0.10000E+01 volume 0.77065E-03 ppm1 2.833 ppm2 7.832 CV 1
ASSI { 583}
(( segid "SUPF" and resid 54 and name HB2 ))
(( segid "SUPF" and resid 54 and name HB1 ))
1.900 0.400 0.400 peak 583 spectrum 1 weight 0.10000E+01 volume 0.86462E-02 ppm1 3.220 ppm2 2.847 CV 1
ASSI { 584}
(( segid "SUPF" and resid 54 and name HB2 ))
( segid "SUPF" and resid 54 and name HD% )
2.800 1.000 1.000 peak 584 spectrum 1 weight 0.10000E+01 volume 0.23615E-02 ppm1 3.223 ppm2 6.274 CV 1
ASSI { 586}
(( segid "SUPF" and resid 54 and name HB2 ))
( segid "SUPF" and resid 55 and name HD% )
5.300 3.600 0.700 peak 586 spectrum 1 weight 0.10000E+01 volume 0.38686E-03 ppm1 3.209 ppm2 7.832 CV 1
ASSI { 592}
( segid "SUPF" and resid 54 and name HD% )
( segid "SUPF" and resid 54 and name HE% )
2.200 0.600 0.600 peak 592 spectrum 1 weight 0.10000E+01 volume 0.95220E-02 ppm1 6.272 ppm2 6.478 CV 1
ASSI { 593}
( segid "SUPF" and resid 54 and name HD% )
( segid "SUPF" and resid 55 and name HD% )
3.300 1.300 1.300 peak 593 spectrum 1 weight 0.10000E+01 volume 0.87239E-03 ppm1 6.276 ppm2 7.833 CV 1
ASSI { 594}
( segid "SUPF" and resid 54 and name HD% )
( segid "SUPF" and resid 55 and name HE% )
3.400 1.400 1.400 peak 594 spectrum 1 weight 0.10000E+01 volume 0.76475E-03 ppm1 6.270 ppm2 7.326 CV 1
ASSI { 595}
( segid "SUPF" and resid 54 and name HD% )
( segid "SUPF" and resid 58 and name HE% )
3.500 1.500 1.500 peak 595 spectrum 1 weight 0.10000E+01 volume 0.75698E-03 ppm1 6.256 ppm2 7.001 CV 1
ASSI { 599}
( segid "SUPF" and resid 54 and name HE% )
(( segid "SUPF" and resid 54 and name HB1 ))
4.400 2.400 1.600 peak 599 spectrum 1 weight 0.10000E+01 volume 0.77963E-03 ppm1 6.475 ppm2 2.840 CV 1
ASSI { 600}
( segid "SUPF" and resid 54 and name HE% )
(( segid "SUPF" and resid 54 and name HB2 ))
4.300 2.300 1.700 peak 600 spectrum 1 weight 0.10000E+01 volume 0.84462E-03 ppm1 6.479 ppm2 3.223 CV 1
ASSI { 603}
( segid "SUPF" and resid 54 and name HE% )
( segid "SUPF" and resid 55 and name HD% )
4.300 2.300 1.700 peak 603 spectrum 1 weight 0.10000E+01 volume 0.61404E-03 ppm1 6.479 ppm2 7.834 CV 1
ASSI { 604}
( segid "SUPF" and resid 54 and name HE% )
( segid "SUPF" and resid 55 and name HE% )
3.500 1.600 1.600 peak 604 spectrum 1 weight 0.10000E+01 volume 0.92805E-03 ppm1 6.497 ppm2 7.321 CV 1
ASSI { 605}
( segid "SUPF" and resid 54 and name HE% )
( segid "SUPF" and resid 58 and name HE% )
2.800 1.000 1.000 peak 605 spectrum 1 weight 0.10000E+01 volume 0.26405E-02 ppm1 6.479 ppm2 7.005 CV 1
ASSI { 606}
( segid "SUPF" and resid 54 and name HE% )
(( segid "SUPF" and resid 58 and name HZ ))
3.400 1.400 1.400 peak 606 spectrum 1 weight 0.10000E+01 volume 0.11339E-02 ppm1 6.481 ppm2 7.283 CV 1
ASSI { 608}
( segid "SUPF" and resid 54 and name HE% )
(( segid "SUPF" and resid 98 and name HB2 ))
3.500 1.600 1.600 peak 608 spectrum 1 weight 0.10000E+01 volume 0.81896E-03 ppm1 6.481 ppm2 1.550 CV 1
ASSI { 613}
(( segid "SUPF" and resid 88 and name HA ))
(( segid "SUPF" and resid 91 and name HB1 ))
3.100 1.200 1.200 peak 613 spectrum 1 weight 0.10000E+01 volume 0.12469E-02 ppm1 4.328 ppm2 2.333 CV 1
ASSI { 614}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 54 and name HD% )
3.400 1.500 1.500 peak 614 spectrum 1 weight 0.10000E+01 volume 0.70409E-03 ppm1 4.327 ppm2 6.275 CV 1
ASSI { 615}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 54 and name HE% )
4.300 2.300 1.700 peak 615 spectrum 1 weight 0.10000E+01 volume 0.34496E-03 ppm1 4.312 ppm2 6.480 CV 1
ASSI { 618}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 55 and name HD% )
2.900 1.000 1.000 peak 618 spectrum 1 weight 0.10000E+01 volume 0.24334E-02 ppm1 4.317 ppm2 7.832 CV 1
ASSI { 619}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 58 and name HD% )
2.300 0.700 0.700 peak 619 spectrum 1 weight 0.10000E+01 volume 0.59797E-02 ppm1 4.321 ppm2 7.373 CV 1
ASSI { 620}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 58 and name HE% )
2.800 1.000 1.000 peak 620 spectrum 1 weight 0.10000E+01 volume 0.25078E-02 ppm1 4.318 ppm2 7.003 CV 1
ASSI { 621}
(( segid "SUPF" and resid 55 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
3.900 1.900 1.900 peak 621 spectrum 1 weight 0.10000E+01 volume 0.84595E-03 ppm1 4.317 ppm2 0.412 CV 1
ASSI { 622}
(( segid "SUPF" and resid 55 and name HB1 ))
(( segid "SUPF" and resid 55 and name HA ))
2.700 0.900 0.900 peak 622 spectrum 1 weight 0.10000E+01 volume 0.18661E-02 ppm1 2.914 ppm2 4.319 CV 1
ASSI { 623}
(( segid "SUPF" and resid 55 and name HB1 ))
(( segid "SUPF" and resid 55 and name HB2 ))
2.000 0.500 0.500 peak 623 spectrum 1 weight 0.10000E+01 volume 0.53182E-02 ppm1 2.931 ppm2 3.286 CV 1
ASSI { 624}
(( segid "SUPF" and resid 55 and name HB1 ))
( segid "SUPF" and resid 55 and name HD% )
2.500 0.800 0.800 peak 624 spectrum 1 weight 0.10000E+01 volume 0.34435E-02 ppm1 2.923 ppm2 7.831 CV 1
ASSI { 626}
(( segid "SUPF" and resid 55 and name HB1 ))
( segid "SUPF" and resid 81 and name HG2%)
3.100 1.200 1.200 peak 626 spectrum 1 weight 0.10000E+01 volume 0.35709E-02 ppm1 2.927 ppm2 0.411 CV 1
ASSI { 627}
(( segid "SUPF" and resid 55 and name HB2 ))
(( segid "SUPF" and resid 55 and name HA ))
3.000 1.100 1.100 peak 627 spectrum 1 weight 0.10000E+01 volume 0.19196E-02 ppm1 3.290 ppm2 4.320 CV 1
ASSI { 628}
(( segid "SUPF" and resid 55 and name HB2 ))
( segid "SUPF" and resid 55 and name HD% )
2.600 0.900 0.900 peak 628 spectrum 1 weight 0.10000E+01 volume 0.33243E-02 ppm1 3.288 ppm2 7.832 CV 1
ASSI { 629}
(( segid "SUPF" and resid 55 and name HB2 ))
( segid "SUPF" and resid 58 and name HD% )
4.300 2.300 1.700 peak 629 spectrum 1 weight 0.10000E+01 volume 0.85884E-03 ppm1 3.291 ppm2 7.373 CV 1
ASSI { 630}
(( segid "SUPF" and resid 55 and name HB2 ))
( segid "SUPF" and resid 81 and name HG1%)
2.800 1.000 1.000 peak 630 spectrum 1 weight 0.10000E+01 volume 0.19397E-02 ppm1 3.285 ppm2 0.572 CV 1
ASSI { 631}
(( segid "SUPF" and resid 55 and name HB2 ))
( segid "SUPF" and resid 81 and name HG2%)
2.600 0.900 0.900 peak 631 spectrum 1 weight 0.10000E+01 volume 0.31665E-02 ppm1 3.287 ppm2 0.412 CV 1
ASSI { 635}
( segid "SUPF" and resid 55 and name HD% )
( segid "SUPF" and resid 39 and name HG2%)
4.200 2.200 1.800 peak 635 spectrum 1 weight 0.10000E+01 volume 0.61994E-03 ppm1 7.822 ppm2 0.716 CV 1
ASSI { 645}
( segid "SUPF" and resid 55 and name HD% )
( segid "SUPF" and resid 55 and name HE% )
2.300 0.600 0.600 peak 645 spectrum 1 weight 0.10000E+01 volume 0.57900E-02 ppm1 7.829 ppm2 7.323 CV 1
ASSI { 646}
( segid "SUPF" and resid 55 and name HD% )
(( segid "SUPF" and resid 57 and name HB2 ))
4.000 2.000 2.000 peak 646 spectrum 1 weight 0.10000E+01 volume 0.68650E-03 ppm1 7.828 ppm2 1.575 CV 1
OR { 646}
( segid "SUPF" and resid 55 and name HD% )
(( segid "SUPF" and resid 57 and name HB1 ))
ASSI { 647}
( segid "SUPF" and resid 55 and name HD% )
( segid "SUPF" and resid 58 and name HD% )
2.800 1.000 1.000 peak 647 spectrum 1 weight 0.10000E+01 volume 0.25752E-02 ppm1 7.827 ppm2 7.372 CV 1
ASSI { 648}
( segid "SUPF" and resid 55 and name HD% )
( segid "SUPF" and resid 58 and name HE% )
3.500 1.500 1.500 peak 648 spectrum 1 weight 0.10000E+01 volume 0.98292E-03 ppm1 7.834 ppm2 7.005 CV 1
ASSI { 654}
( segid "SUPF" and resid 55 and name HE% )
( segid "SUPF" and resid 39 and name HG1%)
3.000 1.100 1.100 peak 654 spectrum 1 weight 0.10000E+01 volume 0.16396E-02 ppm1 7.327 ppm2 0.747 CV 1
ASSI { 655}
( segid "SUPF" and resid 55 and name HE% )
( segid "SUPF" and resid 39 and name HG2%)
2.700 0.900 0.900 peak 655 spectrum 1 weight 0.10000E+01 volume 0.34200E-02 ppm1 7.326 ppm2 0.708 CV 1
ASSI { 665}
( segid "SUPF" and resid 55 and name HE% )
( segid "SUPF" and resid 107 and name HG1%)
2.900 1.100 1.100 peak 665 spectrum 1 weight 0.10000E+01 volume 0.17512E-02 ppm1 7.324 ppm2 1.089 CV 1
ASSI { 666}
( segid "SUPF" and resid 55 and name HE% )
( segid "SUPF" and resid 107 and name HG2%)
3.700 1.700 1.700 peak 666 spectrum 1 weight 0.10000E+01 volume 0.94877E-03 ppm1 7.329 ppm2 1.038 CV 1
ASSI { 667}
(( segid "SUPF" and resid 55 and name HZ ))
(( segid "SUPF" and resid 39 and name HB ))
4.200 2.200 1.800 peak 667 spectrum 1 weight 0.10000E+01 volume 0.11505E-02 ppm1 7.202 ppm2 1.581 CV 1
ASSI { 668}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 39 and name HG1%)
3.400 1.400 1.400 peak 668 spectrum 1 weight 0.10000E+01 volume 0.11172E-02 ppm1 7.204 ppm2 0.749 CV 1
ASSI { 669}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 39 and name HG2%)
2.600 0.800 0.800 peak 669 spectrum 1 weight 0.10000E+01 volume 0.29227E-02 ppm1 7.206 ppm2 0.719 CV 1
ASSI { 670}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 54 and name HE% )
3.500 1.600 1.600 peak 670 spectrum 1 weight 0.10000E+01 volume 0.75909E-03 ppm1 7.200 ppm2 6.476 CV 1
ASSI { 671}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 55 and name HD% )
3.600 1.600 1.600 peak 671 spectrum 1 weight 0.10000E+01 volume 0.12768E-02 ppm1 7.199 ppm2 7.831 CV 1
ASSI { 672}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 81 and name HG2%)
4.000 2.000 2.000 peak 672 spectrum 1 weight 0.10000E+01 volume 0.51402E-03 ppm1 7.191 ppm2 0.403 CV 1
ASSI { 675}
(( segid "SUPF" and resid 55 and name HZ ))
( segid "SUPF" and resid 107 and name HG2%)
2.700 0.900 0.900 peak 675 spectrum 1 weight 0.10000E+01 volume 0.20761E-02 ppm1 7.200 ppm2 1.036 CV 1
ASSI { 676}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 56 and name HB1 ))
2.800 1.000 1.000 peak 676 spectrum 1 weight 0.10000E+01 volume 0.40760E-02 ppm1 4.501 ppm2 2.083 CV 1
ASSI { 677}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 56 and name HB2 ))
2.500 0.800 0.800 peak 677 spectrum 1 weight 0.10000E+01 volume 0.36095E-02 ppm1 4.493 ppm2 2.173 CV 1
ASSI { 679}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 56 and name HG2 ))
3.100 1.200 1.200 peak 679 spectrum 1 weight 0.10000E+01 volume 0.15511E-02 ppm1 4.498 ppm2 2.602 CV 1
ASSI { 680}
(( segid "SUPF" and resid 56 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
2.400 0.700 0.700 peak 680 spectrum 1 weight 0.10000E+01 volume 0.57916E-02 ppm1 4.490 ppm2 0.414 CV 1
ASSI { 681}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 61 and name HG11))
2.800 0.900 0.900 peak 681 spectrum 1 weight 0.10000E+01 volume 0.17359E-02 ppm1 4.483 ppm2 1.483 CV 1
ASSI { 682}
(( segid "SUPF" and resid 56 and name HA ))
(( segid "SUPF" and resid 61 and name HG12))
4.100 2.100 1.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.79932E-03 ppm1 4.488 ppm2 0.985 CV 1
ASSI { 683}
(( segid "SUPF" and resid 56 and name HA ))
( segid "SUPF" and resid 83 and name HE% )
3.400 1.500 1.500 peak 683 spectrum 1 weight 0.10000E+01 volume 0.13424E-02 ppm1 4.491 ppm2 1.937 CV 1
ASSI { 685}
(( segid "SUPF" and resid 56 and name HB1 ))
(( segid "SUPF" and resid 56 and name HG1 ))
3.100 1.200 1.200 peak 685 spectrum 1 weight 0.10000E+01 volume 0.26207E-02 ppm1 2.088 ppm2 2.424 CV 1
ASSI { 686}
(( segid "SUPF" and resid 56 and name HB1 ))
(( segid "SUPF" and resid 56 and name HG2 ))
2.700 0.900 0.900 peak 686 spectrum 1 weight 0.10000E+01 volume 0.28218E-02 ppm1 2.088 ppm2 2.606 CV 1
ASSI { 687}
(( segid "SUPF" and resid 56 and name HB1 ))
( segid "SUPF" and resid 61 and name HD1%)
3.800 1.800 1.800 peak 687 spectrum 1 weight 0.10000E+01 volume 0.18447E-02 ppm1 2.090 ppm2 0.415 CV 1
ASSI { 689}
(( segid "SUPF" and resid 56 and name HB2 ))
(( segid "SUPF" and resid 56 and name HG1 ))
2.600 0.800 0.800 peak 689 spectrum 1 weight 0.10000E+01 volume 0.29500E-02 ppm1 2.160 ppm2 2.430 CV 1
ASSI { 690}
(( segid "SUPF" and resid 56 and name HB2 ))
(( segid "SUPF" and resid 56 and name HG2 ))
3.100 1.200 1.200 peak 690 spectrum 1 weight 0.10000E+01 volume 0.23975E-02 ppm1 2.172 ppm2 2.608 CV 1
ASSI { 692}
(( segid "SUPF" and resid 56 and name HG1 ))
(( segid "SUPF" and resid 56 and name HA ))
3.100 1.200 1.200 peak 692 spectrum 1 weight 0.10000E+01 volume 0.13936E-02 ppm1 2.426 ppm2 4.492 CV 1
ASSI { 693}
(( segid "SUPF" and resid 56 and name HG1 ))
(( segid "SUPF" and resid 56 and name HG2 ))
1.800 0.400 0.400 peak 693 spectrum 1 weight 0.10000E+01 volume 0.13490E-01 ppm1 2.417 ppm2 2.606 CV 1
ASSI { 694}
(( segid "SUPF" and resid 56 and name HG1 ))
( segid "SUPF" and resid 61 and name HD1%)
3.300 1.300 1.300 peak 694 spectrum 1 weight 0.10000E+01 volume 0.16445E-02 ppm1 2.427 ppm2 0.412 CV 1
ASSI { 699}
(( segid "SUPF" and resid 57 and name HG1 ))
(( segid "SUPF" and resid 57 and name HA ))
3.200 1.200 1.200 peak 699 spectrum 1 weight 0.10000E+01 volume 0.22845E-02 ppm1 1.539 ppm2 4.080 CV 1
ASSI { 700}
(( segid "SUPF" and resid 57 and name HG1 ))
(( segid "SUPF" and resid 57 and name HG2 ))
2.000 0.500 0.500 peak 700 spectrum 1 weight 0.10000E+01 volume 0.70807E-02 ppm1 1.528 ppm2 0.203 CV 1
ASSI { 701}
(( segid "SUPF" and resid 57 and name HG1 ))
( segid "SUPF" and resid 58 and name HD% )
3.900 1.900 1.900 peak 701 spectrum 1 weight 0.10000E+01 volume 0.66271E-03 ppm1 1.522 ppm2 7.375 CV 1
ASSI { 702}
(( segid "SUPF" and resid 57 and name HG1 ))
( segid "SUPF" and resid 58 and name HE% )
4.000 2.000 2.000 peak 702 spectrum 1 weight 0.10000E+01 volume 0.56416E-03 ppm1 1.530 ppm2 7.005 CV 1
ASSI { 703}
(( segid "SUPF" and resid 57 and name HG1 ))
(( segid "SUPF" and resid 58 and name HZ ))
4.200 2.200 1.800 peak 703 spectrum 1 weight 0.10000E+01 volume 0.41122E-03 ppm1 1.524 ppm2 7.284 CV 1
ASSI { 705}
(( segid "SUPF" and resid 57 and name HG2 ))
(( segid "SUPF" and resid 57 and name HB2 ))
2.900 1.100 1.100 peak 705 spectrum 1 weight 0.10000E+01 volume 0.22483E-02 ppm1 0.209 ppm2 1.581 CV 1
OR { 705}
(( segid "SUPF" and resid 57 and name HG2 ))
(( segid "SUPF" and resid 57 and name HB1 ))
ASSI { 707}
(( segid "SUPF" and resid 57 and name HG2 ))
( segid "SUPF" and resid 58 and name HD% )
3.600 1.600 1.600 peak 707 spectrum 1 weight 0.10000E+01 volume 0.66235E-03 ppm1 0.204 ppm2 7.372 CV 1
ASSI { 708}
(( segid "SUPF" and resid 57 and name HG2 ))
( segid "SUPF" and resid 58 and name HE% )
3.600 1.600 1.600 peak 708 spectrum 1 weight 0.10000E+01 volume 0.64337E-03 ppm1 0.210 ppm2 7.005 CV 1
ASSI { 709}
(( segid "SUPF" and resid 57 and name HG2 ))
(( segid "SUPF" and resid 58 and name HZ ))
4.400 2.500 1.600 peak 709 spectrum 1 weight 0.10000E+01 volume 0.24774E-03 ppm1 0.211 ppm2 7.286 CV 1
ASSI { 710}
(( segid "SUPF" and resid 58 and name HA ))
(( segid "SUPF" and resid 58 and name HB1 ))
2.700 0.900 0.900 peak 710 spectrum 1 weight 0.10000E+01 volume 0.23009E-02 ppm1 4.708 ppm2 2.900 CV 1
ASSI { 711}
(( segid "SUPF" and resid 58 and name HA ))
(( segid "SUPF" and resid 58 and name HB2 ))
3.100 1.200 1.200 peak 711 spectrum 1 weight 0.10000E+01 volume 0.25076E-02 ppm1 4.708 ppm2 3.647 CV 1
ASSI { 712}
(( segid "SUPF" and resid 58 and name HA ))
( segid "SUPF" and resid 58 and name HD% )
2.500 0.800 0.800 peak 712 spectrum 1 weight 0.10000E+01 volume 0.50828E-02 ppm1 4.708 ppm2 7.375 CV 1
ASSI { 714}
(( segid "SUPF" and resid 58 and name HB1 ))
( segid "SUPF" and resid 58 and name HD% )
2.600 0.800 0.800 peak 714 spectrum 1 weight 0.10000E+01 volume 0.36251E-02 ppm1 2.907 ppm2 7.373 CV 1
ASSI { 717}
(( segid "SUPF" and resid 58 and name HB2 ))
(( segid "SUPF" and resid 58 and name HB1 ))
2.100 0.500 0.500 peak 717 spectrum 1 weight 0.10000E+01 volume 0.45013E-02 ppm1 3.645 ppm2 2.902 CV 1
ASSI { 718}
(( segid "SUPF" and resid 58 and name HB2 ))
( segid "SUPF" and resid 58 and name HD% )
2.600 0.800 0.800 peak 718 spectrum 1 weight 0.10000E+01 volume 0.30340E-02 ppm1 3.647 ppm2 7.374 CV 1
ASSI { 719}
(( segid "SUPF" and resid 58 and name HB2 ))
( segid "SUPF" and resid 83 and name HE% )
2.700 0.900 0.900 peak 719 spectrum 1 weight 0.10000E+01 volume 0.18675E-02 ppm1 3.648 ppm2 1.939 CV 1
ASSI { 720}
(( segid "SUPF" and resid 58 and name HB2 ))
(( segid "SUPF" and resid 91 and name HB1 ))
4.200 2.200 1.800 peak 720 spectrum 1 weight 0.10000E+01 volume 0.76373E-03 ppm1 3.653 ppm2 2.331 CV 1
ASSI { 732}
( segid "SUPF" and resid 58 and name HE% )
( segid "SUPF" and resid 58 and name HD% )
2.500 0.800 0.800 peak 732 spectrum 1 weight 0.10000E+01 volume 0.36034E-02 ppm1 6.999 ppm2 7.375 CV 1
ASSI { 736}
(( segid "SUPF" and resid 58 and name HZ ))
( segid "SUPF" and resid 58 and name HE% )
2.300 0.700 0.700 peak 736 spectrum 1 weight 0.10000E+01 volume 0.76240E-02 ppm1 7.283 ppm2 7.004 CV 1
ASSI { 738}
(( segid "SUPF" and resid 59 and name HA1 ))
(( segid "SUPF" and resid 59 and name HA2 ))
2.000 0.500 0.500 peak 738 spectrum 1 weight 0.10000E+01 volume 0.98340E-02 ppm1 4.534 ppm2 3.855 CV 1
ASSI { 742}
(( segid "SUPF" and resid 59 and name HA2 ))
( segid "SUPF" and resid 83 and name HE% )
4.100 2.100 1.900 peak 742 spectrum 1 weight 0.10000E+01 volume 0.85902E-03 ppm1 3.862 ppm2 1.939 CV 1
ASSI { 743}
(( segid "SUPF" and resid 60 and name HA ))
(( segid "SUPF" and resid 60 and name HB1 ))
2.600 0.900 0.900 peak 743 spectrum 1 weight 0.10000E+01 volume 0.36511E-02 ppm1 4.723 ppm2 2.528 CV 1
ASSI { 744}
(( segid "SUPF" and resid 60 and name HA ))
(( segid "SUPF" and resid 60 and name HB2 ))
2.700 0.900 0.900 peak 744 spectrum 1 weight 0.10000E+01 volume 0.52681E-02 ppm1 4.724 ppm2 2.602 CV 1
ASSI { 745}
(( segid "SUPF" and resid 60 and name HA ))
(( segid "SUPF" and resid 61 and name HG11))
3.400 1.400 1.400 peak 745 spectrum 1 weight 0.10000E+01 volume 0.92401E-03 ppm1 4.717 ppm2 1.483 CV 1
ASSI { 746}
(( segid "SUPF" and resid 60 and name HB1 ))
(( segid "SUPF" and resid 60 and name HB2 ))
1.700 0.400 0.500 peak 746 spectrum 1 weight 0.10000E+01 volume 0.19916E-01 ppm1 2.528 ppm2 2.598 CV 1
ASSI { 749}
(( segid "SUPF" and resid 61 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
3.600 1.600 1.600 peak 749 spectrum 1 weight 0.10000E+01 volume 0.23198E-02 ppm1 4.161 ppm2 0.413 CV 1
ASSI { 750}
(( segid "SUPF" and resid 61 and name HA ))
(( segid "SUPF" and resid 61 and name HG12))
2.500 0.800 0.800 peak 750 spectrum 1 weight 0.10000E+01 volume 0.27243E-02 ppm1 4.149 ppm2 0.989 CV 1
ASSI { 751}
(( segid "SUPF" and resid 61 and name HA ))
( segid "SUPF" and resid 61 and name HG2%)
2.300 0.600 0.600 peak 751 spectrum 1 weight 0.10000E+01 volume 0.61892E-02 ppm1 4.162 ppm2 0.588 CV 1
ASSI { 753}
(( segid "SUPF" and resid 61 and name HA ))
(( segid "SUPF" and resid 83 and name HA ))
2.100 0.500 0.500 peak 753 spectrum 1 weight 0.10000E+01 volume 0.80944E-02 ppm1 4.160 ppm2 5.112 CV 1
ASSI { 754}
(( segid "SUPF" and resid 61 and name HB ))
(( segid "SUPF" and resid 52 and name HD2 ))
3.400 1.400 1.400 peak 754 spectrum 1 weight 0.10000E+01 volume 0.62681E-03 ppm1 1.494 ppm2 7.246 CV 1
ASSI { 755}
(( segid "SUPF" and resid 61 and name HB ))
(( segid "SUPF" and resid 61 and name HA ))
2.700 0.900 0.900 peak 755 spectrum 1 weight 0.10000E+01 volume 0.22886E-02 ppm1 1.497 ppm2 4.161 CV 1
ASSI { 756}
(( segid "SUPF" and resid 61 and name HB ))
( segid "SUPF" and resid 61 and name HD1%)
2.400 0.700 0.700 peak 756 spectrum 1 weight 0.10000E+01 volume 0.54310E-02 ppm1 1.497 ppm2 0.414 CV 1
ASSI { 757}
(( segid "SUPF" and resid 61 and name HB ))
(( segid "SUPF" and resid 61 and name HG12))
2.900 1.100 1.100 peak 757 spectrum 1 weight 0.10000E+01 volume 0.23083E-02 ppm1 1.498 ppm2 0.992 CV 1
ASSI { 758}
(( segid "SUPF" and resid 61 and name HB ))
( segid "SUPF" and resid 61 and name HG2%)
2.100 0.500 0.500 peak 758 spectrum 1 weight 0.10000E+01 volume 0.90305E-02 ppm1 1.496 ppm2 0.589 CV 1
ASSI { 759}
(( segid "SUPF" and resid 61 and name HB ))
(( segid "SUPF" and resid 83 and name HA ))
4.900 3.000 1.100 peak 759 spectrum 1 weight 0.10000E+01 volume 0.38342E-03 ppm1 1.493 ppm2 5.111 CV 1
ASSI { 763}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 52 and name HB1 ))
4.000 2.000 2.000 peak 763 spectrum 1 weight 0.10000E+01 volume 0.74626E-03 ppm1 0.420 ppm2 3.508 CV 1
ASSI { 764}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 52 and name HB2 ))
3.900 1.900 1.900 peak 764 spectrum 1 weight 0.10000E+01 volume 0.72728E-03 ppm1 0.413 ppm2 3.569 CV 1
ASSI { 765}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 52 and name HD2 ))
3.200 1.300 1.300 peak 765 spectrum 1 weight 0.10000E+01 volume 0.13737E-02 ppm1 0.414 ppm2 7.248 CV 1
ASSI { 767}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 55 and name HB1 ))
2.600 0.800 0.800 peak 767 spectrum 1 weight 0.10000E+01 volume 0.40806E-02 ppm1 0.418 ppm2 2.923 CV 1
ASSI { 768}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 55 and name HB2 ))
2.400 0.700 0.700 peak 768 spectrum 1 weight 0.10000E+01 volume 0.33737E-02 ppm1 0.418 ppm2 3.288 CV 1
ASSI { 769}
( segid "SUPF" and resid 61 and name HD1%)
( segid "SUPF" and resid 55 and name HD% )
3.900 1.900 1.900 peak 769 spectrum 1 weight 0.10000E+01 volume 0.14770E-02 ppm1 0.418 ppm2 7.833 CV 1
ASSI { 772}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 56 and name HB2 ))
2.900 1.100 1.100 peak 772 spectrum 1 weight 0.10000E+01 volume 0.13795E-02 ppm1 0.418 ppm2 2.169 CV 1
ASSI { 774}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 56 and name HG2 ))
2.700 0.900 0.900 peak 774 spectrum 1 weight 0.10000E+01 volume 0.16465E-02 ppm1 0.417 ppm2 2.603 CV 1
ASSI { 775}
( segid "SUPF" and resid 61 and name HD1%)
( segid "SUPF" and resid 58 and name HD% )
4.500 2.500 1.500 peak 775 spectrum 1 weight 0.10000E+01 volume 0.40476E-03 ppm1 0.415 ppm2 7.378 CV 1
ASSI { 778}
( segid "SUPF" and resid 61 and name HD1%)
(( segid "SUPF" and resid 61 and name HG12))
2.300 0.600 0.600 peak 778 spectrum 1 weight 0.10000E+01 volume 0.57202E-02 ppm1 0.418 ppm2 0.987 CV 1
ASSI { 780}
( segid "SUPF" and resid 61 and name HD1%)
( segid "SUPF" and resid 83 and name HE% )
3.000 1.100 1.100 peak 780 spectrum 1 weight 0.10000E+01 volume 0.44900E-02 ppm1 0.418 ppm2 1.938 CV 1
ASSI { 782}
( segid "SUPF" and resid 61 and name HG2%)
(( segid "SUPF" and resid 52 and name HD2 ))
2.600 0.900 0.900 peak 782 spectrum 1 weight 0.10000E+01 volume 0.34118E-02 ppm1 0.593 ppm2 7.247 CV 1
ASSI { 785}
( segid "SUPF" and resid 61 and name HG2%)
(( segid "SUPF" and resid 64 and name HA ))
4.100 2.100 1.900 peak 785 spectrum 1 weight 0.10000E+01 volume 0.86884E-03 ppm1 0.592 ppm2 5.182 CV 1
ASSI { 786}
( segid "SUPF" and resid 61 and name HG2%)
(( segid "SUPF" and resid 83 and name HA ))
3.000 1.100 1.100 peak 786 spectrum 1 weight 0.10000E+01 volume 0.16522E-02 ppm1 0.590 ppm2 5.110 CV 1
ASSI { 787}
(( segid "SUPF" and resid 62 and name HA ))
(( segid "SUPF" and resid 62 and name HB1 ))
2.400 0.700 0.700 peak 787 spectrum 1 weight 0.10000E+01 volume 0.54194E-02 ppm1 4.406 ppm2 1.675 CV 1
ASSI { 788}
(( segid "SUPF" and resid 62 and name HA ))
(( segid "SUPF" and resid 62 and name HB2 ))
2.800 1.000 1.000 peak 788 spectrum 1 weight 0.10000E+01 volume 0.45985E-02 ppm1 4.412 ppm2 1.814 CV 1
ASSI { 790}
(( segid "SUPF" and resid 62 and name HA ))
( segid "SUPF" and resid 82 and name HG2%)
4.700 2.800 1.300 peak 790 spectrum 1 weight 0.10000E+01 volume 0.81101E-03 ppm1 4.409 ppm2 1.154 CV 1
ASSI { 792}
(( segid "SUPF" and resid 62 and name HB1 ))
(( segid "SUPF" and resid 62 and name HB2 ))
1.800 0.400 0.400 peak 792 spectrum 1 weight 0.10000E+01 volume 0.12952E-01 ppm1 1.685 ppm2 1.812 CV 1
ASSI { 793}
(( segid "SUPF" and resid 62 and name HB1 ))
(( segid "SUPF" and resid 82 and name HB ))
3.700 1.700 1.700 peak 793 spectrum 1 weight 0.10000E+01 volume 0.21642E-02 ppm1 1.674 ppm2 3.938 CV 1
ASSI { 794}
(( segid "SUPF" and resid 62 and name HB1 ))
( segid "SUPF" and resid 82 and name HG2%)
3.600 1.600 1.600 peak 794 spectrum 1 weight 0.10000E+01 volume 0.25181E-02 ppm1 1.678 ppm2 1.152 CV 1
ASSI { 796}
(( segid "SUPF" and resid 62 and name HB2 ))
(( segid "SUPF" and resid 82 and name HB ))
2.600 0.800 0.800 peak 796 spectrum 1 weight 0.10000E+01 volume 0.27510E-02 ppm1 1.815 ppm2 3.940 CV 1
ASSI { 797}
(( segid "SUPF" and resid 62 and name HB2 ))
( segid "SUPF" and resid 82 and name HG2%)
2.400 0.700 0.700 peak 797 spectrum 1 weight 0.10000E+01 volume 0.38140E-02 ppm1 1.818 ppm2 1.152 CV 1
ASSI { 798}
(( segid "SUPF" and resid 62 and name HG1 ))
(( segid "SUPF" and resid 62 and name HA ))
2.600 0.900 0.900 peak 798 spectrum 1 weight 0.10000E+01 volume 0.53756E-02 ppm1 2.088 ppm2 4.407 CV 1
OR { 798}
(( segid "SUPF" and resid 62 and name HG2 ))
(( segid "SUPF" and resid 62 and name HA ))
ASSI { 799}
(( segid "SUPF" and resid 62 and name HG2 ))
(( segid "SUPF" and resid 62 and name HB1 ))
2.400 0.700 0.700 peak 799 spectrum 1 weight 0.10000E+01 volume 0.79294E-02 ppm1 2.081 ppm2 1.675 CV 1
OR { 799}
(( segid "SUPF" and resid 62 and name HG1 ))
(( segid "SUPF" and resid 62 and name HB1 ))
ASSI { 800}
(( segid "SUPF" and resid 62 and name HG2 ))
(( segid "SUPF" and resid 62 and name HB2 ))
2.200 0.600 0.600 peak 800 spectrum 1 weight 0.10000E+01 volume 0.88853E-02 ppm1 2.082 ppm2 1.817 CV 1
OR { 800}
(( segid "SUPF" and resid 62 and name HG1 ))
(( segid "SUPF" and resid 62 and name HB2 ))
ASSI { 801}
(( segid "SUPF" and resid 62 and name HG2 ))
( segid "SUPF" and resid 82 and name HG2%)
2.900 1.100 1.100 peak 801 spectrum 1 weight 0.10000E+01 volume 0.36033E-02 ppm1 2.085 ppm2 1.152 CV 1
OR { 801}
(( segid "SUPF" and resid 62 and name HG1 ))
( segid "SUPF" and resid 82 and name HG2%)
ASSI { 802}
(( segid "SUPF" and resid 62 and name HG1 ))
(( segid "SUPF" and resid 84 and name HA ))
2.500 0.800 0.800 peak 802 spectrum 1 weight 0.10000E+01 volume 0.44993E-02 ppm1 2.088 ppm2 4.101 CV 1
OR { 802}
(( segid "SUPF" and resid 62 and name HG2 ))
(( segid "SUPF" and resid 84 and name HA ))
ASSI { 803}
(( segid "SUPF" and resid 63 and name HA ))
( segid "SUPF" and resid 61 and name HG2%)
2.900 1.000 1.000 peak 803 spectrum 1 weight 0.10000E+01 volume 0.26874E-02 ppm1 4.606 ppm2 0.588 CV 1
ASSI { 805}
(( segid "SUPF" and resid 63 and name HA ))
(( segid "SUPF" and resid 63 and name HG1 ))
2.600 0.800 0.800 peak 805 spectrum 1 weight 0.10000E+01 volume 0.35444E-02 ppm1 4.603 ppm2 2.208 CV 1
ASSI { 806}
(( segid "SUPF" and resid 63 and name HA ))
(( segid "SUPF" and resid 63 and name HG2 ))
2.900 1.000 1.000 peak 806 spectrum 1 weight 0.10000E+01 volume 0.48322E-02 ppm1 4.608 ppm2 2.038 CV 1
ASSI { 807}
(( segid "SUPF" and resid 63 and name HA ))
( segid "SUPF" and resid 64 and name HB% )
4.100 2.100 1.900 peak 807 spectrum 1 weight 0.10000E+01 volume 0.89100E-03 ppm1 4.607 ppm2 1.343 CV 1
ASSI { 808}
(( segid "SUPF" and resid 63 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
4.100 2.100 1.900 peak 808 spectrum 1 weight 0.10000E+01 volume 0.88052E-03 ppm1 4.607 ppm2 0.959 CV 1
ASSI { 809}
(( segid "SUPF" and resid 63 and name HB1 ))
(( segid "SUPF" and resid 63 and name HA ))
2.300 0.700 0.700 peak 809 spectrum 1 weight 0.10000E+01 volume 0.74559E-02 ppm1 2.009 ppm2 4.605 CV 1
OR { 809}
(( segid "SUPF" and resid 63 and name HB2 ))
(( segid "SUPF" and resid 63 and name HA ))
ASSI { 810}
(( segid "SUPF" and resid 63 and name HB1 ))
(( segid "SUPF" and resid 63 and name HG1 ))
2.300 0.700 0.700 peak 810 spectrum 1 weight 0.10000E+01 volume 0.11070E-01 ppm1 2.007 ppm2 2.208 CV 1
OR { 810}
(( segid "SUPF" and resid 63 and name HB2 ))
(( segid "SUPF" and resid 63 and name HG1 ))
ASSI { 811}
(( segid "SUPF" and resid 63 and name HB2 ))
(( segid "SUPF" and resid 64 and name HA ))
4.100 2.100 1.900 peak 811 spectrum 1 weight 0.10000E+01 volume 0.49962E-03 ppm1 2.009 ppm2 5.182 CV 1
OR { 811}
(( segid "SUPF" and resid 63 and name HB1 ))
(( segid "SUPF" and resid 64 and name HA ))
ASSI { 812}
(( segid "SUPF" and resid 63 and name HB2 ))
(( segid "SUPF" and resid 82 and name HB ))
2.600 0.800 0.800 peak 812 spectrum 1 weight 0.10000E+01 volume 0.39457E-02 ppm1 1.996 ppm2 3.938 CV 1
OR { 812}
(( segid "SUPF" and resid 63 and name HB1 ))
(( segid "SUPF" and resid 82 and name HB ))
ASSI { 815}
(( segid "SUPF" and resid 63 and name HG2 ))
(( segid "SUPF" and resid 63 and name HG1 ))
1.800 0.400 0.400 peak 815 spectrum 1 weight 0.10000E+01 volume 0.14619E-01 ppm1 2.068 ppm2 2.208 CV 1
ASSI { 818}
(( segid "SUPF" and resid 64 and name HA ))
( segid "SUPF" and resid 81 and name HG1%)
3.500 1.600 1.600 peak 818 spectrum 1 weight 0.10000E+01 volume 0.26498E-02 ppm1 5.185 ppm2 0.572 CV 1
ASSI { 819}
(( segid "SUPF" and resid 64 and name HA ))
( segid "SUPF" and resid 81 and name HG2%)
3.000 1.100 1.100 peak 819 spectrum 1 weight 0.10000E+01 volume 0.40546E-02 ppm1 5.185 ppm2 0.403 CV 1
ASSI { 822}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 48 and name HA ))
3.200 3.200 2.800 peak 822 spectrum 1 weight 0.10000E+01 volume 0.14995E-02 ppm1 1.339 ppm2 4.014 CV 1
ASSI { 823}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 48 and name HB2 ))
3.800 1.800 1.800 peak 823 spectrum 1 weight 0.10000E+01 volume 0.57203E-03 ppm1 1.340 ppm2 2.763 CV 1
ASSI { 826}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 52 and name HB1 ))
3.700 1.700 1.700 peak 826 spectrum 1 weight 0.10000E+01 volume 0.31993E-02 ppm1 1.346 ppm2 3.508 CV 1
ASSI { 827}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 52 and name HB2 ))
2.600 0.800 0.800 peak 827 spectrum 1 weight 0.10000E+01 volume 0.21024E-02 ppm1 1.326 ppm2 3.566 CV 1
ASSI { 828}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 52 and name HD2 ))
2.300 0.700 0.700 peak 828 spectrum 1 weight 0.10000E+01 volume 0.47763E-02 ppm1 1.346 ppm2 7.247 CV 1
ASSI { 829}
( segid "SUPF" and resid 64 and name HB% )
( segid "SUPF" and resid 55 and name HD% )
4.400 2.400 1.600 peak 829 spectrum 1 weight 0.10000E+01 volume 0.65434E-03 ppm1 1.343 ppm2 7.834 CV 1
ASSI { 830}
( segid "SUPF" and resid 64 and name HB% )
(( segid "SUPF" and resid 64 and name HA ))
2.100 0.500 0.500 peak 830 spectrum 1 weight 0.10000E+01 volume 0.96636E-02 ppm1 1.345 ppm2 5.185 CV 1
ASSI { 831}
(( segid "SUPF" and resid 65 and name HA ))
(( segid "SUPF" and resid 65 and name HB ))
2.300 0.700 0.700 peak 831 spectrum 1 weight 0.10000E+01 volume 0.53290E-02 ppm1 4.711 ppm2 1.966 CV 1
ASSI { 832}
(( segid "SUPF" and resid 65 and name HA ))
( segid "SUPF" and resid 65 and name HG1%)
2.400 0.700 0.700 peak 832 spectrum 1 weight 0.10000E+01 volume 0.88227E-02 ppm1 4.720 ppm2 0.961 CV 1
OR { 832}
(( segid "SUPF" and resid 65 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
ASSI { 833}
(( segid "SUPF" and resid 65 and name HA ))
( segid "SUPF" and resid 66 and name HG2%)
3.800 1.800 1.800 peak 833 spectrum 1 weight 0.10000E+01 volume 0.10386E-02 ppm1 4.712 ppm2 0.635 CV 1
ASSI { 835}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 80 and name HA ))
4.200 2.200 1.800 peak 835 spectrum 1 weight 0.10000E+01 volume 0.70313E-03 ppm1 0.961 ppm2 5.848 CV 1
OR { 835}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 80 and name HA ))
ASSI { 836}
( segid "SUPF" and resid 65 and name HG2%)
( segid "SUPF" and resid 80 and name HD% )
2.900 1.100 1.100 peak 836 spectrum 1 weight 0.10000E+01 volume 0.36900E-02 ppm1 0.960 ppm2 7.165 CV 1
OR { 836}
( segid "SUPF" and resid 65 and name HG1%)
( segid "SUPF" and resid 80 and name HD% )
ASSI { 837}
( segid "SUPF" and resid 65 and name HG2%)
( segid "SUPF" and resid 80 and name HE% )
3.900 1.900 1.900 peak 837 spectrum 1 weight 0.10000E+01 volume 0.15254E-02 ppm1 0.959 ppm2 7.559 CV 1
OR { 837}
( segid "SUPF" and resid 65 and name HG1%)
( segid "SUPF" and resid 80 and name HE% )
ASSI { 838}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 63 and name HG1 ))
2.900 1.100 1.100 peak 838 spectrum 1 weight 0.10000E+01 volume 0.21761E-02 ppm1 0.962 ppm2 2.209 CV 1
ASSI { 839}
( segid "SUPF" and resid 65 and name HG1%)
(( segid "SUPF" and resid 65 and name HB ))
2.100 0.600 0.600 peak 839 spectrum 1 weight 0.10000E+01 volume 0.12587E-01 ppm1 0.962 ppm2 1.965 CV 1
ASSI { 840}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 64 and name HA ))
3.800 1.800 1.800 peak 840 spectrum 1 weight 0.10000E+01 volume 0.15808E-02 ppm1 0.956 ppm2 5.185 CV 1
ASSI { 841}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 80 and name HB1 ))
3.500 1.500 1.500 peak 841 spectrum 1 weight 0.10000E+01 volume 0.26681E-02 ppm1 0.961 ppm2 2.676 CV 1
ASSI { 842}
( segid "SUPF" and resid 65 and name HG2%)
(( segid "SUPF" and resid 80 and name HB2 ))
3.000 1.100 1.100 peak 842 spectrum 1 weight 0.10000E+01 volume 0.17016E-02 ppm1 0.958 ppm2 2.870 CV 1
ASSI { 844}
(( segid "SUPF" and resid 66 and name HA ))
( segid "SUPF" and resid 42 and name HD1%)
3.900 1.900 1.900 peak 844 spectrum 1 weight 0.10000E+01 volume 0.74041E-03 ppm1 3.929 ppm2 0.499 CV 1
ASSI { 845}
(( segid "SUPF" and resid 66 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
3.500 1.500 1.500 peak 845 spectrum 1 weight 0.10000E+01 volume 0.82360E-03 ppm1 3.933 ppm2 0.957 CV 1
ASSI { 846}
(( segid "SUPF" and resid 66 and name HA ))
(( segid "SUPF" and resid 66 and name HB ))
2.900 1.000 1.000 peak 846 spectrum 1 weight 0.10000E+01 volume 0.21327E-02 ppm1 3.931 ppm2 1.877 CV 1
ASSI { 848}
(( segid "SUPF" and resid 66 and name HA ))
( segid "SUPF" and resid 66 and name HG2%)
2.300 0.600 0.600 peak 848 spectrum 1 weight 0.10000E+01 volume 0.69969E-02 ppm1 3.931 ppm2 0.629 CV 1
ASSI { 849}
(( segid "SUPF" and resid 66 and name HA ))
(( segid "SUPF" and resid 67 and name HG11))
4.400 2.500 1.600 peak 849 spectrum 1 weight 0.10000E+01 volume 0.71277E-03 ppm1 3.932 ppm2 1.450 CV 1
OR { 849}
(( segid "SUPF" and resid 66 and name HA ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 850}
(( segid "SUPF" and resid 66 and name HB ))
( segid "SUPF" and resid 66 and name HG1%)
2.200 0.600 0.600 peak 850 spectrum 1 weight 0.10000E+01 volume 0.10711E-01 ppm1 1.879 ppm2 0.759 CV 1
ASSI { 851}
(( segid "SUPF" and resid 66 and name HB ))
( segid "SUPF" and resid 66 and name HG2%)
2.200 0.600 0.600 peak 851 spectrum 1 weight 0.10000E+01 volume 0.99774E-02 ppm1 1.878 ppm2 0.627 CV 1
ASSI { 852}
(( segid "SUPF" and resid 66 and name HB ))
( segid "SUPF" and resid 68 and name HG2%)
3.300 1.400 1.400 peak 852 spectrum 1 weight 0.10000E+01 volume 0.10200E-02 ppm1 1.874 ppm2 0.979 CV 1
ASSI { 853}
( segid "SUPF" and resid 66 and name HG1%)
(( segid "SUPF" and resid 66 and name HA ))
2.300 0.600 0.600 peak 853 spectrum 1 weight 0.10000E+01 volume 0.79716E-02 ppm1 0.760 ppm2 3.934 CV 1
ASSI { 855}
( segid "SUPF" and resid 66 and name HG1%)
(( segid "SUPF" and resid 75 and name HA ))
2.700 0.900 0.900 peak 855 spectrum 1 weight 0.10000E+01 volume 0.33946E-02 ppm1 0.756 ppm2 4.258 CV 1
ASSI { 856}
( segid "SUPF" and resid 66 and name HG1%)
(( segid "SUPF" and resid 75 and name HB2 ))
3.100 1.200 1.200 peak 856 spectrum 1 weight 0.10000E+01 volume 0.33440E-02 ppm1 0.762 ppm2 4.139 CV 1
ASSI { 857}
(( segid "SUPF" and resid 67 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
2.800 1.000 1.000 peak 857 spectrum 1 weight 0.10000E+01 volume 0.45978E-02 ppm1 4.068 ppm2 0.939 CV 1
ASSI { 858}
(( segid "SUPF" and resid 67 and name HA ))
(( segid "SUPF" and resid 67 and name HB ))
3.000 1.100 1.100 peak 858 spectrum 1 weight 0.10000E+01 volume 0.17457E-02 ppm1 4.063 ppm2 1.219 CV 1
ASSI { 860}
(( segid "SUPF" and resid 67 and name HA ))
( segid "SUPF" and resid 67 and name HG2%)
2.400 0.700 0.700 peak 860 spectrum 1 weight 0.10000E+01 volume 0.74590E-02 ppm1 4.067 ppm2 0.846 CV 1
ASSI { 863}
(( segid "SUPF" and resid 67 and name HB ))
(( segid "SUPF" and resid 67 and name HG11))
2.400 0.700 0.700 peak 863 spectrum 1 weight 0.10000E+01 volume 0.45302E-02 ppm1 1.223 ppm2 1.458 CV 1
OR { 863}
(( segid "SUPF" and resid 67 and name HB ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 864}
(( segid "SUPF" and resid 67 and name HB ))
( segid "SUPF" and resid 67 and name HG2%)
2.300 0.600 0.600 peak 864 spectrum 1 weight 0.10000E+01 volume 0.75385E-02 ppm1 1.223 ppm2 0.847 CV 1
ASSI { 866}
(( segid "SUPF" and resid 67 and name HB ))
( segid "SUPF" and resid 78 and name HE% )
3.100 1.200 1.200 peak 866 spectrum 1 weight 0.10000E+01 volume 0.11618E-02 ppm1 1.227 ppm2 6.850 CV 1
ASSI { 867}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 67 and name HA ))
2.100 0.600 0.600 peak 867 spectrum 1 weight 0.10000E+01 volume 0.10211E-01 ppm1 0.918 ppm2 4.069 CV 1
ASSI { 868}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 67 and name HB ))
3.600 1.700 1.700 peak 868 spectrum 1 weight 0.10000E+01 volume 0.18502E-02 ppm1 0.920 ppm2 1.217 CV 1
ASSI { 869}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 67 and name HG11))
2.200 0.600 0.600 peak 869 spectrum 1 weight 0.10000E+01 volume 0.73813E-02 ppm1 0.919 ppm2 1.457 CV 1
ASSI { 870}
( segid "SUPF" and resid 67 and name HD1%)
( segid "SUPF" and resid 78 and name HD% )
4.500 2.600 1.500 peak 870 spectrum 1 weight 0.10000E+01 volume 0.61639E-03 ppm1 0.923 ppm2 6.744 CV 1
ASSI { 871}
( segid "SUPF" and resid 67 and name HD1%)
( segid "SUPF" and resid 78 and name HE% )
4.200 2.200 1.800 peak 871 spectrum 1 weight 0.10000E+01 volume 0.13008E-02 ppm1 0.918 ppm2 6.850 CV 1
ASSI { 872}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 79 and name HA1 ))
4.600 2.600 1.400 peak 872 spectrum 1 weight 0.10000E+01 volume 0.85486E-03 ppm1 0.915 ppm2 4.284 CV 1
ASSI { 873}
( segid "SUPF" and resid 67 and name HD1%)
(( segid "SUPF" and resid 79 and name HA2 ))
4.300 2.300 1.700 peak 873 spectrum 1 weight 0.10000E+01 volume 0.76252E-03 ppm1 0.915 ppm2 3.950 CV 1
ASSI { 874}
( segid "SUPF" and resid 67 and name HD1%)
( segid "SUPF" and resid 80 and name HD% )
2.800 1.000 1.000 peak 874 spectrum 1 weight 0.10000E+01 volume 0.47291E-02 ppm1 0.917 ppm2 7.166 CV 1
ASSI { 875}
( segid "SUPF" and resid 67 and name HD1%)
( segid "SUPF" and resid 80 and name HE% )
3.600 1.700 1.700 peak 875 spectrum 1 weight 0.10000E+01 volume 0.26255E-02 ppm1 0.918 ppm2 7.558 CV 1
ASSI { 876}
(( segid "SUPF" and resid 67 and name HG11))
(( segid "SUPF" and resid 67 and name HA ))
3.200 1.300 1.300 peak 876 spectrum 1 weight 0.10000E+01 volume 0.17510E-02 ppm1 1.460 ppm2 4.075 CV 1
OR { 876}
(( segid "SUPF" and resid 67 and name HG12))
(( segid "SUPF" and resid 67 and name HA ))
ASSI { 877}
(( segid "SUPF" and resid 67 and name HG11))
( segid "SUPF" and resid 78 and name HD% )
3.700 1.700 1.700 peak 877 spectrum 1 weight 0.10000E+01 volume 0.90281E-03 ppm1 1.468 ppm2 6.745 CV 1
OR { 877}
(( segid "SUPF" and resid 67 and name HG12))
( segid "SUPF" and resid 78 and name HD% )
ASSI { 878}
(( segid "SUPF" and resid 67 and name HG12))
( segid "SUPF" and resid 78 and name HE% )
3.100 1.200 1.200 peak 878 spectrum 1 weight 0.10000E+01 volume 0.20485E-02 ppm1 1.463 ppm2 6.851 CV 1
OR { 878}
(( segid "SUPF" and resid 67 and name HG11))
( segid "SUPF" and resid 78 and name HE% )
ASSI { 879}
(( segid "SUPF" and resid 67 and name HG11))
(( segid "SUPF" and resid 79 and name HA2 ))
3.300 1.300 1.300 peak 879 spectrum 1 weight 0.10000E+01 volume 0.12572E-02 ppm1 1.458 ppm2 3.951 CV 1
OR { 879}
(( segid "SUPF" and resid 67 and name HG12))
(( segid "SUPF" and resid 79 and name HA2 ))
ASSI { 880}
(( segid "SUPF" and resid 67 and name HG11))
( segid "SUPF" and resid 80 and name HD% )
2.800 1.000 1.000 peak 880 spectrum 1 weight 0.10000E+01 volume 0.13781E-02 ppm1 1.471 ppm2 7.166 CV 1
OR { 880}
(( segid "SUPF" and resid 67 and name HG12))
( segid "SUPF" and resid 80 and name HD% )
ASSI { 881}
(( segid "SUPF" and resid 67 and name HG12))
( segid "SUPF" and resid 80 and name HE% )
2.700 0.900 0.900 peak 881 spectrum 1 weight 0.10000E+01 volume 0.17833E-02 ppm1 1.464 ppm2 7.556 CV 1
OR { 881}
(( segid "SUPF" and resid 67 and name HG11))
( segid "SUPF" and resid 80 and name HE% )
ASSI { 884}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 67 and name HG12))
2.500 0.800 0.800 peak 884 spectrum 1 weight 0.10000E+01 volume 0.54508E-02 ppm1 0.850 ppm2 1.458 CV 1
OR { 884}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 67 and name HG11))
ASSI { 885}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HB2 ))
3.600 1.600 1.600 peak 885 spectrum 1 weight 0.10000E+01 volume 0.10561E-02 ppm1 0.855 ppm2 2.207 CV 1
ASSI { 886}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HD1 ))
3.000 1.100 1.100 peak 886 spectrum 1 weight 0.10000E+01 volume 0.25039E-02 ppm1 0.850 ppm2 3.171 CV 1
ASSI { 887}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HD2 ))
2.800 1.000 1.000 peak 887 spectrum 1 weight 0.10000E+01 volume 0.22764E-02 ppm1 0.852 ppm2 3.248 CV 1
ASSI { 888}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HG1 ))
3.400 1.400 1.400 peak 888 spectrum 1 weight 0.10000E+01 volume 0.13523E-02 ppm1 0.852 ppm2 1.623 CV 1
OR { 888}
( segid "SUPF" and resid 67 and name HG2%)
(( segid "SUPF" and resid 76 and name HG2 ))
ASSI { 889}
( segid "SUPF" and resid 67 and name HG2%)
( segid "SUPF" and resid 78 and name HD% )
4.300 2.300 1.700 peak 889 spectrum 1 weight 0.10000E+01 volume 0.67982E-03 ppm1 0.851 ppm2 6.744 CV 1
ASSI { 890}
( segid "SUPF" and resid 67 and name HG2%)
( segid "SUPF" and resid 78 and name HE% )
3.200 1.300 1.300 peak 890 spectrum 1 weight 0.10000E+01 volume 0.27496E-02 ppm1 0.850 ppm2 6.852 CV 1
ASSI { 891}
( segid "SUPF" and resid 67 and name HG2%)
( segid "SUPF" and resid 80 and name HD% )
5.000 3.100 1.000 peak 891 spectrum 1 weight 0.10000E+01 volume 0.66247E-03 ppm1 0.850 ppm2 7.163 CV 1
ASSI { 892}
( segid "SUPF" and resid 67 and name HG2%)
( segid "SUPF" and resid 80 and name HE% )
4.200 2.200 1.800 peak 892 spectrum 1 weight 0.10000E+01 volume 0.69482E-03 ppm1 0.853 ppm2 7.555 CV 1
ASSI { 893}
(( segid "SUPF" and resid 68 and name HA ))
(( segid "SUPF" and resid 75 and name HA ))
2.100 0.600 0.600 peak 893 spectrum 1 weight 0.10000E+01 volume 0.89618E-02 ppm1 4.792 ppm2 4.255 CV 1
ASSI { 894}
(( segid "SUPF" and resid 68 and name HA ))
( segid "SUPF" and resid 66 and name HG1%)
3.600 1.600 1.600 peak 894 spectrum 1 weight 0.10000E+01 volume 0.85570E-03 ppm1 4.792 ppm2 0.758 CV 1
ASSI { 895}
(( segid "SUPF" and resid 68 and name HA ))
(( segid "SUPF" and resid 68 and name HB ))
2.200 0.600 0.600 peak 895 spectrum 1 weight 0.10000E+01 volume 0.74246E-02 ppm1 4.792 ppm2 3.713 CV 1
ASSI { 896}
(( segid "SUPF" and resid 68 and name HA ))
( segid "SUPF" and resid 68 and name HG2%)
2.300 0.600 0.600 peak 896 spectrum 1 weight 0.10000E+01 volume 0.94594E-02 ppm1 4.785 ppm2 0.979 CV 1
ASSI { 897}
(( segid "SUPF" and resid 68 and name HA ))
(( segid "SUPF" and resid 76 and name HG1 ))
2.800 1.000 1.000 peak 897 spectrum 1 weight 0.10000E+01 volume 0.10450E-02 ppm1 4.794 ppm2 1.634 CV 1
ASSI { 898}
(( segid "SUPF" and resid 68 and name HA ))
(( segid "SUPF" and resid 76 and name HG2 ))
4.100 2.100 1.900 peak 898 spectrum 1 weight 0.10000E+01 volume 0.13255E-02 ppm1 4.792 ppm2 1.588 CV 1
ASSI { 900}
(( segid "SUPF" and resid 68 and name HB ))
(( segid "SUPF" and resid 73 and name HA ))
2.500 0.800 0.800 peak 900 spectrum 1 weight 0.10000E+01 volume 0.39336E-02 ppm1 3.715 ppm2 3.977 CV 1
ASSI { 901}
(( segid "SUPF" and resid 68 and name HB ))
(( segid "SUPF" and resid 75 and name HA ))
3.400 1.500 1.500 peak 901 spectrum 1 weight 0.10000E+01 volume 0.16221E-02 ppm1 3.716 ppm2 4.257 CV 1
ASSI { 903}
( segid "SUPF" and resid 68 and name HG2%)
(( segid "SUPF" and resid 68 and name HB ))
2.100 0.500 0.500 peak 903 spectrum 1 weight 0.10000E+01 volume 0.13305E-01 ppm1 0.983 ppm2 3.713 CV 1
ASSI { 904}
( segid "SUPF" and resid 68 and name HG2%)
(( segid "SUPF" and resid 75 and name HA ))
2.200 0.600 0.600 peak 904 spectrum 1 weight 0.10000E+01 volume 0.79541E-02 ppm1 0.983 ppm2 4.255 CV 1
ASSI { 905}
(( segid "SUPF" and resid 69 and name HA ))
( segid "SUPF" and resid 67 and name HG2%)
3.700 1.700 1.700 peak 905 spectrum 1 weight 0.10000E+01 volume 0.58051E-03 ppm1 4.613 ppm2 0.850 CV 1
ASSI { 906}
(( segid "SUPF" and resid 69 and name HA ))
(( segid "SUPF" and resid 69 and name HB1 ))
2.500 0.800 0.800 peak 906 spectrum 1 weight 0.10000E+01 volume 0.61031E-02 ppm1 4.605 ppm2 2.489 CV 1
ASSI { 907}
(( segid "SUPF" and resid 69 and name HA ))
(( segid "SUPF" and resid 69 and name HB2 ))
2.600 0.900 0.900 peak 907 spectrum 1 weight 0.10000E+01 volume 0.44277E-02 ppm1 4.610 ppm2 3.106 CV 1
ASSI { 909}
(( segid "SUPF" and resid 69 and name HB1 ))
(( segid "SUPF" and resid 69 and name HB2 ))
1.800 0.400 0.400 peak 909 spectrum 1 weight 0.10000E+01 volume 0.15340E-01 ppm1 2.488 ppm2 3.107 CV 1
ASSI { 911}
(( segid "SUPF" and resid 70 and name HB1 ))
(( segid "SUPF" and resid 70 and name HA ))
2.200 0.600 0.600 peak 911 spectrum 1 weight 0.10000E+01 volume 0.11634E-01 ppm1 1.901 ppm2 4.091 CV 1
OR { 911}
(( segid "SUPF" and resid 70 and name HB2 ))
(( segid "SUPF" and resid 70 and name HA ))
ASSI { 912}
(( segid "SUPF" and resid 70 and name HB2 ))
(( segid "SUPF" and resid 70 and name HD2 ))
2.600 0.900 0.900 peak 912 spectrum 1 weight 0.10000E+01 volume 0.44503E-02 ppm1 1.902 ppm2 3.249 CV 1
OR { 912}
(( segid "SUPF" and resid 70 and name HB1 ))
(( segid "SUPF" and resid 70 and name HD1 ))
OR { 912}
(( segid "SUPF" and resid 70 and name HB1 ))
(( segid "SUPF" and resid 70 and name HD2 ))
OR { 912}
(( segid "SUPF" and resid 70 and name HB2 ))
(( segid "SUPF" and resid 70 and name HD1 ))
ASSI { 913}
(( segid "SUPF" and resid 70 and name HG1 ))
(( segid "SUPF" and resid 70 and name HA ))
2.500 0.800 0.800 peak 913 spectrum 1 weight 0.10000E+01 volume 0.49735E-02 ppm1 1.711 ppm2 4.090 CV 1
OR { 913}
(( segid "SUPF" and resid 70 and name HG2 ))
(( segid "SUPF" and resid 70 and name HA ))
ASSI { 914}
(( segid "SUPF" and resid 70 and name HG1 ))
(( segid "SUPF" and resid 70 and name HD1 ))
2.200 0.600 0.600 peak 914 spectrum 1 weight 0.10000E+01 volume 0.10317E-01 ppm1 1.712 ppm2 3.246 CV 1
OR { 914}
(( segid "SUPF" and resid 70 and name HG2 ))
(( segid "SUPF" and resid 70 and name HD2 ))
OR { 914}
(( segid "SUPF" and resid 70 and name HG1 ))
(( segid "SUPF" and resid 70 and name HD2 ))
OR { 914}
(( segid "SUPF" and resid 70 and name HG2 ))
(( segid "SUPF" and resid 70 and name HD1 ))
ASSI { 915}
(( segid "SUPF" and resid 71 and name HA ))
(( segid "SUPF" and resid 71 and name HB1 ))
2.700 0.900 0.900 peak 915 spectrum 1 weight 0.10000E+01 volume 0.35179E-02 ppm1 4.742 ppm2 3.009 CV 1
ASSI { 916}
(( segid "SUPF" and resid 71 and name HA ))
(( segid "SUPF" and resid 71 and name HB2 ))
2.700 0.900 0.900 peak 916 spectrum 1 weight 0.10000E+01 volume 0.60976E-02 ppm1 4.739 ppm2 2.868 CV 1
ASSI { 917}
(( segid "SUPF" and resid 71 and name HB1 ))
( segid "SUPF" and resid 72 and name HG2%)
2.900 1.000 1.000 peak 917 spectrum 1 weight 0.10000E+01 volume 0.28581E-02 ppm1 3.013 ppm2 1.199 CV 1
ASSI { 918}
(( segid "SUPF" and resid 71 and name HB2 ))
( segid "SUPF" and resid 72 and name HG2%)
3.100 1.200 1.200 peak 918 spectrum 1 weight 0.10000E+01 volume 0.22846E-02 ppm1 2.869 ppm2 1.199 CV 1
ASSI { 919}
(( segid "SUPF" and resid 72 and name HA ))
( segid "SUPF" and resid 72 and name HG2%)
2.200 0.600 0.600 peak 919 spectrum 1 weight 0.10000E+01 volume 0.15178E-01 ppm1 4.385 ppm2 1.200 CV 1
ASSI { 920}
(( segid "SUPF" and resid 72 and name HB ))
( segid "SUPF" and resid 72 and name HG2%)
2.100 0.500 0.500 peak 920 spectrum 1 weight 0.10000E+01 volume 0.15708E-01 ppm1 4.345 ppm2 1.200 CV 1
ASSI { 922}
(( segid "SUPF" and resid 72 and name HB ))
(( segid "SUPF" and resid 74 and name HB2 ))
4.000 2.000 2.000 peak 922 spectrum 1 weight 0.10000E+01 volume 0.52863E-03 ppm1 4.353 ppm2 1.821 CV 1
ASSI { 924}
(( segid "SUPF" and resid 72 and name HB ))
(( segid "SUPF" and resid 74 and name HG2 ))
2.700 0.900 0.900 peak 924 spectrum 1 weight 0.10000E+01 volume 0.26756E-02 ppm1 4.344 ppm2 1.434 CV 1
OR { 924}
(( segid "SUPF" and resid 72 and name HB ))
(( segid "SUPF" and resid 74 and name HG1 ))
ASSI { 930}
(( segid "SUPF" and resid 73 and name HA ))
( segid "SUPF" and resid 68 and name HG2%)
3.200 1.300 1.300 peak 930 spectrum 1 weight 0.10000E+01 volume 0.28234E-02 ppm1 3.979 ppm2 0.979 CV 1
ASSI { 931}
(( segid "SUPF" and resid 73 and name HA ))
(( segid "SUPF" and resid 73 and name HB2 ))
2.400 0.700 0.700 peak 931 spectrum 1 weight 0.10000E+01 volume 0.75324E-02 ppm1 3.978 ppm2 2.370 CV 1
OR { 931}
(( segid "SUPF" and resid 73 and name HA ))
(( segid "SUPF" and resid 73 and name HB1 ))
ASSI { 932}
(( segid "SUPF" and resid 73 and name HA ))
(( segid "SUPF" and resid 73 and name HG2 ))
2.600 0.800 0.800 peak 932 spectrum 1 weight 0.10000E+01 volume 0.62091E-02 ppm1 3.977 ppm2 2.298 CV 1
OR { 932}
(( segid "SUPF" and resid 73 and name HA ))
(( segid "SUPF" and resid 73 and name HG1 ))
ASSI { 933}
(( segid "SUPF" and resid 73 and name HB2 ))
(( segid "SUPF" and resid 68 and name HB ))
3.900 1.900 1.900 peak 933 spectrum 1 weight 0.10000E+01 volume 0.63380E-03 ppm1 2.377 ppm2 3.711 CV 1
OR { 933}
(( segid "SUPF" and resid 73 and name HB1 ))
(( segid "SUPF" and resid 68 and name HB ))
ASSI { 934}
(( segid "SUPF" and resid 73 and name HB2 ))
( segid "SUPF" and resid 68 and name HG2%)
3.800 1.800 1.800 peak 934 spectrum 1 weight 0.10000E+01 volume 0.76529E-03 ppm1 2.357 ppm2 0.981 CV 1
OR { 934}
(( segid "SUPF" and resid 73 and name HB1 ))
( segid "SUPF" and resid 68 and name HG2%)
ASSI { 935}
(( segid "SUPF" and resid 73 and name HB1 ))
(( segid "SUPF" and resid 72 and name HA ))
3.800 1.800 1.800 peak 935 spectrum 1 weight 0.10000E+01 volume 0.56263E-03 ppm1 2.370 ppm2 4.397 CV 1
OR { 935}
(( segid "SUPF" and resid 73 and name HB2 ))
(( segid "SUPF" and resid 72 and name HA ))
ASSI { 937}
(( segid "SUPF" and resid 73 and name HB2 ))
(( segid "SUPF" and resid 73 and name HG1 ))
2.000 0.500 0.500 peak 937 spectrum 1 weight 0.10000E+01 volume 0.20123E-01 ppm1 2.377 ppm2 2.300 CV 1
OR { 937}
(( segid "SUPF" and resid 73 and name HB1 ))
(( segid "SUPF" and resid 73 and name HG2 ))
OR { 937}
(( segid "SUPF" and resid 73 and name HB1 ))
(( segid "SUPF" and resid 73 and name HG1 ))
OR { 937}
(( segid "SUPF" and resid 73 and name HB2 ))
(( segid "SUPF" and resid 73 and name HG2 ))
ASSI { 939}
(( segid "SUPF" and resid 74 and name HA ))
( segid "SUPF" and resid 68 and name HG2%)
3.400 1.400 1.400 peak 939 spectrum 1 weight 0.10000E+01 volume 0.13537E-02 ppm1 4.413 ppm2 0.979 CV 1
ASSI { 941}
(( segid "SUPF" and resid 74 and name HA ))
(( segid "SUPF" and resid 74 and name HG1 ))
2.500 0.800 0.800 peak 941 spectrum 1 weight 0.10000E+01 volume 0.56450E-02 ppm1 4.414 ppm2 1.433 CV 1
OR { 941}
(( segid "SUPF" and resid 74 and name HA ))
(( segid "SUPF" and resid 74 and name HG2 ))
ASSI { 942}
(( segid "SUPF" and resid 74 and name HB1 ))
(( segid "SUPF" and resid 74 and name HA ))
2.500 0.800 0.800 peak 942 spectrum 1 weight 0.10000E+01 volume 0.43998E-02 ppm1 1.651 ppm2 4.413 CV 1
ASSI { 943}
(( segid "SUPF" and resid 74 and name HB2 ))
(( segid "SUPF" and resid 74 and name HA ))
2.600 0.800 0.800 peak 943 spectrum 1 weight 0.10000E+01 volume 0.58745E-02 ppm1 1.833 ppm2 4.412 CV 1
ASSI { 944}
(( segid "SUPF" and resid 74 and name HD2 ))
(( segid "SUPF" and resid 74 and name HA ))
3.400 1.500 1.500 peak 944 spectrum 1 weight 0.10000E+01 volume 0.27260E-02 ppm1 1.597 ppm2 4.412 CV 1
OR { 944}
(( segid "SUPF" and resid 74 and name HD1 ))
(( segid "SUPF" and resid 74 and name HA ))
ASSI { 947}
(( segid "SUPF" and resid 74 and name HG1 ))
(( segid "SUPF" and resid 74 and name HE1 ))
3.000 1.100 1.100 peak 947 spectrum 1 weight 0.10000E+01 volume 0.21084E-02 ppm1 1.430 ppm2 2.847 CV 1
OR { 947}
(( segid "SUPF" and resid 74 and name HG2 ))
(( segid "SUPF" and resid 74 and name HE1 ))
ASSI { 948}
(( segid "SUPF" and resid 74 and name HG1 ))
(( segid "SUPF" and resid 74 and name HE2 ))
3.000 1.200 1.200 peak 948 spectrum 1 weight 0.10000E+01 volume 0.21814E-02 ppm1 1.430 ppm2 2.906 CV 1
OR { 948}
(( segid "SUPF" and resid 74 and name HG2 ))
(( segid "SUPF" and resid 74 and name HE2 ))
ASSI { 952}
(( segid "SUPF" and resid 75 and name HA ))
(( segid "SUPF" and resid 75 and name HB1 ))
2.500 0.800 0.800 peak 952 spectrum 1 weight 0.10000E+01 volume 0.34034E-02 ppm1 4.255 ppm2 3.948 CV 1
ASSI { 954}
(( segid "SUPF" and resid 75 and name HB1 ))
(( segid "SUPF" and resid 44 and name HB2 ))
5.000 3.100 1.000 peak 954 spectrum 1 weight 0.10000E+01 volume 0.50924E-03 ppm1 3.957 ppm2 3.014 CV 1
ASSI { 956}
(( segid "SUPF" and resid 75 and name HB1 ))
( segid "SUPF" and resid 44 and name HE% )
5.000 3.100 1.000 peak 956 spectrum 1 weight 0.10000E+01 volume 0.25495E-03 ppm1 3.945 ppm2 6.822 CV 1
ASSI { 957}
(( segid "SUPF" and resid 75 and name HB1 ))
( segid "SUPF" and resid 66 and name HG1%)
3.000 1.100 1.100 peak 957 spectrum 1 weight 0.10000E+01 volume 0.14572E-02 ppm1 3.949 ppm2 0.756 CV 1
ASSI { 958}
(( segid "SUPF" and resid 75 and name HB1 ))
( segid "SUPF" and resid 68 and name HG2%)
4.200 2.200 1.800 peak 958 spectrum 1 weight 0.10000E+01 volume 0.77258E-03 ppm1 3.949 ppm2 0.981 CV 1
ASSI { 960}
(( segid "SUPF" and resid 75 and name HB1 ))
(( segid "SUPF" and resid 75 and name HB2 ))
1.800 0.400 0.400 peak 960 spectrum 1 weight 0.10000E+01 volume 0.12060E-01 ppm1 3.946 ppm2 4.139 CV 1
ASSI { 962}
(( segid "SUPF" and resid 75 and name HB2 ))
( segid "SUPF" and resid 44 and name HD% )
3.500 1.600 1.600 peak 962 spectrum 1 weight 0.10000E+01 volume 0.86058E-03 ppm1 4.145 ppm2 7.161 CV 1
ASSI { 964}
(( segid "SUPF" and resid 75 and name HB2 ))
( segid "SUPF" and resid 68 and name HG2%)
4.000 2.000 2.000 peak 964 spectrum 1 weight 0.10000E+01 volume 0.15441E-02 ppm1 4.140 ppm2 0.980 CV 1
ASSI { 965}
(( segid "SUPF" and resid 75 and name HB2 ))
(( segid "SUPF" and resid 75 and name HA ))
2.600 0.800 0.800 peak 965 spectrum 1 weight 0.10000E+01 volume 0.44816E-02 ppm1 4.134 ppm2 4.255 CV 1
ASSI { 967}
(( segid "SUPF" and resid 76 and name HA ))
( segid "SUPF" and resid 44 and name HE% )
3.400 3.400 2.600 peak 967 spectrum 1 weight 0.10000E+01 volume 0.10345E-02 ppm1 4.514 ppm2 6.824 CV 1
ASSI { 970}
(( segid "SUPF" and resid 76 and name HB1 ))
(( segid "SUPF" and resid 76 and name HD1 ))
3.400 1.400 1.400 peak 970 spectrum 1 weight 0.10000E+01 volume 0.64428E-03 ppm1 1.230 ppm2 3.171 CV 1
ASSI { 971}
(( segid "SUPF" and resid 76 and name HB1 ))
(( segid "SUPF" and resid 76 and name HD2 ))
3.600 1.600 1.600 peak 971 spectrum 1 weight 0.10000E+01 volume 0.10426E-02 ppm1 1.225 ppm2 3.248 CV 1
ASSI { 972}
(( segid "SUPF" and resid 76 and name HB1 ))
( segid "SUPF" and resid 78 and name HD% )
3.600 1.600 1.600 peak 972 spectrum 1 weight 0.10000E+01 volume 0.81842E-03 ppm1 1.238 ppm2 6.743 CV 1
ASSI { 974}
(( segid "SUPF" and resid 76 and name HB2 ))
(( segid "SUPF" and resid 76 and name HA ))
3.000 1.100 1.100 peak 974 spectrum 1 weight 0.10000E+01 volume 0.32452E-02 ppm1 2.211 ppm2 4.512 CV 1
ASSI { 975}
(( segid "SUPF" and resid 76 and name HB2 ))
(( segid "SUPF" and resid 76 and name HD1 ))
3.400 1.400 1.400 peak 975 spectrum 1 weight 0.10000E+01 volume 0.72355E-03 ppm1 2.213 ppm2 3.170 CV 1
ASSI { 978}
(( segid "SUPF" and resid 76 and name HB2 ))
( segid "SUPF" and resid 78 and name HE% )
3.000 1.100 1.100 peak 978 spectrum 1 weight 0.10000E+01 volume 0.19235E-02 ppm1 2.212 ppm2 6.853 CV 1
ASSI { 979}
(( segid "SUPF" and resid 76 and name HD2 ))
( segid "SUPF" and resid 78 and name HE% )
3.400 1.500 1.500 peak 979 spectrum 1 weight 0.10000E+01 volume 0.13873E-02 ppm1 3.232 ppm2 6.854 CV 1
ASSI { 980}
(( segid "SUPF" and resid 76 and name HG2 ))
( segid "SUPF" and resid 78 and name HE% )
4.200 2.200 1.800 peak 980 spectrum 1 weight 0.10000E+01 volume 0.87908E-03 ppm1 1.607 ppm2 6.850 CV 1
OR { 980}
(( segid "SUPF" and resid 76 and name HG1 ))
( segid "SUPF" and resid 78 and name HE% )
ASSI { 981}
(( segid "SUPF" and resid 77 and name HA1 ))
(( segid "SUPF" and resid 42 and name HB1 ))
4.800 2.900 1.200 peak 981 spectrum 1 weight 0.10000E+01 volume 0.56942E-03 ppm1 3.293 ppm2 1.266 CV 1
ASSI { 983}
(( segid "SUPF" and resid 77 and name HA1 ))
( segid "SUPF" and resid 42 and name HD1%)
5.000 3.100 1.000 peak 983 spectrum 1 weight 0.10000E+01 volume 0.38460E-03 ppm1 3.285 ppm2 0.496 CV 1
ASSI { 984}
(( segid "SUPF" and resid 77 and name HA1 ))
( segid "SUPF" and resid 44 and name HD% )
4.100 2.100 1.900 peak 984 spectrum 1 weight 0.10000E+01 volume 0.40095E-03 ppm1 3.280 ppm2 7.158 CV 1
ASSI { 985}
(( segid "SUPF" and resid 77 and name HA1 ))
( segid "SUPF" and resid 44 and name HE% )
3.700 1.700 1.700 peak 985 spectrum 1 weight 0.10000E+01 volume 0.41834E-03 ppm1 3.285 ppm2 6.823 CV 1
ASSI { 987}
(( segid "SUPF" and resid 77 and name HA2 ))
(( segid "SUPF" and resid 42 and name HB1 ))
3.800 1.800 1.800 peak 987 spectrum 1 weight 0.10000E+01 volume 0.71415E-03 ppm1 4.077 ppm2 1.265 CV 1
ASSI { 989}
(( segid "SUPF" and resid 77 and name HA2 ))
( segid "SUPF" and resid 42 and name HD1%)
4.300 2.300 1.700 peak 989 spectrum 1 weight 0.10000E+01 volume 0.50654E-03 ppm1 4.068 ppm2 0.496 CV 1
ASSI { 990}
(( segid "SUPF" and resid 77 and name HA2 ))
( segid "SUPF" and resid 44 and name HD% )
3.700 1.700 1.700 peak 990 spectrum 1 weight 0.10000E+01 volume 0.50886E-03 ppm1 4.073 ppm2 7.158 CV 1
ASSI { 991}
(( segid "SUPF" and resid 77 and name HA2 ))
( segid "SUPF" and resid 44 and name HE% )
3.100 3.100 2.900 peak 991 spectrum 1 weight 0.10000E+01 volume 0.69102E-03 ppm1 4.079 ppm2 6.822 CV 1
ASSI { 992}
(( segid "SUPF" and resid 77 and name HA2 ))
(( segid "SUPF" and resid 77 and name HA1 ))
2.100 0.500 0.500 peak 992 spectrum 1 weight 0.10000E+01 volume 0.67928E-02 ppm1 4.082 ppm2 3.288 CV 1
ASSI { 993}
(( segid "SUPF" and resid 78 and name HA ))
( segid "SUPF" and resid 38 and name HE% )
4.100 2.100 1.900 peak 993 spectrum 1 weight 0.10000E+01 volume 0.97178E-03 ppm1 5.195 ppm2 6.919 CV 1
ASSI { 994}
(( segid "SUPF" and resid 78 and name HA ))
( segid "SUPF" and resid 39 and name HG1%)
4.700 2.700 1.300 peak 994 spectrum 1 weight 0.10000E+01 volume 0.45224E-03 ppm1 5.203 ppm2 0.748 CV 1
ASSI { 995}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 40 and name HA1 ))
4.300 2.300 1.700 peak 995 spectrum 1 weight 0.10000E+01 volume 0.13276E-02 ppm1 5.195 ppm2 3.749 CV 1
ASSI { 996}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 40 and name HA2 ))
2.900 1.000 1.000 peak 996 spectrum 1 weight 0.10000E+01 volume 0.18669E-02 ppm1 5.194 ppm2 4.601 CV 1
ASSI { 997}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 42 and name HB1 ))
4.000 2.000 2.000 peak 997 spectrum 1 weight 0.10000E+01 volume 0.15458E-02 ppm1 5.192 ppm2 1.267 CV 1
ASSI { 1000}
(( segid "SUPF" and resid 78 and name HA ))
( segid "SUPF" and resid 42 and name HD2%)
3.100 1.200 1.200 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.70114E-03 ppm1 5.194 ppm2 0.643 CV 1
ASSI { 1002}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 78 and name HB1 ))
2.500 0.800 0.800 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.35146E-02 ppm1 5.193 ppm2 2.948 CV 1
ASSI { 1003}
(( segid "SUPF" and resid 78 and name HA ))
(( segid "SUPF" and resid 78 and name HB2 ))
2.400 0.700 0.700 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.37623E-02 ppm1 5.194 ppm2 3.227 CV 1
ASSI { 1004}
(( segid "SUPF" and resid 78 and name HA ))
( segid "SUPF" and resid 78 and name HD% )
3.600 1.700 1.700 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.15173E-02 ppm1 5.195 ppm2 6.742 CV 1
ASSI { 1005}
(( segid "SUPF" and resid 78 and name HB1 ))
( segid "SUPF" and resid 38 and name HE% )
3.300 1.400 1.400 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.20724E-02 ppm1 2.967 ppm2 6.917 CV 1
ASSI { 1007}
(( segid "SUPF" and resid 78 and name HB1 ))
( segid "SUPF" and resid 78 and name HD% )
2.700 0.900 0.900 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.24844E-02 ppm1 2.952 ppm2 6.744 CV 1
ASSI { 1008}
(( segid "SUPF" and resid 78 and name HB2 ))
( segid "SUPF" and resid 38 and name HD% )
4.000 2.000 2.000 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.38709E-03 ppm1 3.243 ppm2 6.994 CV 1
ASSI { 1009}
(( segid "SUPF" and resid 78 and name HB2 ))
( segid "SUPF" and resid 38 and name HE% )
3.200 1.300 1.300 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.11003E-02 ppm1 3.219 ppm2 6.919 CV 1
ASSI { 1012}
( segid "SUPF" and resid 78 and name HD% )
( segid "SUPF" and resid 38 and name HD% )
3.100 1.200 1.200 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.20837E-02 ppm1 6.749 ppm2 6.990 CV 1
ASSI { 1013}
( segid "SUPF" and resid 78 and name HD% )
( segid "SUPF" and resid 38 and name HE% )
2.700 0.900 0.900 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.37336E-02 ppm1 6.745 ppm2 6.918 CV 1
ASSI { 1014}
( segid "SUPF" and resid 78 and name HD% )
(( segid "SUPF" and resid 67 and name HB ))
3.500 1.500 1.500 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.99955E-03 ppm1 6.740 ppm2 1.219 CV 1
ASSI { 1017}
( segid "SUPF" and resid 78 and name HD% )
(( segid "SUPF" and resid 76 and name HB2 ))
3.300 1.400 1.400 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.97985E-03 ppm1 6.741 ppm2 2.213 CV 1
ASSI { 1020}
( segid "SUPF" and resid 78 and name HD% )
(( segid "SUPF" and resid 78 and name HB2 ))
2.600 0.900 0.900 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.32119E-02 ppm1 6.743 ppm2 3.231 CV 1
ASSI { 1021}
( segid "SUPF" and resid 78 and name HD% )
( segid "SUPF" and resid 78 and name HE% )
2.100 0.500 0.500 peak 1021 spectrum 1 weight 0.10000E+01 volume 0.11034E-01 ppm1 6.743 ppm2 6.852 CV 1
ASSI { 1022}
( segid "SUPF" and resid 78 and name HD% )
( segid "SUPF" and resid 80 and name HE% )
3.900 1.900 1.900 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.10712E-02 ppm1 6.742 ppm2 7.558 CV 1
ASSI { 1027}
( segid "SUPF" and resid 78 and name HE% )
(( segid "SUPF" and resid 76 and name HA ))
3.100 3.100 2.900 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.73313E-03 ppm1 6.838 ppm2 4.512 CV 1
ASSI { 1028}
( segid "SUPF" and resid 78 and name HE% )
(( segid "SUPF" and resid 76 and name HB1 ))
2.800 1.000 1.000 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.16168E-02 ppm1 6.847 ppm2 1.219 CV 1
ASSI { 1030}
( segid "SUPF" and resid 78 and name HE% )
(( segid "SUPF" and resid 78 and name HB2 ))
3.800 1.800 1.800 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.14759E-02 ppm1 6.838 ppm2 3.240 CV 1
ASSI { 1031}
( segid "SUPF" and resid 78 and name HE% )
( segid "SUPF" and resid 80 and name HE% )
2.600 0.800 0.800 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.25856E-02 ppm1 6.850 ppm2 7.560 CV 1
ASSI { 1032}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 51 and name HD1%)
4.100 2.100 1.900 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.63838E-03 ppm1 4.300 ppm2 0.841 CV 1
ASSI { 1033}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 42 and name HD1%)
3.600 1.600 1.600 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.42335E-03 ppm1 4.287 ppm2 0.500 CV 1
ASSI { 1034}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 65 and name HG2%)
4.300 2.300 1.700 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.47572E-03 ppm1 4.289 ppm2 0.946 CV 1
ASSI { 1035}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 66 and name HG1%)
3.800 1.800 1.800 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.56842E-03 ppm1 4.298 ppm2 0.756 CV 1
ASSI { 1036}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 66 and name HG2%)
3.300 1.300 1.300 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.65223E-03 ppm1 4.289 ppm2 0.638 CV 1
ASSI { 1037}
(( segid "SUPF" and resid 79 and name HA1 ))
(( segid "SUPF" and resid 67 and name HG11))
4.100 2.100 1.900 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.15606E-02 ppm1 4.295 ppm2 1.455 CV 1
OR { 1037}
(( segid "SUPF" and resid 79 and name HA1 ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 1038}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 78 and name HD% )
4.500 2.600 1.500 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.36760E-03 ppm1 4.299 ppm2 6.744 CV 1
ASSI { 1039}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 78 and name HE% )
5.300 3.600 0.700 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.21041E-03 ppm1 4.299 ppm2 6.850 CV 1
ASSI { 1040}
(( segid "SUPF" and resid 79 and name HA1 ))
(( segid "SUPF" and resid 79 and name HA2 ))
1.800 0.400 0.400 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.73915E-02 ppm1 4.290 ppm2 3.948 CV 1
ASSI { 1041}
(( segid "SUPF" and resid 79 and name HA1 ))
( segid "SUPF" and resid 80 and name HD% )
4.800 2.800 1.200 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.40927E-03 ppm1 4.292 ppm2 7.167 CV 1
ASSI { 1043}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 42 and name HD1%)
4.000 2.000 2.000 peak 1043 spectrum 1 weight 0.10000E+01 volume 0.82637E-03 ppm1 3.960 ppm2 0.501 CV 1
ASSI { 1044}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 65 and name HG2%)
4.000 2.000 2.000 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.58735E-03 ppm1 3.964 ppm2 0.956 CV 1
ASSI { 1045}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 66 and name HG1%)
3.700 1.700 1.700 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.75071E-03 ppm1 3.963 ppm2 0.753 CV 1
ASSI { 1046}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 66 and name HG2%)
4.000 2.000 2.000 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.89974E-03 ppm1 3.966 ppm2 0.645 CV 1
ASSI { 1048}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 78 and name HD% )
3.700 1.700 1.700 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.32669E-03 ppm1 3.957 ppm2 6.748 CV 1
ASSI { 1050}
(( segid "SUPF" and resid 79 and name HA2 ))
( segid "SUPF" and resid 80 and name HD% )
4.200 2.200 1.800 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.25368E-03 ppm1 3.960 ppm2 7.168 CV 1
ASSI { 1051}
(( segid "SUPF" and resid 80 and name HA ))
(( segid "SUPF" and resid 36 and name HG2 ))
4.400 2.400 1.600 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.42652E-03 ppm1 5.849 ppm2 1.391 CV 1
ASSI { 1052}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
4.100 2.100 1.900 peak 1052 spectrum 1 weight 0.10000E+01 volume 0.45309E-03 ppm1 5.858 ppm2 6.994 CV 1
ASSI { 1053}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 39 and name HG2%)
3.200 1.300 1.300 peak 1053 spectrum 1 weight 0.10000E+01 volume 0.12908E-02 ppm1 5.849 ppm2 0.709 CV 1
ASSI { 1054}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 65 and name HG2%)
4.400 2.500 1.600 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.43782E-03 ppm1 5.845 ppm2 0.954 CV 1
ASSI { 1055}
(( segid "SUPF" and resid 80 and name HA ))
(( segid "SUPF" and resid 80 and name HB1 ))
2.700 0.900 0.900 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.23887E-02 ppm1 5.846 ppm2 2.677 CV 1
ASSI { 1056}
(( segid "SUPF" and resid 80 and name HA ))
(( segid "SUPF" and resid 80 and name HB2 ))
3.000 1.100 1.100 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.29820E-02 ppm1 5.845 ppm2 2.872 CV 1
ASSI { 1057}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 80 and name HD% )
2.600 0.800 0.800 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.36330E-02 ppm1 5.845 ppm2 7.165 CV 1
ASSI { 1058}
(( segid "SUPF" and resid 80 and name HA ))
( segid "SUPF" and resid 80 and name HE% )
4.300 2.300 1.700 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.50003E-03 ppm1 5.839 ppm2 7.559 CV 1
ASSI { 1062}
(( segid "SUPF" and resid 80 and name HB1 ))
(( segid "SUPF" and resid 80 and name HB2 ))
2.000 0.500 0.500 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.69319E-02 ppm1 2.680 ppm2 2.872 CV 1
ASSI { 1063}
(( segid "SUPF" and resid 80 and name HB1 ))
( segid "SUPF" and resid 80 and name HD% )
2.600 0.800 0.800 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.37478E-02 ppm1 2.677 ppm2 7.165 CV 1
ASSI { 1064}
(( segid "SUPF" and resid 80 and name HB1 ))
( segid "SUPF" and resid 80 and name HE% )
4.600 2.700 1.400 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.45788E-03 ppm1 2.676 ppm2 7.552 CV 1
ASSI { 1068}
(( segid "SUPF" and resid 80 and name HB2 ))
( segid "SUPF" and resid 80 and name HD% )
2.500 0.800 0.800 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.39060E-02 ppm1 2.873 ppm2 7.166 CV 1
ASSI { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HE2 ))
3.200 1.200 1.200 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.13654E-02 ppm1 7.161 ppm2 1.399 CV 1
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HE1 ))
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HG2 ))
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HG1 ))
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
( segid "SUPF" and resid 36 and name HZ% )
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HD1 ))
OR { 1070}
( segid "SUPF" and resid 80 and name HD% )
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 1072}
( segid "SUPF" and resid 80 and name HD% )
( segid "SUPF" and resid 65 and name HG2%)
2.700 2.700 3.300 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.17223E-02 ppm1 7.160 ppm2 0.954 CV 1
ASSI { 1078}
( segid "SUPF" and resid 80 and name HD% )
( segid "SUPF" and resid 80 and name HE% )
2.200 0.600 0.600 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.62910E-02 ppm1 7.159 ppm2 7.559 CV 1
ASSI { 1081}
( segid "SUPF" and resid 80 and name HE% )
(( segid "SUPF" and resid 38 and name HB2 ))
3.800 1.800 1.800 peak 1081 spectrum 1 weight 0.10000E+01 volume 0.57276E-03 ppm1 7.562 ppm2 3.003 CV 1
OR { 1081}
( segid "SUPF" and resid 80 and name HE% )
(( segid "SUPF" and resid 38 and name HB1 ))
ASSI { 1088}
(( segid "SUPF" and resid 81 and name HA ))
(( segid "SUPF" and resid 64 and name HA ))
2.100 0.500 0.500 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.90986E-02 ppm1 4.711 ppm2 5.185 CV 1
ASSI { 1089}
(( segid "SUPF" and resid 81 and name HA ))
( segid "SUPF" and resid 64 and name HB% )
2.500 0.800 0.800 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.36105E-02 ppm1 4.710 ppm2 1.343 CV 1
ASSI { 1090}
(( segid "SUPF" and resid 81 and name HA ))
(( segid "SUPF" and resid 80 and name HA ))
4.100 2.100 1.900 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.55958E-03 ppm1 4.714 ppm2 5.846 CV 1
ASSI { 1091}
(( segid "SUPF" and resid 81 and name HA ))
(( segid "SUPF" and resid 81 and name HB ))
3.000 1.200 1.200 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.14280E-02 ppm1 4.712 ppm2 1.177 CV 1
ASSI { 1092}
(( segid "SUPF" and resid 81 and name HA ))
( segid "SUPF" and resid 81 and name HG1%)
2.300 0.700 0.700 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.58581E-02 ppm1 4.710 ppm2 0.571 CV 1
ASSI { 1093}
(( segid "SUPF" and resid 81 and name HA ))
( segid "SUPF" and resid 81 and name HG2%)
2.300 0.700 0.700 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.63615E-02 ppm1 4.710 ppm2 0.403 CV 1
ASSI { 1094}
(( segid "SUPF" and resid 81 and name HB ))
(( segid "SUPF" and resid 37 and name HB ))
2.600 0.800 0.800 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.30129E-02 ppm1 1.179 ppm2 1.785 CV 1
ASSI { 1095}
(( segid "SUPF" and resid 81 and name HB ))
( segid "SUPF" and resid 81 and name HG1%)
2.200 0.600 0.600 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.72921E-02 ppm1 1.177 ppm2 0.571 CV 1
ASSI { 1096}
(( segid "SUPF" and resid 81 and name HB ))
( segid "SUPF" and resid 81 and name HG2%)
2.200 0.600 0.600 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.73204E-02 ppm1 1.178 ppm2 0.403 CV 1
ASSI { 1101}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 52 and name HD2 ))
3.200 1.300 1.300 peak 1101 spectrum 1 weight 0.10000E+01 volume 0.51702E-03 ppm1 0.585 ppm2 7.247 CV 1
ASSI { 1102}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 55 and name HB1 ))
2.700 0.900 0.900 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.24483E-02 ppm1 0.571 ppm2 2.924 CV 1
ASSI { 1104}
( segid "SUPF" and resid 81 and name HG1%)
( segid "SUPF" and resid 55 and name HD% )
2.800 1.000 1.000 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.25608E-02 ppm1 0.573 ppm2 7.831 CV 1
ASSI { 1105}
( segid "SUPF" and resid 81 and name HG1%)
( segid "SUPF" and resid 55 and name HE% )
3.700 1.700 1.700 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.83318E-03 ppm1 0.577 ppm2 7.323 CV 1
ASSI { 1106}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 61 and name HG11))
3.700 1.700 1.700 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.23198E-02 ppm1 0.581 ppm2 1.486 CV 1
ASSI { 1108}
( segid "SUPF" and resid 81 and name HG1%)
( segid "SUPF" and resid 64 and name HB% )
2.300 0.600 0.600 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.60114E-02 ppm1 0.582 ppm2 1.343 CV 1
ASSI { 1110}
( segid "SUPF" and resid 81 and name HG1%)
(( segid "SUPF" and resid 83 and name HG1 ))
4.100 2.100 1.900 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.49224E-03 ppm1 0.578 ppm2 2.268 CV 1
ASSI { 1111}
( segid "SUPF" and resid 81 and name HG2%)
(( segid "SUPF" and resid 51 and name HG ))
2.400 0.700 0.700 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.43576E-02 ppm1 0.406 ppm2 1.579 CV 1
ASSI { 1112}
( segid "SUPF" and resid 81 and name HG2%)
(( segid "SUPF" and resid 52 and name HA ))
3.700 1.700 1.700 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.70530E-03 ppm1 0.415 ppm2 3.818 CV 1
ASSI { 1115}
( segid "SUPF" and resid 81 and name HG2%)
(( segid "SUPF" and resid 37 and name HB ))
3.900 1.900 1.900 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.80017E-03 ppm1 0.414 ppm2 1.786 CV 1
ASSI { 1118}
( segid "SUPF" and resid 81 and name HG2%)
( segid "SUPF" and resid 55 and name HD% )
2.600 0.800 0.800 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.34818E-02 ppm1 0.408 ppm2 7.833 CV 1
ASSI { 1119}
( segid "SUPF" and resid 81 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
3.000 1.100 1.100 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.19704E-02 ppm1 0.408 ppm2 7.324 CV 1
ASSI { 1121}
( segid "SUPF" and resid 81 and name HG2%)
( segid "SUPF" and resid 64 and name HB% )
2.100 0.600 0.600 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.80396E-02 ppm1 0.404 ppm2 1.342 CV 1
ASSI { 1122}
( segid "SUPF" and resid 81 and name HG2%)
(( segid "SUPF" and resid 80 and name HA ))
3.700 1.700 1.700 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.65964E-03 ppm1 0.406 ppm2 5.848 CV 1
ASSI { 1123}
(( segid "SUPF" and resid 82 and name HA ))
(( segid "SUPF" and resid 35 and name HB ))
3.600 1.600 1.600 peak 1123 spectrum 1 weight 0.10000E+01 volume 0.81107E-03 ppm1 5.101 ppm2 4.530 CV 1
ASSI { 1125}
(( segid "SUPF" and resid 82 and name HA ))
(( segid "SUPF" and resid 36 and name HB2 ))
4.300 2.300 1.700 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.38895E-03 ppm1 5.087 ppm2 1.980 CV 1
ASSI { 1127}
(( segid "SUPF" and resid 82 and name HA ))
(( segid "SUPF" and resid 36 and name HG2 ))
2.900 2.900 3.100 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.10754E-02 ppm1 5.090 ppm2 1.394 CV 1
ASSI { 1128}
(( segid "SUPF" and resid 82 and name HA ))
( segid "SUPF" and resid 81 and name HG1%)
3.700 1.700 1.700 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.60183E-03 ppm1 5.095 ppm2 0.574 CV 1
ASSI { 1135}
(( segid "SUPF" and resid 82 and name HB ))
(( segid "SUPF" and resid 36 and name HA ))
4.300 2.300 1.700 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.52490E-03 ppm1 3.934 ppm2 5.016 CV 1
ASSI { 1136}
(( segid "SUPF" and resid 82 and name HB ))
( segid "SUPF" and resid 61 and name HG2%)
4.400 2.400 1.600 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.45660E-03 ppm1 3.944 ppm2 0.575 CV 1
ASSI { 1138}
(( segid "SUPF" and resid 82 and name HB ))
(( segid "SUPF" and resid 63 and name HG1 ))
3.000 3.000 3.000 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.79782E-03 ppm1 3.945 ppm2 2.207 CV 1
ASSI { 1139}
(( segid "SUPF" and resid 82 and name HB ))
(( segid "SUPF" and resid 82 and name HA ))
2.900 1.000 1.000 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.20276E-02 ppm1 3.939 ppm2 5.095 CV 1
ASSI { 1140}
(( segid "SUPF" and resid 82 and name HB ))
( segid "SUPF" and resid 82 and name HG2%)
2.100 0.500 0.500 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.12588E-01 ppm1 3.939 ppm2 1.153 CV 1
ASSI { 1142}
(( segid "SUPF" and resid 83 and name HA ))
( segid "SUPF" and resid 61 and name HD1%)
4.200 2.300 1.800 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.93558E-03 ppm1 5.110 ppm2 0.416 CV 1
ASSI { 1144}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 61 and name HG11))
4.300 2.300 1.700 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.75571E-03 ppm1 5.111 ppm2 1.485 CV 1
ASSI { 1145}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 61 and name HG12))
3.400 1.500 1.500 peak 1145 spectrum 1 weight 0.10000E+01 volume 0.73776E-03 ppm1 5.111 ppm2 0.986 CV 1
ASSI { 1147}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 83 and name HB1 ))
2.300 0.700 0.700 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.40737E-02 ppm1 5.111 ppm2 2.550 CV 1
ASSI { 1148}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 83 and name HB2 ))
3.100 1.200 1.200 peak 1148 spectrum 1 weight 0.10000E+01 volume 0.18440E-02 ppm1 5.113 ppm2 2.015 CV 1
ASSI { 1149}
(( segid "SUPF" and resid 83 and name HA ))
( segid "SUPF" and resid 83 and name HE% )
2.800 1.000 1.000 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.28447E-02 ppm1 5.111 ppm2 1.938 CV 1
ASSI { 1150}
(( segid "SUPF" and resid 83 and name HA ))
(( segid "SUPF" and resid 83 and name HG1 ))
3.700 1.700 1.700 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.10787E-02 ppm1 5.109 ppm2 2.264 CV 1
ASSI { 1153}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 37 and name HD1%)
3.400 1.400 1.400 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.17245E-02 ppm1 1.939 ppm2 0.681 CV 1
OR { 1153}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 37 and name HG2%)
ASSI { 1155}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 55 and name HB2 ))
3.900 1.900 1.900 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.13436E-02 ppm1 1.940 ppm2 3.286 CV 1
ASSI { 1157}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 55 and name HD% )
3.300 1.400 1.400 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.13197E-02 ppm1 1.939 ppm2 7.832 CV 1
ASSI { 1158}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 58 and name HB1 ))
3.100 1.200 1.200 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.39539E-02 ppm1 1.940 ppm2 2.906 CV 1
ASSI { 1160}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 58 and name HD% )
3.200 1.200 1.200 peak 1160 spectrum 1 weight 0.10000E+01 volume 0.20911E-02 ppm1 1.940 ppm2 7.374 CV 1
ASSI { 1161}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 59 and name HA1 ))
2.800 1.000 1.000 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.19962E-02 ppm1 1.941 ppm2 4.535 CV 1
ASSI { 1162}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 61 and name HA ))
3.300 1.400 1.400 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.16043E-02 ppm1 1.942 ppm2 4.160 CV 1
ASSI { 1163}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 61 and name HG12))
2.700 0.900 0.900 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.16366E-02 ppm1 1.943 ppm2 0.992 CV 1
ASSI { 1164}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 81 and name HG1%)
2.900 1.100 1.100 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.26827E-02 ppm1 1.936 ppm2 0.575 CV 1
ASSI { 1165}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 81 and name HG2%)
2.300 2.300 3.700 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.38791E-02 ppm1 1.940 ppm2 0.414 CV 1
ASSI { 1167}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 83 and name HB1 ))
2.200 0.600 0.600 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.58012E-02 ppm1 1.940 ppm2 2.553 CV 1
ASSI { 1168}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 83 and name HG1 ))
2.700 0.900 0.900 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.30365E-02 ppm1 1.938 ppm2 2.262 CV 1
ASSI { 1169}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 88 and name HA ))
3.300 1.400 1.400 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.25286E-02 ppm1 1.941 ppm2 4.326 CV 1
ASSI { 1170}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 88 and name HB1 ))
2.300 0.700 0.700 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.61693E-02 ppm1 1.940 ppm2 3.872 CV 1
ASSI { 1171}
( segid "SUPF" and resid 83 and name HE% )
(( segid "SUPF" and resid 88 and name HB2 ))
3.000 1.100 1.100 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.43647E-02 ppm1 1.941 ppm2 4.055 CV 1
ASSI { 1172}
( segid "SUPF" and resid 83 and name HE% )
( segid "SUPF" and resid 92 and name HB% )
2.700 0.900 0.900 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.36015E-02 ppm1 1.938 ppm2 1.440 CV 1
ASSI { 1175}
(( segid "SUPF" and resid 83 and name HG2 ))
( segid "SUPF" and resid 37 and name HD1%)
3.000 1.100 1.100 peak 1175 spectrum 1 weight 0.10000E+01 volume 0.18784E-02 ppm1 2.558 ppm2 0.682 CV 1
ASSI { 1176}
(( segid "SUPF" and resid 84 and name HG1 ))
(( segid "SUPF" and resid 84 and name HA ))
2.900 1.000 1.000 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.48340E-02 ppm1 1.381 ppm2 4.102 CV 1
OR { 1176}
(( segid "SUPF" and resid 84 and name HG2 ))
(( segid "SUPF" and resid 84 and name HA ))
ASSI { 1177}
(( segid "SUPF" and resid 85 and name HA ))
(( segid "SUPF" and resid 86 and name HB1 ))
4.700 2.800 1.300 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.39932E-03 ppm1 4.889 ppm2 1.897 CV 1
OR { 1177}
(( segid "SUPF" and resid 85 and name HA ))
(( segid "SUPF" and resid 86 and name HB2 ))
ASSI { 1178}
(( segid "SUPF" and resid 85 and name HA ))
( segid "SUPF" and resid 35 and name HG2%)
2.600 0.900 0.900 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.42654E-02 ppm1 4.890 ppm2 0.811 CV 1
ASSI { 1179}
(( segid "SUPF" and resid 85 and name HA ))
(( segid "SUPF" and resid 85 and name HB1 ))
2.500 0.800 0.800 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.86890E-02 ppm1 4.896 ppm2 2.998 CV 1
ASSI { 1180}
(( segid "SUPF" and resid 85 and name HA ))
(( segid "SUPF" and resid 85 and name HB2 ))
2.400 0.700 0.700 peak 1180 spectrum 1 weight 0.10000E+01 volume 0.70608E-02 ppm1 4.888 ppm2 2.755 CV 1
ASSI { 1182}
(( segid "SUPF" and resid 85 and name HB1 ))
(( segid "SUPF" and resid 85 and name HB2 ))
1.800 0.400 0.400 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.14527E-01 ppm1 2.998 ppm2 2.750 CV 1
ASSI { 1185}
(( segid "SUPF" and resid 86 and name HB2 ))
(( segid "SUPF" and resid 34 and name HB1 ))
3.400 1.500 1.500 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.10729E-02 ppm1 1.885 ppm2 2.788 CV 1
OR { 1185}
(( segid "SUPF" and resid 86 and name HB1 ))
(( segid "SUPF" and resid 34 and name HB1 ))
ASSI { 1187}
(( segid "SUPF" and resid 86 and name HB2 ))
( segid "SUPF" and resid 34 and name HD% )
4.100 2.100 1.900 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.70042E-03 ppm1 1.881 ppm2 7.201 CV 1
OR { 1187}
(( segid "SUPF" and resid 86 and name HB1 ))
( segid "SUPF" and resid 34 and name HD% )
ASSI { 1188}
(( segid "SUPF" and resid 86 and name HB1 ))
( segid "SUPF" and resid 35 and name HG2%)
3.200 1.300 1.300 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.22824E-02 ppm1 1.878 ppm2 0.812 CV 1
OR { 1188}
(( segid "SUPF" and resid 86 and name HB2 ))
( segid "SUPF" and resid 35 and name HG2%)
ASSI { 1189}
(( segid "SUPF" and resid 86 and name HB1 ))
(( segid "SUPF" and resid 86 and name HD1 ))
2.600 0.800 0.800 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.54134E-02 ppm1 1.877 ppm2 2.975 CV 1
OR { 1189}
(( segid "SUPF" and resid 86 and name HB1 ))
(( segid "SUPF" and resid 86 and name HD2 ))
OR { 1189}
(( segid "SUPF" and resid 86 and name HB2 ))
(( segid "SUPF" and resid 86 and name HD1 ))
OR { 1189}
(( segid "SUPF" and resid 86 and name HB2 ))
(( segid "SUPF" and resid 86 and name HD2 ))
ASSI { 1190}
(( segid "SUPF" and resid 86 and name HD2 ))
(( segid "SUPF" and resid 34 and name HB2 ))
3.200 1.300 1.300 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.14060E-02 ppm1 2.982 ppm2 3.460 CV 1
OR { 1190}
(( segid "SUPF" and resid 86 and name HD1 ))
(( segid "SUPF" and resid 34 and name HB2 ))
ASSI { 1191}
(( segid "SUPF" and resid 86 and name HD2 ))
( segid "SUPF" and resid 34 and name HD% )
3.300 1.300 1.300 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.14148E-02 ppm1 2.975 ppm2 7.200 CV 1
OR { 1191}
(( segid "SUPF" and resid 86 and name HD1 ))
( segid "SUPF" and resid 34 and name HD% )
ASSI { 1193}
(( segid "SUPF" and resid 86 and name HD1 ))
(( segid "SUPF" and resid 86 and name HA ))
3.400 1.400 1.400 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.22146E-02 ppm1 2.979 ppm2 4.028 CV 1
OR { 1193}
(( segid "SUPF" and resid 86 and name HD2 ))
(( segid "SUPF" and resid 86 and name HA ))
ASSI { 1195}
(( segid "SUPF" and resid 86 and name HD1 ))
(( segid "SUPF" and resid 86 and name HG1 ))
2.600 0.800 0.800 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.39995E-02 ppm1 2.980 ppm2 1.783 CV 1
OR { 1195}
(( segid "SUPF" and resid 86 and name HD2 ))
(( segid "SUPF" and resid 86 and name HG1 ))
ASSI { 1196}
(( segid "SUPF" and resid 86 and name HD2 ))
(( segid "SUPF" and resid 86 and name HG2 ))
2.500 0.800 0.800 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.50296E-02 ppm1 2.976 ppm2 1.642 CV 1
OR { 1196}
(( segid "SUPF" and resid 86 and name HD1 ))
(( segid "SUPF" and resid 86 and name HG2 ))
ASSI { 1197}
(( segid "SUPF" and resid 86 and name HG1 ))
(( segid "SUPF" and resid 34 and name HB2 ))
3.500 1.600 1.600 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.98358E-03 ppm1 1.787 ppm2 3.459 CV 1
ASSI { 1199}
(( segid "SUPF" and resid 86 and name HG2 ))
(( segid "SUPF" and resid 34 and name HB2 ))
3.700 1.700 1.700 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.58384E-03 ppm1 1.646 ppm2 3.457 CV 1
ASSI { 1200}
(( segid "SUPF" and resid 86 and name HG2 ))
(( segid "SUPF" and resid 86 and name HA ))
3.100 1.200 1.200 peak 1200 spectrum 1 weight 0.10000E+01 volume 0.17287E-02 ppm1 1.633 ppm2 4.027 CV 1
ASSI { 1201}
(( segid "SUPF" and resid 87 and name HA ))
( segid "SUPF" and resid 87 and name HB% )
2.100 0.600 0.600 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.16452E-01 ppm1 4.234 ppm2 1.519 CV 1
ASSI { 1205}
(( segid "SUPF" and resid 88 and name HB1 ))
(( segid "SUPF" and resid 59 and name HA1 ))
3.000 1.100 1.100 peak 1205 spectrum 1 weight 0.10000E+01 volume 0.92437E-03 ppm1 3.876 ppm2 4.537 CV 1
ASSI { 1208}
(( segid "SUPF" and resid 88 and name HB1 ))
(( segid "SUPF" and resid 88 and name HA ))
2.500 0.800 0.800 peak 1208 spectrum 1 weight 0.10000E+01 volume 0.41537E-02 ppm1 3.885 ppm2 4.328 CV 1
ASSI { 1209}
(( segid "SUPF" and resid 88 and name HB1 ))
(( segid "SUPF" and resid 88 and name HB2 ))
1.900 0.500 0.500 peak 1209 spectrum 1 weight 0.10000E+01 volume 0.75957E-02 ppm1 3.876 ppm2 4.054 CV 1
ASSI { 1210}
(( segid "SUPF" and resid 88 and name HB2 ))
(( segid "SUPF" and resid 59 and name HA1 ))
3.600 1.700 1.700 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.77903E-03 ppm1 4.034 ppm2 4.538 CV 1
ASSI { 1213}
(( segid "SUPF" and resid 88 and name HB2 ))
(( segid "SUPF" and resid 88 and name HA ))
2.800 1.000 1.000 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.35447E-02 ppm1 4.057 ppm2 4.327 CV 1
ASSI { 1217}
(( segid "SUPF" and resid 89 and name HA ))
(( segid "SUPF" and resid 83 and name HB2 ))
3.600 1.600 1.600 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.10136E-02 ppm1 4.100 ppm2 2.013 CV 1
ASSI { 1218}
(( segid "SUPF" and resid 89 and name HA ))
(( segid "SUPF" and resid 83 and name HG1 ))
2.400 0.700 0.700 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.24868E-02 ppm1 4.100 ppm2 2.264 CV 1
ASSI { 1224}
( segid "SUPF" and resid 89 and name HB% )
(( segid "SUPF" and resid 89 and name HA ))
2.200 0.600 0.600 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.74867E-02 ppm1 1.556 ppm2 4.101 CV 1
ASSI { 1225}
(( segid "SUPF" and resid 90 and name HA ))
(( segid "SUPF" and resid 90 and name HG2 ))
3.300 1.300 1.300 peak 1225 spectrum 1 weight 0.10000E+01 volume 0.20537E-02 ppm1 3.998 ppm2 2.542 CV 1
ASSI { 1226}
(( segid "SUPF" and resid 90 and name HB1 ))
(( segid "SUPF" and resid 90 and name HG2 ))
2.500 0.800 0.800 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.42562E-02 ppm1 2.220 ppm2 2.538 CV 1
ASSI { 1227}
(( segid "SUPF" and resid 90 and name HB2 ))
(( segid "SUPF" and resid 90 and name HG2 ))
3.200 1.300 1.300 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.24053E-02 ppm1 2.087 ppm2 2.539 CV 1
ASSI { 1228}
(( segid "SUPF" and resid 90 and name HG1 ))
(( segid "SUPF" and resid 87 and name HA ))
3.600 1.600 1.600 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.12824E-02 ppm1 2.237 ppm2 4.226 CV 1
ASSI { 1229}
(( segid "SUPF" and resid 90 and name HG1 ))
(( segid "SUPF" and resid 90 and name HA ))
2.900 1.100 1.100 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.44597E-02 ppm1 2.238 ppm2 3.997 CV 1
ASSI { 1230}
(( segid "SUPF" and resid 90 and name HG1 ))
(( segid "SUPF" and resid 90 and name HG2 ))
1.800 0.400 0.400 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.11910E-01 ppm1 2.238 ppm2 2.540 CV 1
ASSI { 1231}
(( segid "SUPF" and resid 90 and name HG2 ))
(( segid "SUPF" and resid 87 and name HA ))
3.100 1.200 1.200 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.10723E-02 ppm1 2.542 ppm2 4.230 CV 1
ASSI { 1233}
(( segid "SUPF" and resid 91 and name HA ))
( segid "SUPF" and resid 58 and name HD% )
4.200 2.200 1.800 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.72319E-03 ppm1 3.975 ppm2 7.374 CV 1
ASSI { 1234}
(( segid "SUPF" and resid 91 and name HA ))
(( segid "SUPF" and resid 91 and name HB1 ))
2.900 1.100 1.100 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.25911E-02 ppm1 3.980 ppm2 2.335 CV 1
ASSI { 1235}
(( segid "SUPF" and resid 91 and name HA ))
(( segid "SUPF" and resid 91 and name HB2 ))
2.200 0.600 0.600 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.93401E-02 ppm1 3.987 ppm2 2.073 CV 1
ASSI { 1237}
(( segid "SUPF" and resid 91 and name HA ))
(( segid "SUPF" and resid 91 and name HD2 ))
4.300 2.300 1.700 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.90239E-03 ppm1 3.969 ppm2 3.584 CV 1
ASSI { 1238}
(( segid "SUPF" and resid 91 and name HB1 ))
( segid "SUPF" and resid 58 and name HD% )
3.200 1.300 1.300 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.13911E-02 ppm1 2.332 ppm2 7.372 CV 1
ASSI { 1241}
(( segid "SUPF" and resid 91 and name HB1 ))
(( segid "SUPF" and resid 91 and name HD2 ))
3.400 1.400 1.400 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.10637E-02 ppm1 2.332 ppm2 3.586 CV 1
ASSI { 1242}
(( segid "SUPF" and resid 91 and name HB2 ))
( segid "SUPF" and resid 58 and name HD% )
3.700 1.700 1.700 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.21284E-02 ppm1 2.056 ppm2 7.373 CV 1
ASSI { 1246}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 58 and name HA ))
3.100 1.200 1.200 peak 1246 spectrum 1 weight 0.10000E+01 volume 0.12485E-02 ppm1 3.438 ppm2 4.706 CV 1
ASSI { 1247}
(( segid "SUPF" and resid 91 and name HD1 ))
( segid "SUPF" and resid 58 and name HD% )
3.300 1.400 1.400 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.85293E-03 ppm1 3.428 ppm2 7.374 CV 1
ASSI { 1248}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 91 and name HA ))
4.400 2.400 1.600 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.87335E-03 ppm1 3.429 ppm2 3.985 CV 1
ASSI { 1249}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 91 and name HB1 ))
3.000 1.100 1.100 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.14051E-02 ppm1 3.429 ppm2 2.330 CV 1
ASSI { 1250}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 91 and name HB2 ))
2.900 1.000 1.000 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.40897E-02 ppm1 3.430 ppm2 2.070 CV 1
ASSI { 1252}
(( segid "SUPF" and resid 91 and name HD1 ))
(( segid "SUPF" and resid 91 and name HG1 ))
2.900 1.100 1.100 peak 1252 spectrum 1 weight 0.10000E+01 volume 0.30306E-02 ppm1 3.429 ppm2 1.736 CV 1
ASSI { 1253}
(( segid "SUPF" and resid 91 and name HD2 ))
(( segid "SUPF" and resid 58 and name HA ))
3.900 1.900 1.900 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.10024E-02 ppm1 3.597 ppm2 4.702 CV 1
ASSI { 1254}
(( segid "SUPF" and resid 91 and name HD2 ))
( segid "SUPF" and resid 58 and name HD% )
4.300 2.300 1.700 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.58166E-03 ppm1 3.585 ppm2 7.374 CV 1
ASSI { 1257}
(( segid "SUPF" and resid 91 and name HD2 ))
(( segid "SUPF" and resid 91 and name HB2 ))
2.400 0.700 0.700 peak 1257 spectrum 1 weight 0.10000E+01 volume 0.41621E-02 ppm1 3.589 ppm2 2.074 CV 1
ASSI { 1258}
(( segid "SUPF" and resid 91 and name HD2 ))
(( segid "SUPF" and resid 91 and name HD1 ))
1.700 0.300 0.500 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.15608E-01 ppm1 3.590 ppm2 3.429 CV 1
ASSI { 1259}
(( segid "SUPF" and resid 91 and name HD2 ))
(( segid "SUPF" and resid 91 and name HG1 ))
2.500 0.800 0.800 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.36698E-02 ppm1 3.591 ppm2 1.734 CV 1
ASSI { 1260}
(( segid "SUPF" and resid 91 and name HG1 ))
( segid "SUPF" and resid 58 and name HD% )
4.400 2.400 1.600 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.75469E-03 ppm1 1.738 ppm2 7.375 CV 1
ASSI { 1261}
(( segid "SUPF" and resid 91 and name HG1 ))
(( segid "SUPF" and resid 91 and name HA ))
2.600 0.800 0.800 peak 1261 spectrum 1 weight 0.10000E+01 volume 0.34228E-02 ppm1 1.745 ppm2 3.983 CV 1
ASSI { 1264}
(( segid "SUPF" and resid 91 and name HG2 ))
( segid "SUPF" and resid 58 and name HD% )
3.000 1.200 1.200 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.78716E-03 ppm1 2.090 ppm2 7.378 CV 1
ASSI { 1265}
(( segid "SUPF" and resid 91 and name HG2 ))
(( segid "SUPF" and resid 91 and name HA ))
2.500 0.800 0.800 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.64518E-02 ppm1 2.081 ppm2 3.993 CV 1
ASSI { 1268}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 37 and name HD1%)
4.600 2.700 1.400 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.54782E-03 ppm1 2.017 ppm2 0.684 CV 1
ASSI { 1269}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 54 and name HE% )
4.400 2.400 1.600 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.26967E-03 ppm1 2.016 ppm2 6.483 CV 1
ASSI { 1270}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 55 and name HD% )
4.300 2.300 1.700 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.69867E-03 ppm1 2.016 ppm2 7.833 CV 1
ASSI { 1271}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 55 and name HE% )
4.200 2.200 1.800 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.61500E-03 ppm1 2.015 ppm2 7.329 CV 1
ASSI { 1272}
(( segid "SUPF" and resid 92 and name HA ))
(( segid "SUPF" and resid 58 and name HB1 ))
3.900 1.900 1.900 peak 1272 spectrum 1 weight 0.10000E+01 volume 0.44963E-03 ppm1 2.017 ppm2 2.906 CV 1
ASSI { 1273}
(( segid "SUPF" and resid 92 and name HA ))
(( segid "SUPF" and resid 58 and name HB2 ))
4.100 2.100 1.900 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.44692E-03 ppm1 2.021 ppm2 3.640 CV 1
ASSI { 1274}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 58 and name HD% )
3.000 1.100 1.100 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.18358E-02 ppm1 2.021 ppm2 7.374 CV 1
ASSI { 1275}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 58 and name HE% )
3.100 1.200 1.200 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.17363E-02 ppm1 2.017 ppm2 7.003 CV 1
ASSI { 1276}
(( segid "SUPF" and resid 92 and name HA ))
(( segid "SUPF" and resid 58 and name HZ ))
3.500 1.600 1.600 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.84426E-03 ppm1 2.020 ppm2 7.282 CV 1
ASSI { 1277}
(( segid "SUPF" and resid 92 and name HA ))
( segid "SUPF" and resid 92 and name HB% )
2.300 0.600 0.600 peak 1277 spectrum 1 weight 0.10000E+01 volume 0.88456E-02 ppm1 2.019 ppm2 1.436 CV 1
ASSI { 1279}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 54 and name HD% )
3.700 1.700 1.700 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.24533E-03 ppm1 1.443 ppm2 6.284 CV 1
ASSI { 1280}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 54 and name HE% )
3.400 3.400 2.600 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.38355E-03 ppm1 1.441 ppm2 6.477 CV 1
ASSI { 1281}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 55 and name HD% )
2.300 0.700 0.700 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.64711E-02 ppm1 1.437 ppm2 7.831 CV 1
ASSI { 1282}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 55 and name HE% )
2.400 0.700 0.700 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.53781E-02 ppm1 1.439 ppm2 7.324 CV 1
ASSI { 1283}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 55 and name HZ ))
4.300 2.300 1.700 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.65163E-03 ppm1 1.444 ppm2 7.201 CV 1
ASSI { 1284}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 58 and name HB1 ))
2.900 1.100 1.100 peak 1284 spectrum 1 weight 0.10000E+01 volume 0.32316E-02 ppm1 1.424 ppm2 2.906 CV 1
ASSI { 1285}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 58 and name HB2 ))
2.900 1.000 1.000 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.17815E-02 ppm1 1.438 ppm2 3.645 CV 1
ASSI { 1286}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 58 and name HD% )
2.600 0.800 0.800 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.41582E-02 ppm1 1.440 ppm2 7.373 CV 1
ASSI { 1287}
( segid "SUPF" and resid 92 and name HB% )
( segid "SUPF" and resid 58 and name HE% )
3.200 1.300 1.300 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.16807E-02 ppm1 1.439 ppm2 7.003 CV 1
ASSI { 1288}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 83 and name HG1 ))
3.200 1.300 1.300 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.11663E-02 ppm1 1.439 ppm2 2.263 CV 1
ASSI { 1289}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 83 and name HG2 ))
3.600 1.600 1.600 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.11459E-02 ppm1 1.436 ppm2 2.558 CV 1
ASSI { 1290}
( segid "SUPF" and resid 92 and name HB% )
(( segid "SUPF" and resid 89 and name HA ))
2.500 0.800 0.800 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.46663E-02 ppm1 1.440 ppm2 4.100 CV 1
ASSI { 1293}
(( segid "SUPF" and resid 93 and name HA ))
(( segid "SUPF" and resid 93 and name HB2 ))
2.700 0.900 0.900 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.28573E-02 ppm1 4.284 ppm2 2.794 CV 1
ASSI { 1294}
(( segid "SUPF" and resid 93 and name HB1 ))
(( segid "SUPF" and resid 90 and name HA ))
3.300 1.400 1.400 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.90323E-03 ppm1 3.051 ppm2 3.999 CV 1
ASSI { 1295}
(( segid "SUPF" and resid 93 and name HB1 ))
(( segid "SUPF" and resid 93 and name HA ))
2.800 1.000 1.000 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.39929E-02 ppm1 3.048 ppm2 4.283 CV 1
ASSI { 1296}
(( segid "SUPF" and resid 93 and name HB1 ))
(( segid "SUPF" and resid 93 and name HB2 ))
1.900 0.500 0.500 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.98154E-02 ppm1 3.048 ppm2 2.792 CV 1
ASSI { 1297}
(( segid "SUPF" and resid 93 and name HB2 ))
(( segid "SUPF" and resid 90 and name HA ))
3.200 1.300 1.300 peak 1297 spectrum 1 weight 0.10000E+01 volume 0.13210E-02 ppm1 2.793 ppm2 3.996 CV 1
ASSI { 1300}
(( segid "SUPF" and resid 94 and name HA ))
(( segid "SUPF" and resid 94 and name HB2 ))
2.500 0.800 0.800 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.57834E-02 ppm1 3.901 ppm2 1.907 CV 1
ASSI { 1301}
(( segid "SUPF" and resid 94 and name HA ))
(( segid "SUPF" and resid 94 and name HG1 ))
3.200 1.300 1.300 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.22564E-02 ppm1 3.895 ppm2 1.548 CV 1
ASSI { 1302}
(( segid "SUPF" and resid 94 and name HA ))
(( segid "SUPF" and resid 94 and name HG2 ))
3.100 1.200 1.200 peak 1302 spectrum 1 weight 0.10000E+01 volume 0.26227E-02 ppm1 3.894 ppm2 1.589 CV 1
ASSI { 1303}
(( segid "SUPF" and resid 94 and name HD1 ))
(( segid "SUPF" and resid 94 and name HA ))
2.600 0.900 0.900 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.34676E-02 ppm1 1.756 ppm2 3.899 CV 1
OR { 1303}
(( segid "SUPF" and resid 94 and name HD2 ))
(( segid "SUPF" and resid 94 and name HA ))
ASSI { 1304}
(( segid "SUPF" and resid 94 and name HG2 ))
(( segid "SUPF" and resid 91 and name HA ))
2.800 1.000 1.000 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.24966E-02 ppm1 1.572 ppm2 3.979 CV 1
OR { 1304}
(( segid "SUPF" and resid 94 and name HG1 ))
(( segid "SUPF" and resid 91 and name HA ))
ASSI { 1305}
(( segid "SUPF" and resid 94 and name HG2 ))
(( segid "SUPF" and resid 94 and name HA ))
2.800 1.000 1.000 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.50181E-02 ppm1 1.585 ppm2 3.899 CV 1
OR { 1305}
(( segid "SUPF" and resid 94 and name HG1 ))
(( segid "SUPF" and resid 94 and name HA ))
ASSI { 1306}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 95 and name HB1 ))
2.600 0.800 0.800 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.34902E-02 ppm1 5.140 ppm2 2.498 CV 1
ASSI { 1307}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 95 and name HB2 ))
3.000 1.100 1.100 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.23023E-02 ppm1 5.140 ppm2 2.824 CV 1
ASSI { 1308}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HA ))
3.600 1.600 1.600 peak 1308 spectrum 1 weight 0.10000E+01 volume 0.11630E-02 ppm1 5.134 ppm2 4.702 CV 1
ASSI { 1309}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HB2 ))
5.500 3.700 0.500 peak 1309 spectrum 1 weight 0.10000E+01 volume 0.35028E-03 ppm1 5.131 ppm2 2.142 CV 1
ASSI { 1310}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HD1 ))
2.400 0.700 0.700 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.64639E-02 ppm1 5.141 ppm2 3.995 CV 1
ASSI { 1311}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HD2 ))
2.300 0.600 0.600 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.58726E-02 ppm1 5.141 ppm2 4.104 CV 1
ASSI { 1312}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HG1 ))
4.300 2.300 1.700 peak 1312 spectrum 1 weight 0.10000E+01 volume 0.16677E-02 ppm1 5.138 ppm2 2.080 CV 1
OR { 1312}
(( segid "SUPF" and resid 95 and name HA ))
(( segid "SUPF" and resid 96 and name HG2 ))
ASSI { 1314}
(( segid "SUPF" and resid 95 and name HB1 ))
(( segid "SUPF" and resid 96 and name HD1 ))
4.500 2.500 1.500 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.80830E-03 ppm1 2.496 ppm2 3.992 CV 1
ASSI { 1317}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 96 and name HB1 ))
2.400 0.700 0.700 peak 1317 spectrum 1 weight 0.10000E+01 volume 0.56234E-02 ppm1 4.686 ppm2 2.502 CV 1
ASSI { 1318}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 96 and name HB2 ))
2.900 1.000 1.000 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.40081E-02 ppm1 4.686 ppm2 2.146 CV 1
ASSI { 1319}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 96 and name HG2 ))
3.500 1.600 1.600 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.20964E-02 ppm1 4.682 ppm2 2.074 CV 1
OR { 1319}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 96 and name HG1 ))
ASSI { 1320}
(( segid "SUPF" and resid 96 and name HA ))
(( segid "SUPF" and resid 107 and name HB ))
2.700 0.900 0.900 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.32290E-02 ppm1 4.687 ppm2 2.045 CV 1
ASSI { 1321}
(( segid "SUPF" and resid 96 and name HA ))
( segid "SUPF" and resid 107 and name HG2%)
3.300 1.300 1.300 peak 1321 spectrum 1 weight 0.10000E+01 volume 0.24948E-02 ppm1 4.686 ppm2 1.036 CV 1
OR { 1321}
(( segid "SUPF" and resid 96 and name HA ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 1323}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HB1 ))
3.300 1.400 1.400 peak 1323 spectrum 1 weight 0.10000E+01 volume 0.15671E-02 ppm1 3.999 ppm2 2.501 CV 1
ASSI { 1324}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HB2 ))
4.300 2.300 1.700 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.79294E-03 ppm1 4.003 ppm2 2.150 CV 1
ASSI { 1325}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HD2 ))
1.900 0.500 0.500 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.78390E-02 ppm1 3.998 ppm2 4.103 CV 1
ASSI { 1326}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HG1 ))
2.600 0.800 0.800 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.40663E-02 ppm1 3.997 ppm2 2.079 CV 1
OR { 1326}
(( segid "SUPF" and resid 96 and name HD1 ))
(( segid "SUPF" and resid 96 and name HG2 ))
ASSI { 1328}
(( segid "SUPF" and resid 96 and name HD2 ))
(( segid "SUPF" and resid 96 and name HB1 ))
3.800 1.800 1.800 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.15232E-02 ppm1 4.102 ppm2 2.502 CV 1
ASSI { 1329}
(( segid "SUPF" and resid 96 and name HD2 ))
(( segid "SUPF" and resid 96 and name HB2 ))
4.100 2.100 1.900 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.75126E-03 ppm1 4.098 ppm2 2.143 CV 1
ASSI { 1331}
(( segid "SUPF" and resid 96 and name HD2 ))
(( segid "SUPF" and resid 96 and name HG2 ))
2.500 0.800 0.800 peak 1331 spectrum 1 weight 0.10000E+01 volume 0.41494E-02 ppm1 4.099 ppm2 2.078 CV 1
OR { 1331}
(( segid "SUPF" and resid 96 and name HD2 ))
(( segid "SUPF" and resid 96 and name HG1 ))
ASSI { 1333}
(( segid "SUPF" and resid 96 and name HG2 ))
(( segid "SUPF" and resid 96 and name HB1 ))
2.500 0.800 0.800 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.49503E-02 ppm1 2.080 ppm2 2.500 CV 1
OR { 1333}
(( segid "SUPF" and resid 96 and name HG1 ))
(( segid "SUPF" and resid 96 and name HB1 ))
ASSI { 1338}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 97 and name HB1 ))
2.600 0.800 0.800 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.28729E-02 ppm1 6.002 ppm2 2.490 CV 1
ASSI { 1340}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 98 and name HD1 ))
2.700 0.900 0.900 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.30198E-02 ppm1 6.003 ppm2 3.582 CV 1
ASSI { 1341}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 98 and name HD2 ))
2.300 0.700 0.700 peak 1341 spectrum 1 weight 0.10000E+01 volume 0.47497E-02 ppm1 6.003 ppm2 3.194 CV 1
ASSI { 1342}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 98 and name HG1 ))
4.800 2.800 1.200 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.62814E-03 ppm1 6.001 ppm2 1.944 CV 1
OR { 1342}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 1344}
(( segid "SUPF" and resid 97 and name HA ))
( segid "SUPF" and resid 105 and name HB% )
4.100 2.100 1.900 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.70783E-03 ppm1 6.006 ppm2 1.280 CV 1
ASSI { 1345}
(( segid "SUPF" and resid 97 and name HA ))
(( segid "SUPF" and resid 106 and name HA ))
2.600 0.900 0.900 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.33826E-02 ppm1 6.002 ppm2 5.497 CV 1
ASSI { 1346}
(( segid "SUPF" and resid 97 and name HA ))
( segid "SUPF" and resid 107 and name HG2%)
4.100 2.200 1.900 peak 1346 spectrum 1 weight 0.10000E+01 volume 0.10663E-02 ppm1 6.000 ppm2 1.037 CV 1
OR { 1346}
(( segid "SUPF" and resid 97 and name HA ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 1348}
(( segid "SUPF" and resid 97 and name HB1 ))
(( segid "SUPF" and resid 97 and name HB2 ))
1.800 0.400 0.400 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.13830E-01 ppm1 2.486 ppm2 2.786 CV 1
ASSI { 1349}
(( segid "SUPF" and resid 97 and name HB2 ))
(( segid "SUPF" and resid 97 and name HA ))
2.900 1.000 1.000 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.38231E-02 ppm1 2.782 ppm2 6.004 CV 1
ASSI { 1351}
(( segid "SUPF" and resid 98 and name HA ))
(( segid "SUPF" and resid 98 and name HB1 ))
2.500 0.800 0.800 peak 1351 spectrum 1 weight 0.10000E+01 volume 0.39317E-02 ppm1 4.458 ppm2 2.135 CV 1
ASSI { 1352}
(( segid "SUPF" and resid 98 and name HA ))
(( segid "SUPF" and resid 98 and name HB2 ))
2.700 0.900 0.900 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.42259E-02 ppm1 4.451 ppm2 1.550 CV 1
ASSI { 1354}
(( segid "SUPF" and resid 98 and name HA ))
(( segid "SUPF" and resid 98 and name HD2 ))
3.800 1.800 1.800 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.76674E-03 ppm1 4.461 ppm2 3.184 CV 1
ASSI { 1355}
(( segid "SUPF" and resid 98 and name HB1 ))
( segid "SUPF" and resid 54 and name HE% )
4.200 2.200 1.800 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.57986E-03 ppm1 2.136 ppm2 6.480 CV 1
ASSI { 1358}
(( segid "SUPF" and resid 98 and name HD1 ))
(( segid "SUPF" and resid 98 and name HB1 ))
3.400 1.500 1.500 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.80691E-03 ppm1 3.583 ppm2 2.135 CV 1
ASSI { 1359}
(( segid "SUPF" and resid 98 and name HD1 ))
(( segid "SUPF" and resid 98 and name HB2 ))
3.500 1.600 1.600 peak 1359 spectrum 1 weight 0.10000E+01 volume 0.23395E-02 ppm1 3.590 ppm2 1.564 CV 1
ASSI { 1360}
(( segid "SUPF" and resid 98 and name HD1 ))
(( segid "SUPF" and resid 98 and name HD2 ))
2.000 0.500 0.500 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.49664E-02 ppm1 3.584 ppm2 3.193 CV 1
ASSI { 1363}
(( segid "SUPF" and resid 98 and name HD1 ))
( segid "SUPF" and resid 107 and name HG1%)
4.700 2.700 1.300 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.53528E-03 ppm1 3.588 ppm2 1.089 CV 1
ASSI { 1366}
(( segid "SUPF" and resid 98 and name HD2 ))
(( segid "SUPF" and resid 98 and name HB1 ))
4.400 2.400 1.600 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.54833E-03 ppm1 3.186 ppm2 2.134 CV 1
ASSI { 1367}
(( segid "SUPF" and resid 98 and name HD2 ))
(( segid "SUPF" and resid 98 and name HB2 ))
3.700 1.700 1.700 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.16629E-02 ppm1 3.190 ppm2 1.565 CV 1
ASSI { 1369}
(( segid "SUPF" and resid 98 and name HD2 ))
(( segid "SUPF" and resid 98 and name HG1 ))
2.900 1.000 1.000 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.14560E-02 ppm1 3.188 ppm2 1.942 CV 1
OR { 1369}
(( segid "SUPF" and resid 98 and name HD2 ))
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 1370}
(( segid "SUPF" and resid 98 and name HD2 ))
( segid "SUPF" and resid 100 and name HD1%)
4.600 2.600 1.400 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.37520E-03 ppm1 3.204 ppm2 0.221 CV 1
ASSI { 1374}
(( segid "SUPF" and resid 98 and name HD2 ))
( segid "SUPF" and resid 107 and name HG1%)
5.100 3.200 0.900 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.52025E-03 ppm1 3.201 ppm2 1.087 CV 1
ASSI { 1378}
(( segid "SUPF" and resid 98 and name HG2 ))
( segid "SUPF" and resid 54 and name HE% )
3.600 1.700 1.700 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.61091E-03 ppm1 1.945 ppm2 6.478 CV 1
OR { 1378}
(( segid "SUPF" and resid 98 and name HG1 ))
( segid "SUPF" and resid 54 and name HE% )
ASSI { 1380}
(( segid "SUPF" and resid 99 and name HA ))
(( segid "SUPF" and resid 99 and name HB ))
2.800 1.000 1.000 peak 1380 spectrum 1 weight 0.10000E+01 volume 0.24359E-02 ppm1 4.293 ppm2 1.790 CV 1
ASSI { 1383}
(( segid "SUPF" and resid 99 and name HA ))
(( segid "SUPF" and resid 99 and name HG12))
3.000 1.100 1.100 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.20153E-02 ppm1 4.289 ppm2 1.120 CV 1
ASSI { 1384}
(( segid "SUPF" and resid 99 and name HA ))
( segid "SUPF" and resid 99 and name HG2%)
2.300 0.700 0.700 peak 1384 spectrum 1 weight 0.10000E+01 volume 0.74373E-02 ppm1 4.286 ppm2 0.574 CV 1
ASSI { 1387}
(( segid "SUPF" and resid 99 and name HB ))
(( segid "SUPF" and resid 99 and name HG11))
2.600 0.800 0.800 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.39338E-02 ppm1 1.793 ppm2 1.483 CV 1
ASSI { 1388}
(( segid "SUPF" and resid 99 and name HB ))
(( segid "SUPF" and resid 99 and name HG12))
2.600 0.900 0.900 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.31447E-02 ppm1 1.792 ppm2 1.119 CV 1
ASSI { 1389}
(( segid "SUPF" and resid 99 and name HB ))
( segid "SUPF" and resid 99 and name HG2%)
2.100 0.600 0.600 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.12119E-01 ppm1 1.792 ppm2 0.574 CV 1
ASSI { 1391}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 99 and name HA ))
2.400 0.700 0.700 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.47402E-02 ppm1 0.731 ppm2 4.285 CV 1
ASSI { 1392}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 99 and name HB ))
3.300 1.400 1.400 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.37614E-02 ppm1 0.734 ppm2 1.790 CV 1
ASSI { 1393}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 99 and name HG11))
2.300 0.700 0.700 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.76240E-02 ppm1 0.734 ppm2 1.489 CV 1
ASSI { 1394}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 99 and name HG12))
2.200 0.600 0.600 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.86751E-02 ppm1 0.737 ppm2 1.129 CV 1
ASSI { 1395}
( segid "SUPF" and resid 99 and name HD1%)
( segid "SUPF" and resid 99 and name HG2%)
2.100 0.600 0.600 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.15331E-01 ppm1 0.735 ppm2 0.574 CV 1
ASSI { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HG1 ))
3.000 1.100 1.100 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.26489E-02 ppm1 0.732 ppm2 1.685 CV 1
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HB2 ))
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
( segid "SUPF" and resid 104 and name HZ% )
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HG2 ))
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HB1 ))
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HD2 ))
OR { 1396}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HD1 ))
ASSI { 1397}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HA ))
2.400 0.700 0.700 peak 1397 spectrum 1 weight 0.10000E+01 volume 0.50786E-02 ppm1 0.730 ppm2 4.186 CV 1
ASSI { 1398}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HB2 ))
3.100 1.200 1.200 peak 1398 spectrum 1 weight 0.10000E+01 volume 0.17400E-02 ppm1 0.732 ppm2 1.595 CV 1
ASSI { 1399}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HE1 ))
3.200 1.200 1.200 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.22888E-02 ppm1 0.730 ppm2 2.963 CV 1
OR { 1399}
( segid "SUPF" and resid 99 and name HD1%)
(( segid "SUPF" and resid 104 and name HE2 ))
ASSI { 1400}
(( segid "SUPF" and resid 99 and name HG11))
(( segid "SUPF" and resid 99 and name HA ))
3.300 1.400 1.400 peak 1400 spectrum 1 weight 0.10000E+01 volume 0.31522E-02 ppm1 1.476 ppm2 4.287 CV 1
ASSI { 1402}
(( segid "SUPF" and resid 99 and name HG11))
( segid "SUPF" and resid 99 and name HG2%)
2.300 0.600 0.600 peak 1402 spectrum 1 weight 0.10000E+01 volume 0.86775E-02 ppm1 1.484 ppm2 0.577 CV 1
ASSI { 1405}
(( segid "SUPF" and resid 99 and name HG12))
( segid "SUPF" and resid 99 and name HG2%)
3.100 1.200 1.200 peak 1405 spectrum 1 weight 0.10000E+01 volume 0.62247E-02 ppm1 1.119 ppm2 0.575 CV 1
ASSI { 1406}
(( segid "SUPF" and resid 99 and name HG12))
(( segid "SUPF" and resid 104 and name HA ))
4.100 2.100 1.900 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.12521E-02 ppm1 1.122 ppm2 4.185 CV 1
ASSI { 1412}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 100 and name HA ))
3.500 1.500 1.500 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.96816E-03 ppm1 0.571 ppm2 3.796 CV 1
ASSI { 1413}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 102 and name HA1 ))
3.700 1.700 1.700 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.33185E-02 ppm1 0.578 ppm2 3.471 CV 1
ASSI { 1414}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 102 and name HA2 ))
2.700 0.900 0.900 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.28655E-02 ppm1 0.583 ppm2 4.136 CV 1
ASSI { 1415}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 104 and name HG1 ))
3.600 1.700 1.700 peak 1415 spectrum 1 weight 0.10000E+01 volume 0.25915E-02 ppm1 0.588 ppm2 1.344 CV 1
OR { 1415}
( segid "SUPF" and resid 99 and name HG2%)
(( segid "SUPF" and resid 104 and name HG2 ))
ASSI { 1416}
(( segid "SUPF" and resid 100 and name HA ))
( segid "SUPF" and resid 54 and name HE% )
3.700 1.700 1.700 peak 1416 spectrum 1 weight 0.10000E+01 volume 0.49511E-03 ppm1 3.785 ppm2 6.482 CV 1
ASSI { 1417}
(( segid "SUPF" and resid 100 and name HA ))
(( segid "SUPF" and resid 100 and name HB ))
2.800 1.000 1.000 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.28592E-02 ppm1 3.793 ppm2 1.279 CV 1
ASSI { 1418}
(( segid "SUPF" and resid 100 and name HA ))
( segid "SUPF" and resid 100 and name HD1%)
3.800 1.800 1.800 peak 1418 spectrum 1 weight 0.10000E+01 volume 0.21036E-02 ppm1 3.791 ppm2 0.223 CV 1
ASSI { 1420}
(( segid "SUPF" and resid 100 and name HA ))
(( segid "SUPF" and resid 100 and name HG12))
2.500 0.800 0.800 peak 1420 spectrum 1 weight 0.10000E+01 volume 0.30754E-02 ppm1 3.791 ppm2 -0.339 CV 1
ASSI { 1421}
(( segid "SUPF" and resid 100 and name HA ))
( segid "SUPF" and resid 100 and name HG2%)
2.400 0.700 0.700 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.69265E-02 ppm1 3.792 ppm2 0.473 CV 1
ASSI { 1422}
(( segid "SUPF" and resid 100 and name HB ))
( segid "SUPF" and resid 42 and name HD2%)
2.900 1.100 1.100 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.16768E-02 ppm1 1.284 ppm2 0.649 CV 1
ASSI { 1425}
(( segid "SUPF" and resid 100 and name HB ))
(( segid "SUPF" and resid 100 and name HG11))
2.600 0.900 0.900 peak 1425 spectrum 1 weight 0.10000E+01 volume 0.24019E-02 ppm1 1.282 ppm2 0.784 CV 1
ASSI { 1429}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 39 and name HG1%)
2.800 1.000 1.000 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.26007E-02 ppm1 0.227 ppm2 0.716 CV 1
OR { 1429}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 39 and name HG2%)
ASSI { 1431}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 42 and name HD2%)
2.300 0.700 0.700 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.58870E-02 ppm1 0.228 ppm2 0.648 CV 1
ASSI { 1433}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 51 and name HD1%)
2.700 0.900 0.900 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.26951E-02 ppm1 0.227 ppm2 0.828 CV 1
ASSI { 1434}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 54 and name HB1 ))
3.400 1.500 1.500 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.72096E-03 ppm1 0.228 ppm2 2.836 CV 1
ASSI { 1435}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 54 and name HB2 ))
3.900 1.900 1.900 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.74565E-03 ppm1 0.226 ppm2 3.204 CV 1
ASSI { 1436}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 54 and name HD% )
3.100 1.200 1.200 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.15331E-02 ppm1 0.224 ppm2 6.276 CV 1
ASSI { 1437}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 54 and name HE% )
3.100 1.200 1.200 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.18128E-02 ppm1 0.226 ppm2 6.478 CV 1
ASSI { 1438}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 55 and name HD% )
3.000 1.200 1.200 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.76776E-03 ppm1 0.228 ppm2 7.831 CV 1
ASSI { 1439}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 55 and name HE% )
2.500 0.800 0.800 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.37132E-02 ppm1 0.226 ppm2 7.324 CV 1
ASSI { 1440}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 55 and name HZ ))
3.100 1.200 1.200 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.17627E-02 ppm1 0.229 ppm2 7.200 CV 1
ASSI { 1441}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 98 and name HB1 ))
4.600 2.600 1.400 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.60147E-03 ppm1 0.227 ppm2 2.138 CV 1
ASSI { 1442}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 98 and name HD1 ))
4.900 3.000 1.100 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.48570E-03 ppm1 0.226 ppm2 3.588 CV 1
ASSI { 1443}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 98 and name HG1 ))
3.000 1.100 1.100 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.15056E-02 ppm1 0.227 ppm2 1.943 CV 1
OR { 1443}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 1444}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 99 and name HA ))
4.900 3.000 1.100 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.43088E-03 ppm1 0.224 ppm2 4.285 CV 1
ASSI { 1446}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 100 and name HB ))
2.100 0.600 0.600 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.13219E-01 ppm1 0.226 ppm2 1.279 CV 1
ASSI { 1447}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 100 and name HG11))
2.400 0.700 0.700 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.52907E-02 ppm1 0.223 ppm2 0.785 CV 1
ASSI { 1448}
( segid "SUPF" and resid 100 and name HD1%)
(( segid "SUPF" and resid 100 and name HG12))
2.400 0.700 0.700 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.49867E-02 ppm1 0.225 ppm2 -0.339 CV 1
ASSI { 1449}
( segid "SUPF" and resid 100 and name HD1%)
( segid "SUPF" and resid 100 and name HG2%)
2.100 0.600 0.600 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.11856E-01 ppm1 0.225 ppm2 0.473 CV 1
ASSI { 1451}
(( segid "SUPF" and resid 100 and name HG11))
( segid "SUPF" and resid 54 and name HE% )
4.300 2.300 1.700 peak 1451 spectrum 1 weight 0.10000E+01 volume 0.42215E-03 ppm1 0.800 ppm2 6.478 CV 1
ASSI { 1452}
(( segid "SUPF" and resid 100 and name HG11))
(( segid "SUPF" and resid 100 and name HG12))
2.000 0.500 0.500 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.54182E-02 ppm1 0.785 ppm2 -0.341 CV 1
ASSI { 1453}
(( segid "SUPF" and resid 100 and name HG12))
( segid "SUPF" and resid 54 and name HE% )
3.600 1.600 1.600 peak 1453 spectrum 1 weight 0.10000E+01 volume 0.45998E-03 ppm1 -0.338 ppm2 6.476 CV 1
ASSI { 1454}
(( segid "SUPF" and resid 100 and name HG12))
(( segid "SUPF" and resid 98 and name HB2 ))
3.500 1.600 1.600 peak 1454 spectrum 1 weight 0.10000E+01 volume 0.71246E-03 ppm1 -0.327 ppm2 1.547 CV 1
ASSI { 1456}
(( segid "SUPF" and resid 100 and name HG12))
(( segid "SUPF" and resid 100 and name HB ))
3.100 1.200 1.200 peak 1456 spectrum 1 weight 0.10000E+01 volume 0.21940E-02 ppm1 -0.338 ppm2 1.280 CV 1
ASSI { 1461}
( segid "SUPF" and resid 100 and name HG2%)
( segid "SUPF" and resid 46 and name HG2%)
2.600 0.900 0.900 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.40802E-02 ppm1 0.474 ppm2 1.132 CV 1
ASSI { 1463}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 54 and name HB1 ))
3.600 1.600 1.600 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.88450E-03 ppm1 0.476 ppm2 2.838 CV 1
ASSI { 1464}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 54 and name HB2 ))
3.000 1.200 1.200 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.11160E-02 ppm1 0.473 ppm2 3.222 CV 1
ASSI { 1465}
( segid "SUPF" and resid 100 and name HG2%)
( segid "SUPF" and resid 54 and name HD% )
3.500 1.600 1.600 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.79336E-03 ppm1 0.478 ppm2 6.276 CV 1
ASSI { 1466}
( segid "SUPF" and resid 100 and name HG2%)
( segid "SUPF" and resid 54 and name HE% )
4.200 2.200 1.800 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.61259E-03 ppm1 0.479 ppm2 6.478 CV 1
ASSI { 1467}
( segid "SUPF" and resid 100 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
4.200 2.200 1.800 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.58438E-03 ppm1 0.464 ppm2 7.319 CV 1
ASSI { 1469}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 100 and name HB ))
2.000 0.500 0.500 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.13613E-01 ppm1 0.475 ppm2 1.282 CV 1
ASSI { 1471}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 100 and name HG12))
2.600 0.800 0.800 peak 1471 spectrum 1 weight 0.10000E+01 volume 0.35491E-02 ppm1 0.475 ppm2 -0.341 CV 1
ASSI { 1472}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 101 and name HB1 ))
3.200 1.300 1.300 peak 1472 spectrum 1 weight 0.10000E+01 volume 0.25743E-02 ppm1 0.474 ppm2 2.201 CV 1
ASSI { 1473}
( segid "SUPF" and resid 100 and name HG2%)
(( segid "SUPF" and resid 101 and name HB2 ))
3.000 1.100 1.100 peak 1473 spectrum 1 weight 0.10000E+01 volume 0.13602E-02 ppm1 0.476 ppm2 2.992 CV 1
ASSI { 1474}
(( segid "SUPF" and resid 101 and name HA ))
(( segid "SUPF" and resid 101 and name HB1 ))
2.700 0.900 0.900 peak 1474 spectrum 1 weight 0.10000E+01 volume 0.55203E-02 ppm1 4.235 ppm2 2.217 CV 1
ASSI { 1475}
(( segid "SUPF" and resid 101 and name HA ))
(( segid "SUPF" and resid 101 and name HB2 ))
2.500 0.800 0.800 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.48088E-02 ppm1 4.240 ppm2 2.991 CV 1
ASSI { 1476}
(( segid "SUPF" and resid 101 and name HB1 ))
( segid "SUPF" and resid 42 and name HD2%)
3.300 1.300 1.300 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.50187E-03 ppm1 2.198 ppm2 0.645 CV 1
ASSI { 1477}
(( segid "SUPF" and resid 101 and name HB1 ))
(( segid "SUPF" and resid 43 and name HG1 ))
3.400 1.400 1.400 peak 1477 spectrum 1 weight 0.10000E+01 volume 0.11376E-02 ppm1 2.204 ppm2 1.934 CV 1
ASSI { 1478}
(( segid "SUPF" and resid 101 and name HB1 ))
(( segid "SUPF" and resid 43 and name HG2 ))
2.900 1.000 1.000 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.11233E-02 ppm1 2.200 ppm2 1.818 CV 1
ASSI { 1480}
(( segid "SUPF" and resid 101 and name HB1 ))
(( segid "SUPF" and resid 100 and name HB ))
3.100 1.200 1.200 peak 1480 spectrum 1 weight 0.10000E+01 volume 0.17114E-02 ppm1 2.204 ppm2 1.285 CV 1
ASSI { 1483}
(( segid "SUPF" and resid 101 and name HB1 ))
(( segid "SUPF" and resid 101 and name HB2 ))
1.900 0.400 0.400 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.11066E-01 ppm1 2.202 ppm2 2.988 CV 1
ASSI { 1485}
(( segid "SUPF" and resid 101 and name HB2 ))
(( segid "SUPF" and resid 43 and name HG2 ))
3.800 1.800 1.800 peak 1485 spectrum 1 weight 0.10000E+01 volume 0.82420E-03 ppm1 3.000 ppm2 1.816 CV 1
ASSI { 1487}
(( segid "SUPF" and resid 101 and name HB2 ))
(( segid "SUPF" and resid 100 and name HB ))
3.700 1.700 1.700 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.10210E-02 ppm1 2.989 ppm2 1.284 CV 1
ASSI { 1492}
(( segid "SUPF" and resid 102 and name HA1 ))
(( segid "SUPF" and resid 102 and name HA2 ))
2.000 0.500 0.500 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.86143E-02 ppm1 3.471 ppm2 4.128 CV 1
ASSI { 1495}
(( segid "SUPF" and resid 103 and name HA ))
(( segid "SUPF" and resid 103 and name HB1 ))
2.800 1.000 1.000 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.38313E-02 ppm1 4.660 ppm2 1.823 CV 1
ASSI { 1496}
(( segid "SUPF" and resid 103 and name HA ))
(( segid "SUPF" and resid 103 and name HB2 ))
2.500 0.800 0.800 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.39046E-02 ppm1 4.658 ppm2 1.641 CV 1
ASSI { 1497}
(( segid "SUPF" and resid 103 and name HA ))
(( segid "SUPF" and resid 103 and name HG1 ))
2.900 1.000 1.000 peak 1497 spectrum 1 weight 0.10000E+01 volume 0.26789E-02 ppm1 4.659 ppm2 1.568 CV 1
ASSI { 1498}
(( segid "SUPF" and resid 103 and name HA ))
(( segid "SUPF" and resid 103 and name HG2 ))
3.500 1.500 1.500 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.20110E-02 ppm1 4.657 ppm2 1.682 CV 1
ASSI { 1500}
(( segid "SUPF" and resid 103 and name HB1 ))
(( segid "SUPF" and resid 103 and name HD1 ))
3.800 1.800 1.800 peak 1500 spectrum 1 weight 0.10000E+01 volume 0.10214E-02 ppm1 1.830 ppm2 3.154 CV 1
ASSI { 1501}
(( segid "SUPF" and resid 103 and name HB1 ))
(( segid "SUPF" and resid 103 and name HD2 ))
3.500 1.500 1.500 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.15771E-02 ppm1 1.826 ppm2 3.110 CV 1
ASSI { 1503}
(( segid "SUPF" and resid 103 and name HB2 ))
(( segid "SUPF" and resid 103 and name HD1 ))
3.200 1.300 1.300 peak 1503 spectrum 1 weight 0.10000E+01 volume 0.11290E-02 ppm1 1.637 ppm2 3.155 CV 1
ASSI { 1504}
(( segid "SUPF" and resid 103 and name HB2 ))
(( segid "SUPF" and resid 103 and name HD2 ))
2.900 1.100 1.100 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.19390E-02 ppm1 1.639 ppm2 3.110 CV 1
ASSI { 1505}
(( segid "SUPF" and resid 103 and name HG1 ))
(( segid "SUPF" and resid 43 and name HD1 ))
3.400 1.400 1.400 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.13331E-02 ppm1 1.568 ppm2 3.591 CV 1
ASSI { 1506}
(( segid "SUPF" and resid 103 and name HG1 ))
(( segid "SUPF" and resid 103 and name HD2 ))
2.600 0.800 0.800 peak 1506 spectrum 1 weight 0.10000E+01 volume 0.30650E-02 ppm1 1.567 ppm2 3.110 CV 1
ASSI { 1507}
(( segid "SUPF" and resid 103 and name HG2 ))
(( segid "SUPF" and resid 103 and name HD2 ))
3.100 1.200 1.200 peak 1507 spectrum 1 weight 0.10000E+01 volume 0.19030E-02 ppm1 1.686 ppm2 3.110 CV 1
ASSI { 1509}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HG1 ))
2.600 0.900 0.900 peak 1509 spectrum 1 weight 0.10000E+01 volume 0.33197E-02 ppm1 4.186 ppm2 1.342 CV 1
OR { 1509}
(( segid "SUPF" and resid 104 and name HA ))
(( segid "SUPF" and resid 104 and name HG2 ))
ASSI { 1510}
(( segid "SUPF" and resid 104 and name HG1 ))
(( segid "SUPF" and resid 97 and name HA ))
3.400 1.400 1.400 peak 1510 spectrum 1 weight 0.10000E+01 volume 0.10079E-02 ppm1 1.344 ppm2 6.004 CV 1
OR { 1510}
(( segid "SUPF" and resid 104 and name HG2 ))
(( segid "SUPF" and resid 97 and name HA ))
ASSI { 1511}
(( segid "SUPF" and resid 105 and name HA ))
( segid "SUPF" and resid 39 and name HG1%)
4.300 2.300 1.700 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.50353E-03 ppm1 4.698 ppm2 0.751 CV 1
ASSI { 1512}
(( segid "SUPF" and resid 105 and name HA ))
(( segid "SUPF" and resid 41 and name HA1 ))
2.800 1.000 1.000 peak 1512 spectrum 1 weight 0.10000E+01 volume 0.18400E-02 ppm1 4.685 ppm2 4.020 CV 1
ASSI { 1513}
(( segid "SUPF" and resid 105 and name HA ))
(( segid "SUPF" and resid 41 and name HA2 ))
4.500 2.500 1.500 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.11056E-02 ppm1 4.682 ppm2 3.736 CV 1
ASSI { 1514}
(( segid "SUPF" and resid 105 and name HA ))
( segid "SUPF" and resid 42 and name HD2%)
4.000 2.000 2.000 peak 1514 spectrum 1 weight 0.10000E+01 volume 0.56955E-03 ppm1 4.688 ppm2 0.647 CV 1
ASSI { 1515}
(( segid "SUPF" and resid 105 and name HA ))
( segid "SUPF" and resid 100 and name HD1%)
4.700 2.800 1.300 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.55053E-03 ppm1 4.691 ppm2 0.226 CV 1
ASSI { 1516}
(( segid "SUPF" and resid 105 and name HA ))
( segid "SUPF" and resid 105 and name HB% )
2.200 0.600 0.600 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.11359E-01 ppm1 4.688 ppm2 1.280 CV 1
ASSI { 1519}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 98 and name HB1 ))
4.600 2.700 1.400 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.80155E-03 ppm1 1.284 ppm2 2.131 CV 1
ASSI { 1520}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 98 and name HD2 ))
3.000 1.100 1.100 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.14716E-02 ppm1 1.280 ppm2 3.194 CV 1
ASSI { 1521}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 98 and name HG1 ))
2.900 1.100 1.100 peak 1521 spectrum 1 weight 0.10000E+01 volume 0.17340E-02 ppm1 1.288 ppm2 1.946 CV 1
OR { 1521}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 1522}
( segid "SUPF" and resid 105 and name HB% )
( segid "SUPF" and resid 100 and name HD1%)
2.200 0.600 0.600 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.89576E-02 ppm1 1.282 ppm2 0.222 CV 1
ASSI { 1524}
( segid "SUPF" and resid 105 and name HB% )
(( segid "SUPF" and resid 106 and name HA ))
3.900 1.900 1.900 peak 1524 spectrum 1 weight 0.10000E+01 volume 0.71692E-03 ppm1 1.278 ppm2 5.495 CV 1
ASSI { 1526}
(( segid "SUPF" and resid 106 and name HA ))
(( segid "SUPF" and resid 98 and name HD1 ))
4.300 2.300 1.700 peak 1526 spectrum 1 weight 0.10000E+01 volume 0.50021E-03 ppm1 5.491 ppm2 3.578 CV 1
ASSI { 1527}
(( segid "SUPF" and resid 106 and name HA ))
(( segid "SUPF" and resid 98 and name HD2 ))
3.200 1.300 1.300 peak 1527 spectrum 1 weight 0.10000E+01 volume 0.98479E-03 ppm1 5.494 ppm2 3.197 CV 1
ASSI { 1529}
(( segid "SUPF" and resid 106 and name HA ))
(( segid "SUPF" and resid 106 and name HB1 ))
2.500 0.800 0.800 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.43165E-02 ppm1 5.498 ppm2 2.545 CV 1
ASSI { 1530}
(( segid "SUPF" and resid 106 and name HA ))
(( segid "SUPF" and resid 106 and name HB2 ))
2.500 0.800 0.800 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.55214E-02 ppm1 5.498 ppm2 2.707 CV 1
ASSI { 1532}
(( segid "SUPF" and resid 106 and name HB1 ))
( segid "SUPF" and resid 38 and name HD% )
3.900 1.900 1.900 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.35849E-03 ppm1 2.537 ppm2 6.992 CV 1
ASSI { 1533}
(( segid "SUPF" and resid 106 and name HB1 ))
( segid "SUPF" and resid 38 and name HE% )
3.100 3.100 2.900 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.64181E-03 ppm1 2.531 ppm2 6.918 CV 1
ASSI { 1535}
(( segid "SUPF" and resid 106 and name HB2 ))
( segid "SUPF" and resid 38 and name HE% )
3.200 3.200 2.800 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.56521E-03 ppm1 2.710 ppm2 6.919 CV 1
ASSI { 1537}
(( segid "SUPF" and resid 107 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
3.800 1.800 1.800 peak 1537 spectrum 1 weight 0.10000E+01 volume 0.58983E-03 ppm1 5.366 ppm2 6.994 CV 1
ASSI { 1538}
(( segid "SUPF" and resid 107 and name HA ))
(( segid "SUPF" and resid 39 and name HA ))
2.500 0.800 0.800 peak 1538 spectrum 1 weight 0.10000E+01 volume 0.40323E-02 ppm1 5.365 ppm2 4.530 CV 1
ASSI { 1540}
(( segid "SUPF" and resid 107 and name HA ))
(( segid "SUPF" and resid 107 and name HB ))
2.800 1.000 1.000 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.26660E-02 ppm1 5.364 ppm2 2.039 CV 1
ASSI { 1542}
(( segid "SUPF" and resid 107 and name HA ))
( segid "SUPF" and resid 107 and name HG2%)
2.400 0.700 0.700 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.50895E-02 ppm1 5.365 ppm2 1.036 CV 1
ASSI { 1543}
(( segid "SUPF" and resid 107 and name HB ))
( segid "SUPF" and resid 37 and name HG2%)
3.700 1.800 1.800 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.26106E-02 ppm1 2.041 ppm2 0.719 CV 1
ASSI { 1544}
(( segid "SUPF" and resid 107 and name HB ))
(( segid "SUPF" and resid 98 and name HD1 ))
3.400 1.400 1.400 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.84047E-03 ppm1 2.062 ppm2 3.580 CV 1
ASSI { 1545}
(( segid "SUPF" and resid 107 and name HB ))
(( segid "SUPF" and resid 98 and name HD2 ))
4.300 2.300 1.700 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.62235E-03 ppm1 2.059 ppm2 3.197 CV 1
ASSI { 1547}
(( segid "SUPF" and resid 107 and name HB ))
( segid "SUPF" and resid 107 and name HG1%)
2.300 0.600 0.600 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.75433E-02 ppm1 2.042 ppm2 1.088 CV 1
ASSI { 1548}
(( segid "SUPF" and resid 107 and name HB ))
( segid "SUPF" and resid 107 and name HG2%)
2.300 0.600 0.600 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.70831E-02 ppm1 2.042 ppm2 1.036 CV 1
ASSI { 1549}
( segid "SUPF" and resid 107 and name HG2%)
( segid "SUPF" and resid 54 and name HE% )
2.800 1.000 1.000 peak 1549 spectrum 1 weight 0.10000E+01 volume 0.11321E-02 ppm1 1.057 ppm2 6.481 CV 1
OR { 1549}
( segid "SUPF" and resid 107 and name HG1%)
( segid "SUPF" and resid 54 and name HE% )
ASSI { 1550}
( segid "SUPF" and resid 107 and name HG1%)
( segid "SUPF" and resid 55 and name HD% )
3.000 1.200 1.200 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.75969E-03 ppm1 1.084 ppm2 7.831 CV 1
OR { 1550}
( segid "SUPF" and resid 107 and name HG2%)
( segid "SUPF" and resid 55 and name HD% )
ASSI { 1551}
( segid "SUPF" and resid 107 and name HG1%)
( segid "SUPF" and resid 55 and name HE% )
2.600 0.900 0.900 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.44225E-02 ppm1 1.078 ppm2 7.323 CV 1
OR { 1551}
( segid "SUPF" and resid 107 and name HG2%)
( segid "SUPF" and resid 55 and name HE% )
ASSI { 1552}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 55 and name HZ ))
2.300 0.700 0.700 peak 1552 spectrum 1 weight 0.10000E+01 volume 0.58808E-02 ppm1 1.066 ppm2 7.200 CV 1
OR { 1552}
( segid "SUPF" and resid 107 and name HG1%)
(( segid "SUPF" and resid 55 and name HZ ))
ASSI { 1554}
( segid "SUPF" and resid 107 and name HG1%)
(( segid "SUPF" and resid 107 and name HA ))
2.300 0.600 0.600 peak 1554 spectrum 1 weight 0.10000E+01 volume 0.84173E-02 ppm1 1.066 ppm2 5.364 CV 1
OR { 1554}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 107 and name HA ))
ASSI { 1555}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 98 and name HD1 ))
2.800 1.000 1.000 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.28679E-02 ppm1 1.048 ppm2 3.583 CV 1
ASSI { 1556}
( segid "SUPF" and resid 107 and name HG2%)
(( segid "SUPF" and resid 98 and name HD2 ))
2.700 0.900 0.900 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.33866E-02 ppm1 1.046 ppm2 3.194 CV 1
ASSI { 1557}
( segid "SUPF" and resid 107 and name HG2%)
( segid "SUPF" and resid 100 and name HD1%)
2.700 0.900 0.900 peak 1557 spectrum 1 weight 0.10000E+01 volume 0.39385E-02 ppm1 1.054 ppm2 0.223 CV 1
ASSI { 1558}
(( segid "SUPF" and resid 108 and name HA ))
( segid "SUPF" and resid 37 and name HG2%)
3.800 1.800 1.800 peak 1558 spectrum 1 weight 0.10000E+01 volume 0.63711E-03 ppm1 4.928 ppm2 0.719 CV 1
ASSI { 1559}
(( segid "SUPF" and resid 108 and name HA ))
( segid "SUPF" and resid 107 and name HG1%)
3.300 1.400 1.400 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.10289E-02 ppm1 4.929 ppm2 1.089 CV 1
ASSI { 1560}
(( segid "SUPF" and resid 108 and name HA ))
(( segid "SUPF" and resid 108 and name HB1 ))
2.400 0.700 0.700 peak 1560 spectrum 1 weight 0.10000E+01 volume 0.10082E-01 ppm1 4.909 ppm2 3.008 CV 1
ASSI { 1561}
(( segid "SUPF" and resid 108 and name HA ))
(( segid "SUPF" and resid 108 and name HB2 ))
2.400 0.700 0.700 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.64753E-02 ppm1 4.925 ppm2 2.789 CV 1
ASSI { 1564}
(( segid "SUPF" and resid 109 and name HA ))
( segid "SUPF" and resid 109 and name HD2%)
2.200 0.600 0.600 peak 1564 spectrum 1 weight 0.10000E+01 volume 0.81818E-02 ppm1 4.475 ppm2 0.846 CV 1
ASSI { 1565}
(( segid "SUPF" and resid 109 and name HB2 ))
(( segid "SUPF" and resid 109 and name HA ))
2.400 0.700 0.700 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.39705E-02 ppm1 1.787 ppm2 4.473 CV 1
OR { 1565}
(( segid "SUPF" and resid 109 and name HB1 ))
(( segid "SUPF" and resid 109 and name HA ))
ASSI { 1566}
(( segid "SUPF" and resid 109 and name HB2 ))
( segid "SUPF" and resid 111 and name HD% )
2.600 0.800 0.800 peak 1566 spectrum 1 weight 0.10000E+01 volume 0.30535E-02 ppm1 1.788 ppm2 7.075 CV 1
OR { 1566}
(( segid "SUPF" and resid 109 and name HB1 ))
( segid "SUPF" and resid 111 and name HD% )
ASSI { 1567}
(( segid "SUPF" and resid 109 and name HB2 ))
( segid "SUPF" and resid 111 and name HE% )
3.200 1.300 1.300 peak 1567 spectrum 1 weight 0.10000E+01 volume 0.21931E-02 ppm1 1.790 ppm2 6.752 CV 1
OR { 1567}
(( segid "SUPF" and resid 109 and name HB1 ))
( segid "SUPF" and resid 111 and name HE% )
ASSI { 1568}
( segid "SUPF" and resid 109 and name HD1%)
( segid "SUPF" and resid 34 and name HD% )
2.700 0.900 0.900 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.29888E-02 ppm1 1.273 ppm2 7.199 CV 1
ASSI { 1569}
( segid "SUPF" and resid 109 and name HD1%)
( segid "SUPF" and resid 34 and name HE% )
3.700 1.800 1.800 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.86853E-03 ppm1 1.275 ppm2 7.285 CV 1
ASSI { 1570}
( segid "SUPF" and resid 109 and name HD1%)
(( segid "SUPF" and resid 109 and name HA ))
3.900 1.900 1.900 peak 1570 spectrum 1 weight 0.10000E+01 volume 0.18600E-02 ppm1 1.279 ppm2 4.466 CV 1
ASSI { 1571}
( segid "SUPF" and resid 109 and name HD1%)
(( segid "SUPF" and resid 109 and name HG ))
2.300 0.700 0.700 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.56427E-02 ppm1 1.273 ppm2 2.035 CV 1
ASSI { 1572}
( segid "SUPF" and resid 109 and name HD1%)
( segid "SUPF" and resid 111 and name HD% )
3.200 1.300 1.300 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.16583E-02 ppm1 1.272 ppm2 7.075 CV 1
ASSI { 1573}
( segid "SUPF" and resid 109 and name HD1%)
( segid "SUPF" and resid 111 and name HE% )
2.400 0.700 0.700 peak 1573 spectrum 1 weight 0.10000E+01 volume 0.58446E-02 ppm1 1.273 ppm2 6.751 CV 1
ASSI { 1576}
( segid "SUPF" and resid 109 and name HD2%)
( segid "SUPF" and resid 34 and name HD% )
3.300 1.400 1.400 peak 1576 spectrum 1 weight 0.10000E+01 volume 0.12567E-02 ppm1 0.846 ppm2 7.197 CV 1
ASSI { 1578}
( segid "SUPF" and resid 109 and name HD2%)
(( segid "SUPF" and resid 109 and name HB2 ))
2.500 0.800 0.800 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.61579E-02 ppm1 0.846 ppm2 1.787 CV 1
OR { 1578}
( segid "SUPF" and resid 109 and name HD2%)
(( segid "SUPF" and resid 109 and name HB1 ))
ASSI { 1579}
( segid "SUPF" and resid 109 and name HD2%)
(( segid "SUPF" and resid 109 and name HG ))
2.200 0.600 0.600 peak 1579 spectrum 1 weight 0.10000E+01 volume 0.75385E-02 ppm1 0.848 ppm2 2.034 CV 1
ASSI { 1580}
( segid "SUPF" and resid 109 and name HD2%)
( segid "SUPF" and resid 111 and name HD% )
3.900 1.900 1.900 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.97889E-03 ppm1 0.845 ppm2 7.075 CV 1
ASSI { 1581}
( segid "SUPF" and resid 109 and name HD2%)
( segid "SUPF" and resid 111 and name HE% )
4.000 2.000 2.000 peak 1581 spectrum 1 weight 0.10000E+01 volume 0.12392E-02 ppm1 0.843 ppm2 6.752 CV 1
ASSI { 1582}
(( segid "SUPF" and resid 110 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
3.800 1.800 1.800 peak 1582 spectrum 1 weight 0.10000E+01 volume 0.12239E-02 ppm1 4.144 ppm2 6.988 CV 1
ASSI { 1583}
(( segid "SUPF" and resid 110 and name HA ))
( segid "SUPF" and resid 80 and name HE% )
3.800 1.800 1.800 peak 1583 spectrum 1 weight 0.10000E+01 volume 0.70259E-03 ppm1 4.141 ppm2 7.556 CV 1
ASSI { 1585}
( segid "SUPF" and resid 110 and name HB% )
(( segid "SUPF" and resid 38 and name HB2 ))
2.800 1.000 1.000 peak 1585 spectrum 1 weight 0.10000E+01 volume 0.29655E-02 ppm1 1.500 ppm2 3.002 CV 1
OR { 1585}
( segid "SUPF" and resid 110 and name HB% )
(( segid "SUPF" and resid 38 and name HB1 ))
ASSI { 1586}
( segid "SUPF" and resid 110 and name HB% )
( segid "SUPF" and resid 38 and name HD% )
4.000 2.000 2.000 peak 1586 spectrum 1 weight 0.10000E+01 volume 0.93799E-03 ppm1 1.490 ppm2 6.992 CV 1
ASSI { 1587}
( segid "SUPF" and resid 110 and name HB% )
( segid "SUPF" and resid 38 and name HE% )
4.600 2.700 1.400 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.42717E-03 ppm1 1.487 ppm2 6.919 CV 1
ASSI { 1588}
( segid "SUPF" and resid 110 and name HB% )
( segid "SUPF" and resid 80 and name HD% )
2.800 1.000 1.000 peak 1588 spectrum 1 weight 0.10000E+01 volume 0.28882E-02 ppm1 1.488 ppm2 7.166 CV 1
ASSI { 1589}
( segid "SUPF" and resid 110 and name HB% )
( segid "SUPF" and resid 80 and name HE% )
2.700 0.900 0.900 peak 1589 spectrum 1 weight 0.10000E+01 volume 0.30489E-02 ppm1 1.491 ppm2 7.558 CV 1
ASSI { 1590}
( segid "SUPF" and resid 110 and name HB% )
(( segid "SUPF" and resid 80 and name HZ ))
2.900 2.900 3.100 peak 1590 spectrum 1 weight 0.10000E+01 volume 0.93010E-03 ppm1 1.492 ppm2 7.593 CV 1
ASSI { 1591}
( segid "SUPF" and resid 110 and name HB% )
(( segid "SUPF" and resid 110 and name HA ))
2.400 0.700 0.700 peak 1591 spectrum 1 weight 0.10000E+01 volume 0.71391E-02 ppm1 1.493 ppm2 4.142 CV 1
ASSI { 1592}
(( segid "SUPF" and resid 111 and name HA ))
(( segid "SUPF" and resid 111 and name HB1 ))
2.700 0.900 0.900 peak 1592 spectrum 1 weight 0.10000E+01 volume 0.52632E-02 ppm1 4.440 ppm2 2.859 CV 1
ASSI { 1593}
(( segid "SUPF" and resid 111 and name HA ))
(( segid "SUPF" and resid 111 and name HB2 ))
2.400 0.700 0.700 peak 1593 spectrum 1 weight 0.10000E+01 volume 0.49632E-02 ppm1 4.441 ppm2 3.176 CV 1
ASSI { 1594}
(( segid "SUPF" and resid 111 and name HA ))
( segid "SUPF" and resid 111 and name HD% )
3.400 1.400 1.400 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.26177E-02 ppm1 4.441 ppm2 7.075 CV 1
ASSI { 1597}
(( segid "SUPF" and resid 111 and name HB1 ))
(( segid "SUPF" and resid 111 and name HB2 ))
1.900 0.500 0.500 peak 1597 spectrum 1 weight 0.10000E+01 volume 0.78505E-02 ppm1 2.859 ppm2 3.177 CV 1
ASSI { 1598}
(( segid "SUPF" and resid 111 and name HB1 ))
( segid "SUPF" and resid 111 and name HD% )
2.500 0.800 0.800 peak 1598 spectrum 1 weight 0.10000E+01 volume 0.41952E-02 ppm1 2.860 ppm2 7.076 CV 1
ASSI { 1599}
(( segid "SUPF" and resid 111 and name HB1 ))
( segid "SUPF" and resid 111 and name HE% )
4.400 2.400 1.600 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.75168E-03 ppm1 2.856 ppm2 6.753 CV 1
ASSI { 1600}
(( segid "SUPF" and resid 111 and name HB2 ))
(( segid "SUPF" and resid 33 and name HA ))
4.000 2.000 2.000 peak 1600 spectrum 1 weight 0.10000E+01 volume 0.51400E-03 ppm1 3.173 ppm2 3.865 CV 1
ASSI { 1603}
(( segid "SUPF" and resid 111 and name HB2 ))
( segid "SUPF" and resid 111 and name HD% )
2.600 0.800 0.800 peak 1603 spectrum 1 weight 0.10000E+01 volume 0.35230E-02 ppm1 3.179 ppm2 7.075 CV 1
ASSI { 1607}
( segid "SUPF" and resid 111 and name HD% )
( segid "SUPF" and resid 34 and name HD% )
3.000 1.100 1.100 peak 1607 spectrum 1 weight 0.10000E+01 volume 0.20242E-02 ppm1 7.069 ppm2 7.201 CV 1
ASSI { 1608}
( segid "SUPF" and resid 111 and name HD% )
( segid "SUPF" and resid 34 and name HE% )
3.100 1.200 1.200 peak 1608 spectrum 1 weight 0.10000E+01 volume 0.20566E-02 ppm1 7.066 ppm2 7.280 CV 1
ASSI { 1615}
( segid "SUPF" and resid 111 and name HD% )
( segid "SUPF" and resid 111 and name HE% )
1.900 0.500 0.500 peak 1615 spectrum 1 weight 0.10000E+01 volume 0.20534E-01 ppm1 7.072 ppm2 6.751 CV 1
ASSI { 1616}
( segid "SUPF" and resid 111 and name HD% )
( segid "SUPF" and resid 112 and name HD1%)
4.600 2.600 1.400 peak 1616 spectrum 1 weight 0.10000E+01 volume 0.64139E-03 ppm1 7.076 ppm2 0.889 CV 1
ASSI { 1619}
( segid "SUPF" and resid 111 and name HE% )
( segid "SUPF" and resid 34 and name HD% )
2.900 1.100 1.100 peak 1619 spectrum 1 weight 0.10000E+01 volume 0.21004E-02 ppm1 6.750 ppm2 7.198 CV 1
ASSI { 1620}
( segid "SUPF" and resid 111 and name HE% )
( segid "SUPF" and resid 34 and name HE% )
3.100 1.200 1.200 peak 1620 spectrum 1 weight 0.10000E+01 volume 0.15373E-02 ppm1 6.751 ppm2 7.283 CV 1
ASSI { 1625}
( segid "SUPF" and resid 111 and name HE% )
(( segid "SUPF" and resid 111 and name HB2 ))
4.300 2.300 1.700 peak 1625 spectrum 1 weight 0.10000E+01 volume 0.78740E-03 ppm1 6.760 ppm2 3.178 CV 1
ASSI { 1629}
(( segid "SUPF" and resid 112 and name HA ))
( segid "SUPF" and resid 111 and name HD% )
3.800 1.800 1.800 peak 1629 spectrum 1 weight 0.10000E+01 volume 0.60113E-03 ppm1 3.962 ppm2 7.077 CV 1
ASSI { 1630}
(( segid "SUPF" and resid 112 and name HA ))
( segid "SUPF" and resid 111 and name HE% )
4.500 2.600 1.500 peak 1630 spectrum 1 weight 0.10000E+01 volume 0.52405E-03 ppm1 3.962 ppm2 6.752 CV 1
ASSI { 1631}
(( segid "SUPF" and resid 112 and name HA ))
(( segid "SUPF" and resid 112 and name HB1 ))
2.600 0.900 0.900 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.28718E-02 ppm1 3.963 ppm2 1.540 CV 1
ASSI { 1632}
(( segid "SUPF" and resid 112 and name HA ))
(( segid "SUPF" and resid 112 and name HB2 ))
2.800 1.000 1.000 peak 1632 spectrum 1 weight 0.10000E+01 volume 0.41578E-02 ppm1 3.968 ppm2 1.431 CV 1
ASSI { 1633}
(( segid "SUPF" and resid 112 and name HA ))
( segid "SUPF" and resid 112 and name HD1%)
3.900 1.900 1.900 peak 1633 spectrum 1 weight 0.10000E+01 volume 0.24606E-02 ppm1 3.965 ppm2 0.885 CV 1
ASSI { 1634}
(( segid "SUPF" and resid 112 and name HA ))
( segid "SUPF" and resid 112 and name HD2%)
2.200 0.600 0.600 peak 1634 spectrum 1 weight 0.10000E+01 volume 0.11050E-01 ppm1 3.965 ppm2 0.653 CV 1
ASSI { 1635}
(( segid "SUPF" and resid 112 and name HA ))
(( segid "SUPF" and resid 112 and name HG ))
3.400 1.400 1.400 peak 1635 spectrum 1 weight 0.10000E+01 volume 0.10410E-02 ppm1 3.965 ppm2 0.729 CV 1
ASSI { 1636}
(( segid "SUPF" and resid 112 and name HB1 ))
(( segid "SUPF" and resid 112 and name HB2 ))
1.800 0.400 0.400 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.11610E-01 ppm1 1.539 ppm2 1.428 CV 1
ASSI { 1637}
(( segid "SUPF" and resid 112 and name HB1 ))
( segid "SUPF" and resid 112 and name HD1%)
2.400 0.700 0.700 peak 1637 spectrum 1 weight 0.10000E+01 volume 0.66404E-02 ppm1 1.540 ppm2 0.887 CV 1
ASSI { 1638}
(( segid "SUPF" and resid 112 and name HB1 ))
(( segid "SUPF" and resid 112 and name HG ))
3.200 1.300 1.300 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.17452E-02 ppm1 1.548 ppm2 0.736 CV 1
ASSI { 1640}
(( segid "SUPF" and resid 112 and name HB2 ))
( segid "SUPF" and resid 112 and name HD1%)
2.400 0.700 0.700 peak 1640 spectrum 1 weight 0.10000E+01 volume 0.55792E-02 ppm1 1.433 ppm2 0.886 CV 1
ASSI { 1641}
(( segid "SUPF" and resid 112 and name HB2 ))
(( segid "SUPF" and resid 112 and name HG ))
2.900 1.100 1.100 peak 1641 spectrum 1 weight 0.10000E+01 volume 0.12608E-02 ppm1 1.437 ppm2 0.737 CV 1
ASSI { 1642}
( segid "SUPF" and resid 112 and name HD1%)
(( segid "SUPF" and resid 108 and name HB1 ))
2.900 2.900 3.100 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.94774E-03 ppm1 0.886 ppm2 3.006 CV 1
ASSI { 1643}
( segid "SUPF" and resid 112 and name HD1%)
(( segid "SUPF" and resid 108 and name HB2 ))
2.700 2.700 3.300 peak 1643 spectrum 1 weight 0.10000E+01 volume 0.14294E-02 ppm1 0.887 ppm2 2.790 CV 1
ASSI { 1645}
( segid "SUPF" and resid 112 and name HD1%)
( segid "SUPF" and resid 111 and name HE% )
3.500 1.500 1.500 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.16244E-02 ppm1 0.889 ppm2 6.751 CV 1
ASSI { 1647}
( segid "SUPF" and resid 112 and name HD2%)
( segid "SUPF" and resid 111 and name HD% )
3.300 1.400 1.400 peak 1647 spectrum 1 weight 0.10000E+01 volume 0.16474E-02 ppm1 0.656 ppm2 7.076 CV 1
ASSI { 1648}
( segid "SUPF" and resid 112 and name HD2%)
( segid "SUPF" and resid 111 and name HE% )
2.600 0.800 0.800 peak 1648 spectrum 1 weight 0.10000E+01 volume 0.42225E-02 ppm1 0.655 ppm2 6.752 CV 1
ASSI { 1650}
(( segid "SUPF" and resid 113 and name HA1 ))
(( segid "SUPF" and resid 113 and name HA2 ))
1.800 0.400 0.400 peak 1650 spectrum 1 weight 0.10000E+01 volume 0.16148E-01 ppm1 3.878 ppm2 3.641 CV 1
ASSI { 1652}
(( segid "SUPF" and resid 114 and name HA ))
( segid "SUPF" and resid 38 and name HD% )
3.400 1.400 1.400 peak 1652 spectrum 1 weight 0.10000E+01 volume 0.92859E-03 ppm1 3.820 ppm2 6.990 CV 1
ASSI { 1653}
(( segid "SUPF" and resid 114 and name HA ))
( segid "SUPF" and resid 38 and name HE% )
4.000 2.000 2.000 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.51874E-03 ppm1 3.821 ppm2 6.919 CV 1
ASSI { 1654}
(( segid "SUPF" and resid 114 and name HA ))
( segid "SUPF" and resid 114 and name HB% )
2.400 0.700 0.700 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.68283E-02 ppm1 3.817 ppm2 1.168 CV 1
ASSI { 1655}
( segid "SUPF" and resid 114 and name HB% )
( segid "SUPF" and resid 38 and name HD% )
3.200 1.300 1.300 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.15587E-02 ppm1 1.169 ppm2 6.993 CV 1
ASSI { 1656}
( segid "SUPF" and resid 114 and name HB% )
( segid "SUPF" and resid 38 and name HE% )
3.300 1.400 1.400 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.15296E-02 ppm1 1.172 ppm2 6.917 CV 1
ASSI { 1657}
( segid "SUPF" and resid 114 and name HB% )
( segid "SUPF" and resid 80 and name HE% )
2.900 1.000 1.000 peak 1657 spectrum 1 weight 0.10000E+01 volume 0.22024E-02 ppm1 1.171 ppm2 7.561 CV 1
ASSI { 1658}
( segid "SUPF" and resid 114 and name HB% )
(( segid "SUPF" and resid 80 and name HZ ))
2.800 2.800 3.200 peak 1658 spectrum 1 weight 0.10000E+01 volume 0.12930E-02 ppm1 1.171 ppm2 7.586 CV 1
ASSI { 1659}
( segid "SUPF" and resid 114 and name HB% )
(( segid "SUPF" and resid 110 and name HA ))
3.600 1.600 1.600 peak 1659 spectrum 1 weight 0.10000E+01 volume 0.68518E-03 ppm1 1.167 ppm2 4.140 CV 1
ASSI { 1661}
(( segid "SUPF" and resid 115 and name HA ))
( segid "SUPF" and resid 114 and name HB% )
3.300 1.300 1.300 peak 1661 spectrum 1 weight 0.10000E+01 volume 0.48576E-03 ppm1 4.478 ppm2 1.167 CV 1
ASSI { 1662}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 115 and name HB1 ))
2.500 0.800 0.800 peak 1662 spectrum 1 weight 0.10000E+01 volume 0.35423E-02 ppm1 4.475 ppm2 1.725 CV 1
ASSI { 1663}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 115 and name HB2 ))
3.000 1.100 1.100 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.17752E-02 ppm1 4.472 ppm2 1.569 CV 1
ASSI { 1665}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HD2 ))
3.500 1.600 1.600 peak 1665 spectrum 1 weight 0.10000E+01 volume 0.59871E-03 ppm1 4.481 ppm2 1.856 CV 1
OR { 1665}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HD1 ))
OR { 1665}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HG2 ))
OR { 1665}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HG1 ))
ASSI { 1667}
(( segid "SUPF" and resid 115 and name HA ))
(( segid "SUPF" and resid 116 and name HG1 ))
4.900 3.000 1.100 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.69560E-03 ppm1 4.479 ppm2 1.962 CV 1
ASSI { 1669}
(( segid "SUPF" and resid 115 and name HG2 ))
(( segid "SUPF" and resid 115 and name HA ))
3.000 1.100 1.100 peak 1669 spectrum 1 weight 0.10000E+01 volume 0.28326E-02 ppm1 1.355 ppm2 4.473 CV 1
OR { 1669}
(( segid "SUPF" and resid 115 and name HG1 ))
(( segid "SUPF" and resid 115 and name HA ))
ASSI { 1670}
(( segid "SUPF" and resid 116 and name HA ))
(( segid "SUPF" and resid 38 and name HZ ))
3.300 1.300 1.300 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.11492E-02 ppm1 4.396 ppm2 6.916 CV 1
ASSI { 1673}
(( segid "SUPF" and resid 116 and name HB1 ))
( segid "SUPF" and resid 38 and name HE% )
3.800 1.800 1.800 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.47683E-03 ppm1 2.214 ppm2 6.915 CV 1
ASSI { 1674}
(( segid "SUPF" and resid 116 and name HB1 ))
(( segid "SUPF" and resid 116 and name HA ))
2.300 0.600 0.600 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.73572E-02 ppm1 2.214 ppm2 4.397 CV 1
ASSI { 1675}
(( segid "SUPF" and resid 116 and name HB1 ))
(( segid "SUPF" and resid 116 and name HB2 ))
1.700 0.400 0.500 peak 1675 spectrum 1 weight 0.10000E+01 volume 0.15980E-01 ppm1 2.213 ppm2 1.870 CV 1
ASSI { 1676}
(( segid "SUPF" and resid 116 and name HB2 ))
(( segid "SUPF" and resid 116 and name HA ))
2.900 1.000 1.000 peak 1676 spectrum 1 weight 0.10000E+01 volume 0.38734E-02 ppm1 1.873 ppm2 4.397 CV 1
ASSI { 1678}
(( segid "SUPF" and resid 116 and name HD1 ))
( segid "SUPF" and resid 38 and name HE% )
3.300 1.300 1.300 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.76282E-03 ppm1 3.557 ppm2 6.918 CV 1
OR { 1678}
(( segid "SUPF" and resid 116 and name HD2 ))
( segid "SUPF" and resid 38 and name HE% )
ASSI { 1679}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 115 and name HA ))
2.000 0.500 0.500 peak 1679 spectrum 1 weight 0.10000E+01 volume 0.14489E-01 ppm1 3.554 ppm2 4.474 CV 1
OR { 1679}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 115 and name HA ))
ASSI { 1680}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 115 and name HG2 ))
4.000 2.000 2.000 peak 1680 spectrum 1 weight 0.10000E+01 volume 0.90612E-03 ppm1 3.555 ppm2 1.358 CV 1
OR { 1680}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 115 and name HG1 ))
OR { 1680}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 115 and name HG2 ))
OR { 1680}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 115 and name HG1 ))
ASSI { 1681}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 116 and name HB1 ))
3.300 1.400 1.400 peak 1681 spectrum 1 weight 0.10000E+01 volume 0.17395E-02 ppm1 3.553 ppm2 2.214 CV 1
OR { 1681}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 116 and name HB1 ))
ASSI { 1682}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 116 and name HG1 ))
2.400 0.700 0.700 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.57028E-02 ppm1 3.553 ppm2 1.959 CV 1
OR { 1682}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 116 and name HG1 ))
ASSI { 1683}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 116 and name HG2 ))
2.400 0.700 0.700 peak 1683 spectrum 1 weight 0.10000E+01 volume 0.57081E-02 ppm1 3.558 ppm2 1.848 CV 1
OR { 1683}
(( segid "SUPF" and resid 116 and name HD1 ))
(( segid "SUPF" and resid 116 and name HG2 ))
ASSI { 1684}
(( segid "SUPF" and resid 116 and name HD2 ))
(( segid "SUPF" and resid 115 and name HB1 ))
3.200 1.300 1.300 peak 1684 spectrum 1 weight 0.10000E+01 volume 0.27656E-02 ppm1 3.547 ppm2 1.727 CV 1
ASSI { 1685}
(( segid "SUPF" and resid 116 and name HG1 ))
(( segid "SUPF" and resid 116 and name HB1 ))
2.400 0.700 0.700 peak 1685 spectrum 1 weight 0.10000E+01 volume 0.42383E-02 ppm1 1.953 ppm2 2.209 CV 1
ASSI { 1686}
(( segid "SUPF" and resid 116 and name HG2 ))
(( segid "SUPF" and resid 116 and name HB1 ))
2.900 1.000 1.000 peak 1686 spectrum 1 weight 0.10000E+01 volume 0.51402E-02 ppm1 1.847 ppm2 2.209 CV 1
ASSI { 1687}
(( segid "SUPF" and resid 117 and name HD2 ))
( segid "SUPF" and resid 78 and name HD% )
3.100 3.100 2.900 peak 1687 spectrum 1 weight 0.10000E+01 volume 0.69271E-03 ppm1 3.208 ppm2 6.749 CV 1
OR { 1687}
(( segid "SUPF" and resid 117 and name HD1 ))
( segid "SUPF" and resid 78 and name HD% )
ASSI { 1688}
(( segid "SUPF" and resid 117 and name HD1 ))
( segid "SUPF" and resid 78 and name HE% )
3.100 1.200 1.200 peak 1688 spectrum 1 weight 0.10000E+01 volume 0.12345E-02 ppm1 3.209 ppm2 6.849 CV 1
OR { 1688}
(( segid "SUPF" and resid 117 and name HD2 ))
( segid "SUPF" and resid 78 and name HE% )
ASSI { 1689}
(( segid "SUPF" and resid 117 and name HD2 ))
(( segid "SUPF" and resid 117 and name HA ))
3.200 1.300 1.300 peak 1689 spectrum 1 weight 0.10000E+01 volume 0.35609E-02 ppm1 3.203 ppm2 4.367 CV 1
OR { 1689}
(( segid "SUPF" and resid 117 and name HD1 ))
(( segid "SUPF" and resid 117 and name HA ))
ASSI { 1690}
(( segid "SUPF" and resid 117 and name HG1 ))
(( segid "SUPF" and resid 117 and name HA ))
2.700 0.900 0.900 peak 1690 spectrum 1 weight 0.10000E+01 volume 0.41555E-02 ppm1 1.673 ppm2 4.365 CV 1
OR { 1690}
(( segid "SUPF" and resid 117 and name HG2 ))
(( segid "SUPF" and resid 117 and name HA ))
ASSI { 1692}
(( segid "SUPF" and resid 118 and name HB ))
( segid "SUPF" and resid 118 and name HG2%)
2.400 0.700 0.700 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.76818E-02 ppm1 4.232 ppm2 1.202 CV 1
ASSI { 1694}
(( segid "SUPF" and resid 119 and name HA ))
(( segid "SUPF" and resid 119 and name HB1 ))
3.100 1.200 1.200 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.23248E-02 ppm1 4.772 ppm2 2.775 CV 1
ASSI { 1695}
(( segid "SUPF" and resid 119 and name HA ))
(( segid "SUPF" and resid 119 and name HB2 ))
2.900 1.000 1.000 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.21447E-02 ppm1 4.779 ppm2 2.847 CV 1
ASSI { 5}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HG2 ))
4.600 2.700 1.400 peak 5 spectrum 1 weight 0.10000E+01 volume 0.48355E-03 ppm1 6.745 ppm2 2.335 CV 1
OR { 5}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HG1 ))
OR { 5}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HB2 ))
OR { 5}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HB1 ))
ASSI { 6}
(( segid "SUPF" and resid 31 and name HN ))
(( segid "SUPF" and resid 30 and name HA ))
2.800 1.000 1.000 peak 6 spectrum 1 weight 0.10000E+01 volume 0.24472E-02 ppm1 8.368 ppm2 4.300 CV 1
ASSI { 7}
(( segid "SUPF" and resid 31 and name HN ))
(( segid "SUPF" and resid 31 and name HB1 ))
4.000 2.000 2.000 peak 7 spectrum 1 weight 0.10000E+01 volume 0.60609E-03 ppm1 8.371 ppm2 2.660 CV 1
ASSI { 8}
(( segid "SUPF" and resid 31 and name HN ))
(( segid "SUPF" and resid 31 and name HB2 ))
3.300 1.400 1.400 peak 8 spectrum 1 weight 0.10000E+01 volume 0.97648E-03 ppm1 8.366 ppm2 2.804 CV 1
ASSI { 9}
(( segid "SUPF" and resid 32 and name HN ))
(( segid "SUPF" and resid 31 and name HA ))
2.700 0.900 0.900 peak 9 spectrum 1 weight 0.10000E+01 volume 0.33364E-02 ppm1 8.094 ppm2 4.625 CV 1
ASSI { 10}
(( segid "SUPF" and resid 32 and name HN ))
( segid "SUPF" and resid 32 and name HG2%)
3.300 1.400 1.400 peak 10 spectrum 1 weight 0.10000E+01 volume 0.11999E-02 ppm1 8.092 ppm2 1.082 CV 1
ASSI { 11}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 32 and name HA ))
2.700 0.900 0.900 peak 11 spectrum 1 weight 0.10000E+01 volume 0.30248E-02 ppm1 8.072 ppm2 4.597 CV 1
ASSI { 12}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 33 and name HA ))
2.700 0.900 0.900 peak 12 spectrum 1 weight 0.10000E+01 volume 0.36490E-02 ppm1 8.070 ppm2 3.843 CV 1
ASSI { 13}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 33 and name HB1 ))
2.700 0.900 0.900 peak 13 spectrum 1 weight 0.10000E+01 volume 0.36768E-02 ppm1 8.071 ppm2 1.382 CV 1
ASSI { 14}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 33 and name HB2 ))
2.400 0.700 0.700 peak 14 spectrum 1 weight 0.10000E+01 volume 0.55568E-02 ppm1 8.071 ppm2 1.812 CV 1
ASSI { 15}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 33 and name HG1 ))
3.800 1.800 1.800 peak 15 spectrum 1 weight 0.10000E+01 volume 0.94937E-03 ppm1 8.068 ppm2 1.524 CV 1
ASSI { 16}
(( segid "SUPF" and resid 33 and name HN ))
(( segid "SUPF" and resid 34 and name HN ))
2.900 1.100 1.100 peak 16 spectrum 1 weight 0.10000E+01 volume 0.16432E-02 ppm1 8.074 ppm2 8.390 CV 1
ASSI { 19}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 33 and name HB1 ))
2.900 1.100 1.100 peak 19 spectrum 1 weight 0.10000E+01 volume 0.18048E-02 ppm1 8.408 ppm2 1.378 CV 1
ASSI { 20}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 33 and name HB2 ))
3.900 1.900 1.900 peak 20 spectrum 1 weight 0.10000E+01 volume 0.80926E-03 ppm1 8.408 ppm2 1.816 CV 1
ASSI { 21}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 34 and name HA ))
3.000 1.100 1.100 peak 21 spectrum 1 weight 0.10000E+01 volume 0.18648E-02 ppm1 8.405 ppm2 4.896 CV 1
ASSI { 22}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 34 and name HB1 ))
3.600 1.600 1.600 peak 22 spectrum 1 weight 0.10000E+01 volume 0.25067E-02 ppm1 8.408 ppm2 2.779 CV 1
ASSI { 23}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 34 and name HB2 ))
2.900 1.100 1.100 peak 23 spectrum 1 weight 0.10000E+01 volume 0.13532E-02 ppm1 8.405 ppm2 3.475 CV 1
ASSI { 24}
(( segid "SUPF" and resid 34 and name HN ))
( segid "SUPF" and resid 34 and name HD% )
3.300 1.400 1.400 peak 24 spectrum 1 weight 0.10000E+01 volume 0.11711E-02 ppm1 8.402 ppm2 7.189 CV 1
ASSI { 25}
(( segid "SUPF" and resid 34 and name HN ))
(( segid "SUPF" and resid 35 and name HN ))
2.600 0.800 0.800 peak 25 spectrum 1 weight 0.10000E+01 volume 0.27950E-02 ppm1 8.406 ppm2 7.466 CV 1
ASSI { 26}
(( segid "SUPF" and resid 34 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
3.800 1.800 1.800 peak 26 spectrum 1 weight 0.10000E+01 volume 0.54724E-03 ppm1 8.413 ppm2 0.797 CV 1
ASSI { 27}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 32 and name HA ))
3.300 1.400 1.400 peak 27 spectrum 1 weight 0.10000E+01 volume 0.13556E-02 ppm1 7.465 ppm2 4.570 CV 1
ASSI { 29}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 34 and name HB1 ))
4.400 2.400 1.600 peak 29 spectrum 1 weight 0.10000E+01 volume 0.37235E-03 ppm1 7.462 ppm2 2.786 CV 1
ASSI { 30}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 35 and name HA ))
3.200 1.200 1.200 peak 30 spectrum 1 weight 0.10000E+01 volume 0.10453E-02 ppm1 7.465 ppm2 4.401 CV 1
ASSI { 31}
(( segid "SUPF" and resid 35 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
3.000 1.100 1.100 peak 31 spectrum 1 weight 0.10000E+01 volume 0.17321E-02 ppm1 7.465 ppm2 0.808 CV 1
ASSI { 33}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 36 and name HB1 ))
4.900 3.000 1.100 peak 33 spectrum 1 weight 0.10000E+01 volume 0.48578E-03 ppm1 7.466 ppm2 1.707 CV 1
ASSI { 34}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 36 and name HB2 ))
5.100 3.200 0.900 peak 34 spectrum 1 weight 0.10000E+01 volume 0.43579E-03 ppm1 7.469 ppm2 1.975 CV 1
ASSI { 35}
(( segid "SUPF" and resid 35 and name HN ))
(( segid "SUPF" and resid 36 and name HG1 ))
5.600 4.000 0.400 peak 35 spectrum 1 weight 0.10000E+01 volume 0.44435E-03 ppm1 7.465 ppm2 1.117 CV 1
ASSI { 38}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 35 and name HN ))
2.000 0.500 0.500 peak 38 spectrum 1 weight 0.10000E+01 volume 0.56725E-02 ppm1 7.810 ppm2 7.471 CV 1
ASSI { 39}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 35 and name HA ))
3.500 1.500 1.500 peak 39 spectrum 1 weight 0.10000E+01 volume 0.10829E-02 ppm1 7.810 ppm2 4.410 CV 1
ASSI { 40}
(( segid "SUPF" and resid 36 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
4.400 2.400 1.600 peak 40 spectrum 1 weight 0.10000E+01 volume 0.75391E-03 ppm1 7.811 ppm2 0.814 CV 1
ASSI { 41}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HA ))
2.900 1.100 1.100 peak 41 spectrum 1 weight 0.10000E+01 volume 0.13327E-02 ppm1 7.808 ppm2 5.003 CV 1
ASSI { 42}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HB1 ))
2.500 0.800 0.800 peak 42 spectrum 1 weight 0.10000E+01 volume 0.28291E-02 ppm1 7.809 ppm2 1.682 CV 1
ASSI { 43}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HB2 ))
2.600 0.900 0.900 peak 43 spectrum 1 weight 0.10000E+01 volume 0.29073E-02 ppm1 7.810 ppm2 1.980 CV 1
ASSI { 44}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HG1 ))
4.000 2.000 2.000 peak 44 spectrum 1 weight 0.10000E+01 volume 0.11175E-02 ppm1 7.810 ppm2 1.105 CV 1
ASSI { 45}
(( segid "SUPF" and resid 36 and name HN ))
(( segid "SUPF" and resid 36 and name HG2 ))
4.000 2.000 2.000 peak 45 spectrum 1 weight 0.10000E+01 volume 0.97449E-03 ppm1 7.809 ppm2 1.388 CV 1
ASSI { 46}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HA ))
2.600 0.900 0.900 peak 46 spectrum 1 weight 0.10000E+01 volume 0.25733E-02 ppm1 9.930 ppm2 5.010 CV 1
ASSI { 47}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HB2 ))
4.800 2.900 1.200 peak 47 spectrum 1 weight 0.10000E+01 volume 0.47302E-03 ppm1 9.938 ppm2 1.955 CV 1
ASSI { 48}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HD1 ))
4.400 2.400 1.600 peak 48 spectrum 1 weight 0.10000E+01 volume 0.63970E-03 ppm1 9.921 ppm2 1.416 CV 1
OR { 48}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HD2 ))
ASSI { 49}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 36 and name HG1 ))
4.100 2.100 1.900 peak 49 spectrum 1 weight 0.10000E+01 volume 0.31478E-03 ppm1 9.920 ppm2 1.118 CV 1
ASSI { 50}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 37 and name HB ))
3.100 1.200 1.200 peak 50 spectrum 1 weight 0.10000E+01 volume 0.11125E-02 ppm1 9.927 ppm2 1.780 CV 1
ASSI { 51}
(( segid "SUPF" and resid 37 and name HN ))
( segid "SUPF" and resid 37 and name HD1%)
4.500 2.600 1.500 peak 51 spectrum 1 weight 0.10000E+01 volume 0.56752E-03 ppm1 9.934 ppm2 0.685 CV 1
ASSI { 52}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 37 and name HG11))
3.100 1.200 1.200 peak 52 spectrum 1 weight 0.10000E+01 volume 0.84408E-03 ppm1 9.931 ppm2 1.643 CV 1
ASSI { 53}
(( segid "SUPF" and resid 37 and name HN ))
(( segid "SUPF" and resid 81 and name HN ))
3.600 1.600 1.600 peak 53 spectrum 1 weight 0.10000E+01 volume 0.49076E-03 ppm1 9.927 ppm2 9.080 CV 1
ASSI { 54}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 37 and name HA ))
2.400 0.700 0.700 peak 54 spectrum 1 weight 0.10000E+01 volume 0.44963E-02 ppm1 9.410 ppm2 4.244 CV 1
ASSI { 55}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 37 and name HB ))
4.300 2.400 1.700 peak 55 spectrum 1 weight 0.10000E+01 volume 0.42140E-03 ppm1 9.406 ppm2 1.791 CV 1
ASSI { 56}
(( segid "SUPF" and resid 38 and name HN ))
( segid "SUPF" and resid 37 and name HG2%)
2.800 1.000 1.000 peak 56 spectrum 1 weight 0.10000E+01 volume 0.21682E-02 ppm1 9.409 ppm2 0.705 CV 1
ASSI { 57}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 38 and name HA ))
3.200 1.300 1.300 peak 57 spectrum 1 weight 0.10000E+01 volume 0.99304E-03 ppm1 9.406 ppm2 4.728 CV 1
ASSI { 58}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 38 and name HB1 ))
2.500 0.800 0.800 peak 58 spectrum 1 weight 0.10000E+01 volume 0.40229E-02 ppm1 9.411 ppm2 3.003 CV 1
OR { 58}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 38 and name HB2 ))
ASSI { 59}
(( segid "SUPF" and resid 38 and name HN ))
( segid "SUPF" and resid 38 and name HD% )
4.500 2.600 1.500 peak 59 spectrum 1 weight 0.10000E+01 volume 0.60452E-03 ppm1 9.412 ppm2 7.004 CV 1
ASSI { 62}
(( segid "SUPF" and resid 38 and name HN ))
(( segid "SUPF" and resid 110 and name HN ))
3.300 1.400 1.400 peak 62 spectrum 1 weight 0.10000E+01 volume 0.12396E-02 ppm1 9.412 ppm2 9.238 CV 1
ASSI { 63}
(( segid "SUPF" and resid 38 and name HN ))
( segid "SUPF" and resid 110 and name HB% )
3.500 1.500 1.500 peak 63 spectrum 1 weight 0.10000E+01 volume 0.10168E-02 ppm1 9.404 ppm2 1.481 CV 1
ASSI { 64}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 38 and name HA ))
2.300 0.700 0.700 peak 64 spectrum 1 weight 0.10000E+01 volume 0.63012E-02 ppm1 7.818 ppm2 4.727 CV 1
ASSI { 65}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 38 and name HB2 ))
4.200 2.200 1.800 peak 65 spectrum 1 weight 0.10000E+01 volume 0.87040E-03 ppm1 7.821 ppm2 3.001 CV 1
OR { 65}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 38 and name HB1 ))
ASSI { 66}
(( segid "SUPF" and resid 39 and name HN ))
( segid "SUPF" and resid 38 and name HD% )
3.600 1.600 1.600 peak 66 spectrum 1 weight 0.10000E+01 volume 0.92196E-03 ppm1 7.815 ppm2 6.976 CV 1
ASSI { 67}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 39 and name HA ))
3.100 1.200 1.200 peak 67 spectrum 1 weight 0.10000E+01 volume 0.12122E-02 ppm1 7.820 ppm2 4.546 CV 1
ASSI { 68}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 39 and name HB ))
2.700 0.900 0.900 peak 68 spectrum 1 weight 0.10000E+01 volume 0.22904E-02 ppm1 7.820 ppm2 1.575 CV 1
ASSI { 69}
(( segid "SUPF" and resid 39 and name HN ))
( segid "SUPF" and resid 39 and name HG2%)
2.600 0.800 0.800 peak 69 spectrum 1 weight 0.10000E+01 volume 0.37284E-02 ppm1 7.818 ppm2 0.704 CV 1
ASSI { 70}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 79 and name HN ))
3.200 1.200 1.200 peak 70 spectrum 1 weight 0.10000E+01 volume 0.11802E-02 ppm1 7.815 ppm2 8.976 CV 1
ASSI { 71}
(( segid "SUPF" and resid 39 and name HN ))
(( segid "SUPF" and resid 80 and name HA ))
3.300 1.400 1.400 peak 71 spectrum 1 weight 0.10000E+01 volume 0.89444E-03 ppm1 7.821 ppm2 5.841 CV 1
ASSI { 72}
(( segid "SUPF" and resid 39 and name HN ))
( segid "SUPF" and resid 80 and name HD% )
4.200 2.200 1.800 peak 72 spectrum 1 weight 0.10000E+01 volume 0.58254E-03 ppm1 7.817 ppm2 7.157 CV 1
ASSI { 73}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 38 and name HE% )
3.400 1.500 1.500 peak 73 spectrum 1 weight 0.10000E+01 volume 0.10584E-02 ppm1 8.934 ppm2 6.925 CV 1
ASSI { 74}
(( segid "SUPF" and resid 40 and name HN ))
(( segid "SUPF" and resid 39 and name HA ))
2.300 0.700 0.700 peak 74 spectrum 1 weight 0.10000E+01 volume 0.58560E-02 ppm1 8.940 ppm2 4.520 CV 1
ASSI { 75}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 39 and name HG1%)
3.200 1.300 1.300 peak 75 spectrum 1 weight 0.10000E+01 volume 0.25218E-02 ppm1 8.939 ppm2 0.719 CV 1
OR { 75}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 39 and name HG2%)
ASSI { 76}
(( segid "SUPF" and resid 40 and name HN ))
(( segid "SUPF" and resid 40 and name HA1 ))
2.700 0.900 0.900 peak 76 spectrum 1 weight 0.10000E+01 volume 0.21147E-02 ppm1 8.941 ppm2 3.736 CV 1
ASSI { 77}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 105 and name HB% )
4.000 2.000 2.000 peak 77 spectrum 1 weight 0.10000E+01 volume 0.55199E-03 ppm1 8.943 ppm2 1.282 CV 1
ASSI { 79}
(( segid "SUPF" and resid 40 and name HN ))
(( segid "SUPF" and resid 106 and name HB1 ))
3.900 1.900 1.900 peak 79 spectrum 1 weight 0.10000E+01 volume 0.45803E-03 ppm1 8.947 ppm2 2.534 CV 1
ASSI { 80}
(( segid "SUPF" and resid 40 and name HN ))
(( segid "SUPF" and resid 107 and name HA ))
3.600 1.600 1.600 peak 80 spectrum 1 weight 0.10000E+01 volume 0.93534E-03 ppm1 8.937 ppm2 5.351 CV 1
ASSI { 81}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
4.100 2.100 1.900 peak 81 spectrum 1 weight 0.10000E+01 volume 0.79107E-03 ppm1 8.934 ppm2 1.046 CV 1
OR { 81}
(( segid "SUPF" and resid 40 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 83}
(( segid "SUPF" and resid 41 and name HN ))
( segid "SUPF" and resid 38 and name HE% )
4.400 2.400 1.600 peak 83 spectrum 1 weight 0.10000E+01 volume 0.53578E-03 ppm1 8.395 ppm2 6.901 CV 1
OR { 83}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 38 and name HZ ))
ASSI { 85}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 40 and name HA2 ))
2.600 0.800 0.800 peak 85 spectrum 1 weight 0.10000E+01 volume 0.27328E-02 ppm1 8.387 ppm2 4.591 CV 1
ASSI { 86}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 41 and name HA1 ))
3.000 1.100 1.100 peak 86 spectrum 1 weight 0.10000E+01 volume 0.33623E-02 ppm1 8.386 ppm2 4.021 CV 1
ASSI { 88}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 42 and name HB1 ))
4.500 2.500 1.500 peak 88 spectrum 1 weight 0.10000E+01 volume 0.11066E-02 ppm1 8.389 ppm2 1.267 CV 1
ASSI { 90}
(( segid "SUPF" and resid 41 and name HN ))
(( segid "SUPF" and resid 78 and name HB2 ))
4.500 2.500 1.500 peak 90 spectrum 1 weight 0.10000E+01 volume 0.70494E-03 ppm1 8.385 ppm2 3.213 CV 1
ASSI { 94}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 41 and name HN ))
2.700 0.900 0.900 peak 94 spectrum 1 weight 0.10000E+01 volume 0.26640E-02 ppm1 7.631 ppm2 8.381 CV 1
ASSI { 95}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 41 and name HA1 ))
3.900 1.900 1.900 peak 95 spectrum 1 weight 0.10000E+01 volume 0.75638E-03 ppm1 7.630 ppm2 4.034 CV 1
ASSI { 96}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 42 and name HA ))
2.900 1.100 1.100 peak 96 spectrum 1 weight 0.10000E+01 volume 0.15856E-02 ppm1 7.631 ppm2 4.301 CV 1
ASSI { 97}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 42 and name HB1 ))
3.000 1.100 1.100 peak 97 spectrum 1 weight 0.10000E+01 volume 0.61747E-02 ppm1 7.629 ppm2 1.261 CV 1
ASSI { 98}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 42 and name HB2 ))
2.500 0.800 0.800 peak 98 spectrum 1 weight 0.10000E+01 volume 0.30704E-02 ppm1 7.630 ppm2 0.986 CV 1
ASSI { 99}
(( segid "SUPF" and resid 42 and name HN ))
( segid "SUPF" and resid 42 and name HD1%)
3.700 1.700 1.700 peak 99 spectrum 1 weight 0.10000E+01 volume 0.19820E-02 ppm1 7.631 ppm2 0.483 CV 1
ASSI { 100}
(( segid "SUPF" and resid 42 and name HN ))
( segid "SUPF" and resid 42 and name HD2%)
3.700 1.700 1.700 peak 100 spectrum 1 weight 0.10000E+01 volume 0.14214E-02 ppm1 7.629 ppm2 0.657 CV 1
ASSI { 101}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 77 and name HA1 ))
4.000 2.100 2.000 peak 101 spectrum 1 weight 0.10000E+01 volume 0.41761E-03 ppm1 7.631 ppm2 3.273 CV 1
ASSI { 102}
(( segid "SUPF" and resid 42 and name HN ))
(( segid "SUPF" and resid 78 and name HA ))
3.600 1.700 1.700 peak 102 spectrum 1 weight 0.10000E+01 volume 0.60031E-03 ppm1 7.631 ppm2 5.166 CV 1
ASSI { 103}
(( segid "SUPF" and resid 44 and name HN ))
(( segid "SUPF" and resid 43 and name HA ))
2.800 1.000 1.000 peak 103 spectrum 1 weight 0.10000E+01 volume 0.21966E-02 ppm1 8.538 ppm2 4.369 CV 1
ASSI { 104}
(( segid "SUPF" and resid 44 and name HN ))
(( segid "SUPF" and resid 44 and name HA ))
3.500 1.500 1.500 peak 104 spectrum 1 weight 0.10000E+01 volume 0.68976E-03 ppm1 8.536 ppm2 4.163 CV 1
ASSI { 105}
(( segid "SUPF" and resid 44 and name HN ))
(( segid "SUPF" and resid 44 and name HB1 ))
4.300 2.300 1.700 peak 105 spectrum 1 weight 0.10000E+01 volume 0.60025E-03 ppm1 8.542 ppm2 3.232 CV 1
ASSI { 106}
(( segid "SUPF" and resid 44 and name HN ))
(( segid "SUPF" and resid 44 and name HB2 ))
3.200 1.200 1.200 peak 106 spectrum 1 weight 0.10000E+01 volume 0.94166E-03 ppm1 8.537 ppm2 3.023 CV 1
ASSI { 107}
(( segid "SUPF" and resid 44 and name HN ))
( segid "SUPF" and resid 44 and name HD% )
3.800 1.800 1.800 peak 107 spectrum 1 weight 0.10000E+01 volume 0.40577E-03 ppm1 8.544 ppm2 7.167 CV 1
ASSI { 111}
(( segid "SUPF" and resid 46 and name HN ))
(( segid "SUPF" and resid 66 and name HB ))
4.400 2.400 1.600 peak 111 spectrum 1 weight 0.10000E+01 volume 0.39589E-03 ppm1 6.994 ppm2 1.878 CV 1
ASSI { 112}
(( segid "SUPF" and resid 46 and name HN ))
(( segid "SUPF" and resid 46 and name HA ))
2.800 1.000 1.000 peak 112 spectrum 1 weight 0.10000E+01 volume 0.25627E-02 ppm1 6.993 ppm2 4.036 CV 1
ASSI { 113}
(( segid "SUPF" and resid 46 and name HN ))
(( segid "SUPF" and resid 46 and name HB ))
2.400 0.700 0.700 peak 113 spectrum 1 weight 0.10000E+01 volume 0.66361E-02 ppm1 6.992 ppm2 3.666 CV 1
ASSI { 114}
(( segid "SUPF" and resid 46 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
3.800 1.800 1.800 peak 114 spectrum 1 weight 0.10000E+01 volume 0.14538E-02 ppm1 6.996 ppm2 1.120 CV 1
ASSI { 115}
(( segid "SUPF" and resid 46 and name HN ))
(( segid "SUPF" and resid 47 and name HN ))
4.300 2.400 1.700 peak 115 spectrum 1 weight 0.10000E+01 volume 0.60013E-03 ppm1 6.997 ppm2 8.413 CV 1
ASSI { 117}
(( segid "SUPF" and resid 47 and name HN ))
( segid "SUPF" and resid 50 and name HG2%)
3.600 1.600 1.600 peak 117 spectrum 1 weight 0.10000E+01 volume 0.15611E-02 ppm1 8.411 ppm2 1.275 CV 1
ASSI { 118}
(( segid "SUPF" and resid 47 and name HN ))
(( segid "SUPF" and resid 46 and name HA ))
2.000 0.500 0.500 peak 118 spectrum 1 weight 0.10000E+01 volume 0.13539E-01 ppm1 8.413 ppm2 4.032 CV 1
ASSI { 119}
(( segid "SUPF" and resid 47 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
2.600 0.900 0.900 peak 119 spectrum 1 weight 0.10000E+01 volume 0.48696E-02 ppm1 8.412 ppm2 1.123 CV 1
ASSI { 120}
(( segid "SUPF" and resid 47 and name HN ))
(( segid "SUPF" and resid 47 and name HA ))
2.900 1.100 1.100 peak 120 spectrum 1 weight 0.10000E+01 volume 0.18687E-02 ppm1 8.413 ppm2 4.866 CV 1
ASSI { 121}
(( segid "SUPF" and resid 47 and name HN ))
(( segid "SUPF" and resid 50 and name HN ))
3.400 1.400 1.400 peak 121 spectrum 1 weight 0.10000E+01 volume 0.92184E-03 ppm1 8.413 ppm2 7.872 CV 1
ASSI { 122}
(( segid "SUPF" and resid 47 and name HN ))
(( segid "SUPF" and resid 50 and name HB ))
2.600 0.800 0.800 peak 122 spectrum 1 weight 0.10000E+01 volume 0.29288E-02 ppm1 8.414 ppm2 4.449 CV 1
ASSI { 123}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 47 and name HA ))
2.300 0.700 0.700 peak 123 spectrum 1 weight 0.10000E+01 volume 0.75379E-02 ppm1 8.786 ppm2 4.856 CV 1
ASSI { 124}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 47 and name HB1 ))
2.300 0.700 0.700 peak 124 spectrum 1 weight 0.10000E+01 volume 0.64825E-02 ppm1 8.785 ppm2 3.992 CV 1
ASSI { 125}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 47 and name HB2 ))
2.800 1.000 1.000 peak 125 spectrum 1 weight 0.10000E+01 volume 0.51182E-02 ppm1 8.786 ppm2 4.428 CV 1
ASSI { 126}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 48 and name HB1 ))
2.700 0.900 0.900 peak 126 spectrum 1 weight 0.10000E+01 volume 0.20495E-02 ppm1 8.786 ppm2 2.957 CV 1
ASSI { 127}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 48 and name HB2 ))
3.200 1.300 1.300 peak 127 spectrum 1 weight 0.10000E+01 volume 0.26891E-02 ppm1 8.783 ppm2 2.751 CV 1
ASSI { 128}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 49 and name HN ))
2.700 0.900 0.900 peak 128 spectrum 1 weight 0.10000E+01 volume 0.22801E-02 ppm1 8.786 ppm2 7.914 CV 1
ASSI { 129}
(( segid "SUPF" and resid 48 and name HN ))
(( segid "SUPF" and resid 66 and name HB ))
3.300 1.300 1.300 peak 129 spectrum 1 weight 0.10000E+01 volume 0.12062E-02 ppm1 8.788 ppm2 1.870 CV 1
ASSI { 130}
(( segid "SUPF" and resid 48 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
3.100 1.200 1.200 peak 130 spectrum 1 weight 0.10000E+01 volume 0.21640E-02 ppm1 8.785 ppm2 0.611 CV 1
ASSI { 131}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 47 and name HB1 ))
2.500 0.800 0.800 peak 131 spectrum 1 weight 0.10000E+01 volume 0.63000E-02 ppm1 7.920 ppm2 3.979 CV 1
ASSI { 132}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 47 and name HB2 ))
2.900 1.000 1.000 peak 132 spectrum 1 weight 0.10000E+01 volume 0.25669E-02 ppm1 7.921 ppm2 4.439 CV 1
ASSI { 134}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 48 and name HB1 ))
3.300 1.400 1.400 peak 134 spectrum 1 weight 0.10000E+01 volume 0.13878E-02 ppm1 7.920 ppm2 2.960 CV 1
ASSI { 135}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 48 and name HB2 ))
2.900 1.000 1.000 peak 135 spectrum 1 weight 0.10000E+01 volume 0.20516E-02 ppm1 7.921 ppm2 2.754 CV 1
ASSI { 136}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HA ))
2.600 0.800 0.800 peak 136 spectrum 1 weight 0.10000E+01 volume 0.39853E-02 ppm1 7.919 ppm2 4.147 CV 1
ASSI { 137}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HB2 ))
2.400 0.700 0.700 peak 137 spectrum 1 weight 0.10000E+01 volume 0.76577E-02 ppm1 7.920 ppm2 1.874 CV 1
OR { 137}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HB1 ))
ASSI { 138}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HG1 ))
3.900 1.900 1.900 peak 138 spectrum 1 weight 0.10000E+01 volume 0.10988E-02 ppm1 7.917 ppm2 1.487 CV 1
ASSI { 139}
(( segid "SUPF" and resid 49 and name HN ))
(( segid "SUPF" and resid 49 and name HG2 ))
3.000 1.100 1.100 peak 139 spectrum 1 weight 0.10000E+01 volume 0.60188E-03 ppm1 7.922 ppm2 1.374 CV 1
ASSI { 140}
(( segid "SUPF" and resid 50 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
4.200 2.200 1.800 peak 140 spectrum 1 weight 0.10000E+01 volume 0.81547E-03 ppm1 7.864 ppm2 1.107 CV 1
ASSI { 141}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 49 and name HG1 ))
3.200 1.300 1.300 peak 141 spectrum 1 weight 0.10000E+01 volume 0.57061E-03 ppm1 7.865 ppm2 1.465 CV 1
ASSI { 143}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 47 and name HB1 ))
4.000 2.000 2.000 peak 143 spectrum 1 weight 0.10000E+01 volume 0.96991E-03 ppm1 7.864 ppm2 3.995 CV 1
ASSI { 144}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 49 and name HB1 ))
3.100 1.200 1.200 peak 144 spectrum 1 weight 0.10000E+01 volume 0.38940E-02 ppm1 7.865 ppm2 1.842 CV 1
OR { 144}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 49 and name HB2 ))
ASSI { 145}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 50 and name HA ))
2.400 0.800 0.800 peak 145 spectrum 1 weight 0.10000E+01 volume 0.52628E-02 ppm1 7.866 ppm2 4.153 CV 1
ASSI { 146}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 50 and name HB ))
2.300 0.600 0.600 peak 146 spectrum 1 weight 0.10000E+01 volume 0.58905E-02 ppm1 7.865 ppm2 4.451 CV 1
ASSI { 147}
(( segid "SUPF" and resid 50 and name HN ))
( segid "SUPF" and resid 50 and name HG2%)
3.300 1.400 1.400 peak 147 spectrum 1 weight 0.10000E+01 volume 0.34668E-02 ppm1 7.865 ppm2 1.284 CV 1
ASSI { 148}
(( segid "SUPF" and resid 50 and name HN ))
(( segid "SUPF" and resid 51 and name HN ))
2.400 0.700 0.700 peak 148 spectrum 1 weight 0.10000E+01 volume 0.47047E-02 ppm1 7.865 ppm2 8.140 CV 1
ASSI { 152}
(( segid "SUPF" and resid 51 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
3.100 1.200 1.200 peak 152 spectrum 1 weight 0.10000E+01 volume 0.22158E-02 ppm1 8.148 ppm2 1.119 CV 1
ASSI { 153}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 48 and name HA ))
3.000 1.100 1.100 peak 153 spectrum 1 weight 0.10000E+01 volume 0.16506E-02 ppm1 8.149 ppm2 4.002 CV 1
ASSI { 155}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 50 and name HB ))
2.500 0.800 0.800 peak 155 spectrum 1 weight 0.10000E+01 volume 0.28368E-02 ppm1 8.147 ppm2 4.458 CV 1
ASSI { 156}
(( segid "SUPF" and resid 51 and name HN ))
( segid "SUPF" and resid 50 and name HG2%)
3.500 1.500 1.500 peak 156 spectrum 1 weight 0.10000E+01 volume 0.17287E-02 ppm1 8.148 ppm2 1.290 CV 1
ASSI { 157}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 51 and name HA ))
2.400 0.700 0.700 peak 157 spectrum 1 weight 0.10000E+01 volume 0.56651E-02 ppm1 8.147 ppm2 4.164 CV 1
ASSI { 158}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 51 and name HB1 ))
2.500 0.800 0.800 peak 158 spectrum 1 weight 0.10000E+01 volume 0.38371E-02 ppm1 8.147 ppm2 1.725 CV 1
ASSI { 159}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 51 and name HB2 ))
2.200 0.600 0.600 peak 159 spectrum 1 weight 0.10000E+01 volume 0.76505E-02 ppm1 8.148 ppm2 1.573 CV 1
ASSI { 160}
(( segid "SUPF" and resid 51 and name HN ))
( segid "SUPF" and resid 51 and name HD1%)
3.900 1.900 1.900 peak 160 spectrum 1 weight 0.10000E+01 volume 0.14731E-02 ppm1 8.148 ppm2 0.810 CV 1
ASSI { 161}
(( segid "SUPF" and resid 51 and name HN ))
( segid "SUPF" and resid 51 and name HD2%)
3.800 1.800 1.800 peak 161 spectrum 1 weight 0.10000E+01 volume 0.20386E-02 ppm1 8.148 ppm2 0.640 CV 1
ASSI { 162}
(( segid "SUPF" and resid 51 and name HN ))
(( segid "SUPF" and resid 52 and name HN ))
2.600 0.800 0.800 peak 162 spectrum 1 weight 0.10000E+01 volume 0.36054E-02 ppm1 8.147 ppm2 8.515 CV 1
ASSI { 166}
(( segid "SUPF" and resid 52 and name HN ))
(( segid "SUPF" and resid 51 and name HA ))
2.800 1.000 1.000 peak 166 spectrum 1 weight 0.10000E+01 volume 0.31627E-02 ppm1 8.524 ppm2 4.157 CV 1
ASSI { 167}
(( segid "SUPF" and resid 52 and name HN ))
(( segid "SUPF" and resid 51 and name HB1 ))
2.600 0.900 0.900 peak 167 spectrum 1 weight 0.10000E+01 volume 0.20511E-02 ppm1 8.525 ppm2 1.726 CV 1
ASSI { 168}
(( segid "SUPF" and resid 52 and name HN ))
(( segid "SUPF" and resid 51 and name HB2 ))
3.300 1.400 1.400 peak 168 spectrum 1 weight 0.10000E+01 volume 0.38697E-02 ppm1 8.529 ppm2 1.570 CV 1
ASSI { 169}
(( segid "SUPF" and resid 52 and name HN ))
(( segid "SUPF" and resid 52 and name HA ))
2.700 0.900 0.900 peak 169 spectrum 1 weight 0.10000E+01 volume 0.33983E-02 ppm1 8.525 ppm2 3.818 CV 1
ASSI { 171}
(( segid "SUPF" and resid 52 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
3.400 1.400 1.400 peak 171 spectrum 1 weight 0.10000E+01 volume 0.16872E-02 ppm1 8.527 ppm2 1.344 CV 1
ASSI { 173}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 51 and name HN ))
3.700 1.700 1.700 peak 173 spectrum 1 weight 0.10000E+01 volume 0.69451E-03 ppm1 8.484 ppm2 8.166 CV 1
ASSI { 174}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 52 and name HA ))
3.500 1.600 1.600 peak 174 spectrum 1 weight 0.10000E+01 volume 0.83366E-03 ppm1 8.488 ppm2 3.818 CV 1
ASSI { 175}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 52 and name HB1 ))
2.600 0.800 0.800 peak 175 spectrum 1 weight 0.10000E+01 volume 0.43491E-02 ppm1 8.487 ppm2 3.509 CV 1
OR { 175}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 52 and name HB2 ))
ASSI { 176}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 53 and name HB1 ))
2.600 0.900 0.900 peak 176 spectrum 1 weight 0.10000E+01 volume 0.34605E-02 ppm1 8.487 ppm2 2.078 CV 1
ASSI { 177}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 53 and name HB2 ))
2.400 0.700 0.700 peak 177 spectrum 1 weight 0.10000E+01 volume 0.59197E-02 ppm1 8.487 ppm2 2.262 CV 1
ASSI { 178}
(( segid "SUPF" and resid 53 and name HN ))
(( segid "SUPF" and resid 53 and name HG2 ))
3.400 1.400 1.400 peak 178 spectrum 1 weight 0.10000E+01 volume 0.46317E-02 ppm1 8.488 ppm2 2.620 CV 1
ASSI { 180}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 53 and name HN ))
2.700 0.900 0.900 peak 180 spectrum 1 weight 0.10000E+01 volume 0.26951E-02 ppm1 7.837 ppm2 8.483 CV 1
ASSI { 181}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 53 and name HB1 ))
2.800 1.000 1.000 peak 181 spectrum 1 weight 0.10000E+01 volume 0.16701E-02 ppm1 7.838 ppm2 2.085 CV 1
ASSI { 182}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 53 and name HB2 ))
3.700 1.700 1.700 peak 182 spectrum 1 weight 0.10000E+01 volume 0.20278E-02 ppm1 7.837 ppm2 2.253 CV 1
ASSI { 183}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 53 and name HG2 ))
4.300 2.300 1.700 peak 183 spectrum 1 weight 0.10000E+01 volume 0.48289E-03 ppm1 7.837 ppm2 2.630 CV 1
ASSI { 184}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 54 and name HA ))
2.600 0.800 0.800 peak 184 spectrum 1 weight 0.10000E+01 volume 0.49479E-02 ppm1 7.835 ppm2 4.130 CV 1
ASSI { 185}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 54 and name HB1 ))
2.600 0.800 0.800 peak 185 spectrum 1 weight 0.10000E+01 volume 0.36652E-02 ppm1 7.837 ppm2 2.836 CV 1
ASSI { 186}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 54 and name HB2 ))
2.500 0.800 0.800 peak 186 spectrum 1 weight 0.10000E+01 volume 0.43609E-02 ppm1 7.839 ppm2 3.212 CV 1
ASSI { 187}
(( segid "SUPF" and resid 54 and name HN ))
( segid "SUPF" and resid 54 and name HD% )
4.300 2.400 1.700 peak 187 spectrum 1 weight 0.10000E+01 volume 0.96051E-03 ppm1 7.841 ppm2 6.268 CV 1
ASSI { 188}
(( segid "SUPF" and resid 54 and name HN ))
(( segid "SUPF" and resid 55 and name HN ))
2.700 0.900 0.900 peak 188 spectrum 1 weight 0.10000E+01 volume 0.28964E-02 ppm1 7.837 ppm2 7.963 CV 1
ASSI { 190}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 52 and name HA ))
3.700 1.700 1.700 peak 190 spectrum 1 weight 0.10000E+01 volume 0.51492E-03 ppm1 7.968 ppm2 3.837 CV 1
ASSI { 191}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 54 and name HA ))
3.300 1.300 1.300 peak 191 spectrum 1 weight 0.10000E+01 volume 0.15361E-02 ppm1 7.966 ppm2 4.138 CV 1
ASSI { 192}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 54 and name HD% )
3.700 1.700 1.700 peak 192 spectrum 1 weight 0.10000E+01 volume 0.69560E-03 ppm1 7.961 ppm2 6.253 CV 1
ASSI { 193}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 55 and name HA ))
2.800 1.000 1.000 peak 193 spectrum 1 weight 0.10000E+01 volume 0.18644E-02 ppm1 7.963 ppm2 4.296 CV 1
ASSI { 194}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 55 and name HB1 ))
3.300 1.400 1.400 peak 194 spectrum 1 weight 0.10000E+01 volume 0.38646E-02 ppm1 7.966 ppm2 2.906 CV 1
ASSI { 196}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 55 and name HD% )
2.200 0.600 0.600 peak 196 spectrum 1 weight 0.10000E+01 volume 0.68205E-02 ppm1 7.967 ppm2 7.831 CV 1
ASSI { 197}
(( segid "SUPF" and resid 55 and name HN ))
(( segid "SUPF" and resid 56 and name HN ))
2.500 0.800 0.800 peak 197 spectrum 1 weight 0.10000E+01 volume 0.32365E-02 ppm1 7.966 ppm2 8.356 CV 1
ASSI { 198}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 58 and name HD% )
4.800 2.900 1.200 peak 198 spectrum 1 weight 0.10000E+01 volume 0.49577E-03 ppm1 7.964 ppm2 7.348 CV 1
ASSI { 199}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 61 and name HD1%)
3.500 1.600 1.600 peak 199 spectrum 1 weight 0.10000E+01 volume 0.13429E-02 ppm1 7.968 ppm2 0.402 CV 1
ASSI { 200}
(( segid "SUPF" and resid 55 and name HN ))
( segid "SUPF" and resid 81 and name HG1%)
4.900 3.000 1.100 peak 200 spectrum 1 weight 0.10000E+01 volume 0.41660E-03 ppm1 7.968 ppm2 0.577 CV 1
ASSI { 203}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 55 and name HB1 ))
3.900 1.900 1.900 peak 203 spectrum 1 weight 0.10000E+01 volume 0.70951E-03 ppm1 8.366 ppm2 2.915 CV 1
ASSI { 204}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 55 and name HB2 ))
3.700 1.800 1.800 peak 204 spectrum 1 weight 0.10000E+01 volume 0.44181E-03 ppm1 8.363 ppm2 3.266 CV 1
ASSI { 205}
(( segid "SUPF" and resid 56 and name HN ))
( segid "SUPF" and resid 55 and name HD% )
4.500 2.500 1.500 peak 205 spectrum 1 weight 0.10000E+01 volume 0.65139E-03 ppm1 8.364 ppm2 7.808 CV 1
ASSI { 206}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HA ))
2.600 0.800 0.800 peak 206 spectrum 1 weight 0.10000E+01 volume 0.40112E-02 ppm1 8.365 ppm2 4.498 CV 1
ASSI { 207}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HB1 ))
2.800 1.000 1.000 peak 207 spectrum 1 weight 0.10000E+01 volume 0.31929E-02 ppm1 8.365 ppm2 2.072 CV 1
ASSI { 208}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HB2 ))
2.400 0.700 0.700 peak 208 spectrum 1 weight 0.10000E+01 volume 0.37801E-02 ppm1 8.365 ppm2 2.155 CV 1
ASSI { 209}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HG1 ))
3.600 1.700 1.700 peak 209 spectrum 1 weight 0.10000E+01 volume 0.24581E-02 ppm1 8.365 ppm2 2.396 CV 1
ASSI { 210}
(( segid "SUPF" and resid 56 and name HN ))
(( segid "SUPF" and resid 56 and name HG2 ))
3.600 1.600 1.600 peak 210 spectrum 1 weight 0.10000E+01 volume 0.26934E-02 ppm1 8.366 ppm2 2.593 CV 1
ASSI { 213}
(( segid "SUPF" and resid 56 and name HN ))
( segid "SUPF" and resid 61 and name HD1%)
2.700 0.900 0.900 peak 213 spectrum 1 weight 0.10000E+01 volume 0.25233E-02 ppm1 8.366 ppm2 0.404 CV 1
ASSI { 214}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 56 and name HG2 ))
4.000 2.000 2.000 peak 214 spectrum 1 weight 0.10000E+01 volume 0.62699E-03 ppm1 6.734 ppm2 2.585 CV 1
ASSI { 216}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 56 and name HN ))
2.900 1.000 1.000 peak 216 spectrum 1 weight 0.10000E+01 volume 0.17943E-02 ppm1 6.736 ppm2 8.359 CV 1
ASSI { 217}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 56 and name HA ))
3.400 1.400 1.400 peak 217 spectrum 1 weight 0.10000E+01 volume 0.90950E-03 ppm1 6.734 ppm2 4.490 CV 1
ASSI { 220}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 57 and name HA ))
2.800 1.000 1.000 peak 220 spectrum 1 weight 0.10000E+01 volume 0.28985E-02 ppm1 6.734 ppm2 4.082 CV 1
ASSI { 222}
(( segid "SUPF" and resid 57 and name HN ))
(( segid "SUPF" and resid 58 and name HN ))
2.800 1.000 1.000 peak 222 spectrum 1 weight 0.10000E+01 volume 0.20716E-02 ppm1 6.732 ppm2 7.662 CV 1
ASSI { 223}
(( segid "SUPF" and resid 57 and name HN ))
( segid "SUPF" and resid 58 and name HD% )
3.900 1.900 1.900 peak 223 spectrum 1 weight 0.10000E+01 volume 0.68891E-03 ppm1 6.734 ppm2 7.368 CV 1
ASSI { 227}
(( segid "SUPF" and resid 57 and name HE21))
(( segid "SUPF" and resid 57 and name HA ))
3.800 1.800 1.800 peak 227 spectrum 1 weight 0.10000E+01 volume 0.82709E-03 ppm1 6.740 ppm2 4.093 CV 1
ASSI { 228}
(( segid "SUPF" and resid 57 and name HE22))
(( segid "SUPF" and resid 57 and name HE21))
2.000 0.500 0.500 peak 228 spectrum 1 weight 0.10000E+01 volume 0.83360E-02 ppm1 6.082 ppm2 6.741 CV 1
ASSI { 230}
(( segid "SUPF" and resid 57 and name HE21))
(( segid "SUPF" and resid 57 and name HG1 ))
3.100 1.200 1.200 peak 230 spectrum 1 weight 0.10000E+01 volume 0.24214E-02 ppm1 6.739 ppm2 1.540 CV 1
ASSI { 231}
(( segid "SUPF" and resid 57 and name HE22))
(( segid "SUPF" and resid 57 and name HG1 ))
4.200 2.200 1.800 peak 231 spectrum 1 weight 0.10000E+01 volume 0.98196E-03 ppm1 6.083 ppm2 1.517 CV 1
ASSI { 232}
(( segid "SUPF" and resid 57 and name HE21))
(( segid "SUPF" and resid 57 and name HG2 ))
3.100 1.200 1.200 peak 232 spectrum 1 weight 0.10000E+01 volume 0.89191E-03 ppm1 6.740 ppm2 0.234 CV 1
ASSI { 233}
(( segid "SUPF" and resid 57 and name HE22))
(( segid "SUPF" and resid 57 and name HG2 ))
4.600 2.700 1.400 peak 233 spectrum 1 weight 0.10000E+01 volume 0.48966E-03 ppm1 6.087 ppm2 0.218 CV 1
ASSI { 234}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 56 and name HA ))
3.400 1.400 1.400 peak 234 spectrum 1 weight 0.10000E+01 volume 0.10502E-02 ppm1 7.671 ppm2 4.507 CV 1
ASSI { 236}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 57 and name HA ))
3.800 1.800 1.800 peak 236 spectrum 1 weight 0.10000E+01 volume 0.61163E-03 ppm1 7.673 ppm2 4.065 CV 1
ASSI { 237}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 57 and name HG1 ))
3.300 1.300 1.300 peak 237 spectrum 1 weight 0.10000E+01 volume 0.16935E-02 ppm1 7.672 ppm2 1.545 CV 1
ASSI { 238}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 57 and name HG2 ))
3.300 1.400 1.400 peak 238 spectrum 1 weight 0.10000E+01 volume 0.94112E-03 ppm1 7.679 ppm2 0.203 CV 1
ASSI { 239}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 58 and name HA ))
3.000 1.100 1.100 peak 239 spectrum 1 weight 0.10000E+01 volume 0.17359E-02 ppm1 7.675 ppm2 4.696 CV 1
ASSI { 240}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 58 and name HB1 ))
3.400 1.500 1.500 peak 240 spectrum 1 weight 0.10000E+01 volume 0.26905E-02 ppm1 7.675 ppm2 2.897 CV 1
ASSI { 241}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 58 and name HB2 ))
2.800 1.000 1.000 peak 241 spectrum 1 weight 0.10000E+01 volume 0.16004E-02 ppm1 7.677 ppm2 3.631 CV 1
ASSI { 242}
(( segid "SUPF" and resid 58 and name HN ))
(( segid "SUPF" and resid 59 and name HN ))
2.400 0.700 0.700 peak 242 spectrum 1 weight 0.10000E+01 volume 0.67952E-02 ppm1 7.675 ppm2 7.350 CV 1
ASSI { 243}
(( segid "SUPF" and resid 58 and name HN ))
( segid "SUPF" and resid 83 and name HE% )
3.800 1.800 1.800 peak 243 spectrum 1 weight 0.10000E+01 volume 0.71144E-03 ppm1 7.676 ppm2 1.954 CV 1
ASSI { 245}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 57 and name HA ))
3.700 1.700 1.700 peak 245 spectrum 1 weight 0.10000E+01 volume 0.72307E-03 ppm1 7.335 ppm2 4.057 CV 1
ASSI { 247}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 58 and name HA ))
3.300 1.400 1.400 peak 247 spectrum 1 weight 0.10000E+01 volume 0.13549E-02 ppm1 7.335 ppm2 4.706 CV 1
ASSI { 248}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 58 and name HB1 ))
4.100 2.100 1.900 peak 248 spectrum 1 weight 0.10000E+01 volume 0.76306E-03 ppm1 7.333 ppm2 2.893 CV 1
ASSI { 249}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 58 and name HB2 ))
3.700 1.700 1.700 peak 249 spectrum 1 weight 0.10000E+01 volume 0.47588E-03 ppm1 7.336 ppm2 3.658 CV 1
ASSI { 250}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 59 and name HA1 ))
2.700 0.900 0.900 peak 250 spectrum 1 weight 0.10000E+01 volume 0.44812E-02 ppm1 7.336 ppm2 4.515 CV 1
ASSI { 251}
(( segid "SUPF" and resid 59 and name HN ))
(( segid "SUPF" and resid 59 and name HA2 ))
2.700 0.900 0.900 peak 251 spectrum 1 weight 0.10000E+01 volume 0.34824E-02 ppm1 7.336 ppm2 3.855 CV 1
ASSI { 252}
(( segid "SUPF" and resid 59 and name HN ))
( segid "SUPF" and resid 83 and name HE% )
3.100 1.200 1.200 peak 252 spectrum 1 weight 0.10000E+01 volume 0.16758E-02 ppm1 7.335 ppm2 1.926 CV 1
ASSI { 254}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 59 and name HN ))
4.300 2.300 1.700 peak 254 spectrum 1 weight 0.10000E+01 volume 0.69114E-03 ppm1 8.214 ppm2 7.339 CV 1
ASSI { 255}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 59 and name HA1 ))
2.500 0.800 0.800 peak 255 spectrum 1 weight 0.10000E+01 volume 0.52475E-02 ppm1 8.208 ppm2 4.538 CV 1
ASSI { 256}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 59 and name HA2 ))
2.600 0.800 0.800 peak 256 spectrum 1 weight 0.10000E+01 volume 0.55376E-02 ppm1 8.208 ppm2 3.856 CV 1
ASSI { 257}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 60 and name HA ))
2.600 0.800 0.800 peak 257 spectrum 1 weight 0.10000E+01 volume 0.44436E-02 ppm1 8.208 ppm2 4.717 CV 1
ASSI { 258}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 60 and name HB1 ))
2.800 1.000 1.000 peak 258 spectrum 1 weight 0.10000E+01 volume 0.77144E-02 ppm1 8.205 ppm2 2.534 CV 1
ASSI { 260}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 84 and name HB1 ))
3.500 1.500 1.500 peak 260 spectrum 1 weight 0.10000E+01 volume 0.11349E-02 ppm1 8.207 ppm2 1.727 CV 1
ASSI { 261}
(( segid "SUPF" and resid 60 and name HN ))
(( segid "SUPF" and resid 84 and name HB2 ))
3.900 1.900 1.900 peak 261 spectrum 1 weight 0.10000E+01 volume 0.14416E-02 ppm1 8.205 ppm2 1.902 CV 1
ASSI { 262}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 60 and name HN ))
4.800 2.800 1.200 peak 262 spectrum 1 weight 0.10000E+01 volume 0.45557E-03 ppm1 8.801 ppm2 8.217 CV 1
ASSI { 263}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 60 and name HA ))
2.200 0.600 0.600 peak 263 spectrum 1 weight 0.10000E+01 volume 0.11294E-01 ppm1 8.801 ppm2 4.723 CV 1
ASSI { 264}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 60 and name HB2 ))
3.500 1.600 1.600 peak 264 spectrum 1 weight 0.10000E+01 volume 0.23158E-02 ppm1 8.799 ppm2 2.576 CV 1
ASSI { 265}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 61 and name HA ))
2.800 0.900 0.900 peak 265 spectrum 1 weight 0.10000E+01 volume 0.22506E-02 ppm1 8.801 ppm2 4.142 CV 1
ASSI { 266}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 61 and name HB ))
2.300 0.700 0.700 peak 266 spectrum 1 weight 0.10000E+01 volume 0.64470E-02 ppm1 8.800 ppm2 1.511 CV 1
ASSI { 267}
(( segid "SUPF" and resid 61 and name HN ))
( segid "SUPF" and resid 61 and name HD1%)
4.300 2.300 1.700 peak 267 spectrum 1 weight 0.10000E+01 volume 0.70831E-03 ppm1 8.803 ppm2 0.395 CV 1
ASSI { 268}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 61 and name HG12))
4.300 2.300 1.700 peak 268 spectrum 1 weight 0.10000E+01 volume 0.72337E-03 ppm1 8.797 ppm2 1.007 CV 1
ASSI { 269}
(( segid "SUPF" and resid 61 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
3.700 1.700 1.700 peak 269 spectrum 1 weight 0.10000E+01 volume 0.15573E-02 ppm1 8.803 ppm2 0.590 CV 1
ASSI { 270}
(( segid "SUPF" and resid 61 and name HN ))
(( segid "SUPF" and resid 84 and name HB1 ))
3.900 1.900 1.900 peak 270 spectrum 1 weight 0.10000E+01 volume 0.53869E-03 ppm1 8.798 ppm2 1.706 CV 1
ASSI { 273}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 61 and name HN ))
4.200 2.200 1.800 peak 273 spectrum 1 weight 0.10000E+01 volume 0.47288E-03 ppm1 9.117 ppm2 8.809 CV 1
ASSI { 274}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 61 and name HA ))
2.100 0.600 0.600 peak 274 spectrum 1 weight 0.10000E+01 volume 0.68427E-02 ppm1 9.109 ppm2 4.140 CV 1
ASSI { 275}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 61 and name HG11))
4.900 3.000 1.100 peak 275 spectrum 1 weight 0.10000E+01 volume 0.50910E-03 ppm1 9.115 ppm2 1.482 CV 1
ASSI { 276}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 61 and name HG12))
4.500 2.500 1.500 peak 276 spectrum 1 weight 0.10000E+01 volume 0.62097E-03 ppm1 9.110 ppm2 1.000 CV 1
ASSI { 277}
(( segid "SUPF" and resid 62 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
2.700 0.900 0.900 peak 277 spectrum 1 weight 0.10000E+01 volume 0.30456E-02 ppm1 9.109 ppm2 0.585 CV 1
ASSI { 278}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HA ))
3.000 1.100 1.100 peak 278 spectrum 1 weight 0.10000E+01 volume 0.18388E-02 ppm1 9.109 ppm2 4.399 CV 1
ASSI { 279}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HB1 ))
3.600 1.600 1.600 peak 279 spectrum 1 weight 0.10000E+01 volume 0.22275E-02 ppm1 9.110 ppm2 1.663 CV 1
ASSI { 280}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HB2 ))
2.600 0.800 0.800 peak 280 spectrum 1 weight 0.10000E+01 volume 0.21045E-02 ppm1 9.111 ppm2 1.807 CV 1
ASSI { 281}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HG1 ))
3.300 1.400 1.400 peak 281 spectrum 1 weight 0.10000E+01 volume 0.92817E-03 ppm1 9.111 ppm2 2.081 CV 1
OR { 281}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 62 and name HG2 ))
ASSI { 283}
(( segid "SUPF" and resid 62 and name HN ))
(( segid "SUPF" and resid 83 and name HA ))
3.000 1.100 1.100 peak 283 spectrum 1 weight 0.10000E+01 volume 0.20252E-02 ppm1 9.109 ppm2 5.100 CV 1
ASSI { 285}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
3.500 1.500 1.500 peak 285 spectrum 1 weight 0.10000E+01 volume 0.47087E-03 ppm1 7.534 ppm2 1.486 CV 1
OR { 285}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 61 and name HD1%)
ASSI { 286}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 61 and name HA ))
3.600 1.700 1.700 peak 286 spectrum 1 weight 0.10000E+01 volume 0.14870E-02 ppm1 7.528 ppm2 4.137 CV 1
ASSI { 287}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
2.200 0.600 0.600 peak 287 spectrum 1 weight 0.10000E+01 volume 0.60332E-02 ppm1 7.532 ppm2 0.587 CV 1
ASSI { 288}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HN ))
2.400 0.700 0.700 peak 288 spectrum 1 weight 0.10000E+01 volume 0.53876E-02 ppm1 7.529 ppm2 9.108 CV 1
ASSI { 289}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HA ))
3.500 1.500 1.500 peak 289 spectrum 1 weight 0.10000E+01 volume 0.10766E-02 ppm1 7.531 ppm2 4.402 CV 1
ASSI { 290}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HB1 ))
3.600 1.600 1.600 peak 290 spectrum 1 weight 0.10000E+01 volume 0.16915E-02 ppm1 7.529 ppm2 1.658 CV 1
ASSI { 291}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HB2 ))
2.500 0.800 0.800 peak 291 spectrum 1 weight 0.10000E+01 volume 0.25652E-02 ppm1 7.532 ppm2 1.807 CV 1
ASSI { 292}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HG1 ))
4.200 2.200 1.800 peak 292 spectrum 1 weight 0.10000E+01 volume 0.10386E-02 ppm1 7.529 ppm2 2.111 CV 1
OR { 292}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 62 and name HG2 ))
ASSI { 293}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 63 and name HA ))
2.800 1.000 1.000 peak 293 spectrum 1 weight 0.10000E+01 volume 0.21537E-02 ppm1 7.532 ppm2 4.600 CV 1
ASSI { 294}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 63 and name HB2 ))
2.700 0.900 0.900 peak 294 spectrum 1 weight 0.10000E+01 volume 0.31728E-02 ppm1 7.531 ppm2 2.013 CV 1
OR { 294}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 63 and name HB1 ))
ASSI { 295}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 64 and name HN ))
3.800 1.800 1.800 peak 295 spectrum 1 weight 0.10000E+01 volume 0.84408E-03 ppm1 7.532 ppm2 8.929 CV 1
ASSI { 296}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
4.500 2.500 1.500 peak 296 spectrum 1 weight 0.10000E+01 volume 0.49649E-03 ppm1 7.533 ppm2 1.338 CV 1
ASSI { 297}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 82 and name HN ))
2.900 1.000 1.000 peak 297 spectrum 1 weight 0.10000E+01 volume 0.21709E-02 ppm1 7.534 ppm2 9.511 CV 1
ASSI { 298}
(( segid "SUPF" and resid 63 and name HN ))
(( segid "SUPF" and resid 82 and name HB ))
2.500 0.800 0.800 peak 298 spectrum 1 weight 0.10000E+01 volume 0.34031E-02 ppm1 7.531 ppm2 3.943 CV 1
ASSI { 299}
(( segid "SUPF" and resid 63 and name HN ))
( segid "SUPF" and resid 82 and name HG2%)
4.200 2.200 1.800 peak 299 spectrum 1 weight 0.10000E+01 volume 0.81733E-03 ppm1 7.528 ppm2 1.165 CV 1
ASSI { 301}
(( segid "SUPF" and resid 64 and name HN ))
( segid "SUPF" and resid 61 and name HG2%)
3.400 1.500 1.500 peak 301 spectrum 1 weight 0.10000E+01 volume 0.10744E-02 ppm1 8.911 ppm2 0.603 CV 1
ASSI { 303}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 63 and name HA ))
2.100 0.500 0.500 peak 303 spectrum 1 weight 0.10000E+01 volume 0.12787E-01 ppm1 8.908 ppm2 4.600 CV 1
ASSI { 304}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 63 and name HB2 ))
3.500 1.600 1.600 peak 304 spectrum 1 weight 0.10000E+01 volume 0.31794E-02 ppm1 8.907 ppm2 2.025 CV 1
OR { 304}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 63 and name HB1 ))
ASSI { 305}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 63 and name HG1 ))
3.200 1.300 1.300 peak 305 spectrum 1 weight 0.10000E+01 volume 0.18556E-02 ppm1 8.906 ppm2 2.201 CV 1
ASSI { 306}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 64 and name HA ))
2.800 1.000 1.000 peak 306 spectrum 1 weight 0.10000E+01 volume 0.19700E-02 ppm1 8.909 ppm2 5.177 CV 1
ASSI { 307}
(( segid "SUPF" and resid 64 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
2.600 0.800 0.800 peak 307 spectrum 1 weight 0.10000E+01 volume 0.32963E-02 ppm1 8.906 ppm2 1.338 CV 1
ASSI { 308}
(( segid "SUPF" and resid 64 and name HN ))
(( segid "SUPF" and resid 65 and name HN ))
3.700 1.700 1.700 peak 308 spectrum 1 weight 0.10000E+01 volume 0.99792E-03 ppm1 8.906 ppm2 8.742 CV 1
ASSI { 309}
(( segid "SUPF" and resid 64 and name HN ))
( segid "SUPF" and resid 65 and name HG1%)
3.600 1.700 1.700 peak 309 spectrum 1 weight 0.10000E+01 volume 0.60928E-03 ppm1 8.904 ppm2 0.950 CV 1
OR { 309}
(( segid "SUPF" and resid 64 and name HN ))
( segid "SUPF" and resid 65 and name HG2%)
ASSI { 312}
(( segid "SUPF" and resid 65 and name HN ))
(( segid "SUPF" and resid 64 and name HA ))
2.100 0.600 0.600 peak 312 spectrum 1 weight 0.10000E+01 volume 0.92275E-02 ppm1 8.753 ppm2 5.179 CV 1
ASSI { 313}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
3.400 1.400 1.400 peak 313 spectrum 1 weight 0.10000E+01 volume 0.19993E-02 ppm1 8.753 ppm2 1.346 CV 1
ASSI { 314}
(( segid "SUPF" and resid 65 and name HN ))
(( segid "SUPF" and resid 65 and name HA ))
2.500 0.800 0.800 peak 314 spectrum 1 weight 0.10000E+01 volume 0.38029E-02 ppm1 8.754 ppm2 4.711 CV 1
ASSI { 315}
(( segid "SUPF" and resid 65 and name HN ))
(( segid "SUPF" and resid 65 and name HB ))
3.600 1.600 1.600 peak 315 spectrum 1 weight 0.10000E+01 volume 0.13438E-02 ppm1 8.750 ppm2 1.981 CV 1
ASSI { 316}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 65 and name HG2%)
2.600 0.800 0.800 peak 316 spectrum 1 weight 0.10000E+01 volume 0.44442E-02 ppm1 8.753 ppm2 0.959 CV 1
OR { 316}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 65 and name HG1%)
ASSI { 317}
(( segid "SUPF" and resid 65 and name HN ))
(( segid "SUPF" and resid 66 and name HA ))
4.000 2.000 2.000 peak 317 spectrum 1 weight 0.10000E+01 volume 0.41540E-03 ppm1 8.753 ppm2 3.930 CV 1
ASSI { 318}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
3.600 1.600 1.600 peak 318 spectrum 1 weight 0.10000E+01 volume 0.13131E-02 ppm1 8.753 ppm2 0.628 CV 1
ASSI { 319}
(( segid "SUPF" and resid 65 and name HN ))
( segid "SUPF" and resid 81 and name HG2%)
4.200 2.200 1.800 peak 319 spectrum 1 weight 0.10000E+01 volume 0.64253E-03 ppm1 8.751 ppm2 0.397 CV 1
ASSI { 321}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 48 and name HB1 ))
3.400 1.400 1.400 peak 321 spectrum 1 weight 0.10000E+01 volume 0.53278E-03 ppm1 8.511 ppm2 2.982 CV 1
ASSI { 322}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 65 and name HN ))
3.800 1.800 1.800 peak 322 spectrum 1 weight 0.10000E+01 volume 0.93606E-03 ppm1 8.509 ppm2 8.747 CV 1
ASSI { 323}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 65 and name HA ))
2.000 0.500 0.500 peak 323 spectrum 1 weight 0.10000E+01 volume 0.14000E-01 ppm1 8.512 ppm2 4.705 CV 1
ASSI { 324}
(( segid "SUPF" and resid 66 and name HN ))
( segid "SUPF" and resid 65 and name HG2%)
3.200 1.300 1.300 peak 324 spectrum 1 weight 0.10000E+01 volume 0.35266E-02 ppm1 8.511 ppm2 0.949 CV 1
OR { 324}
(( segid "SUPF" and resid 66 and name HN ))
( segid "SUPF" and resid 65 and name HG1%)
ASSI { 325}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 66 and name HA ))
2.700 0.900 0.900 peak 325 spectrum 1 weight 0.10000E+01 volume 0.20019E-02 ppm1 8.514 ppm2 3.945 CV 1
ASSI { 326}
(( segid "SUPF" and resid 66 and name HN ))
(( segid "SUPF" and resid 66 and name HB ))
2.300 0.700 0.700 peak 326 spectrum 1 weight 0.10000E+01 volume 0.63398E-02 ppm1 8.512 ppm2 1.870 CV 1
ASSI { 327}
(( segid "SUPF" and resid 66 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.700 1.700 1.700 peak 327 spectrum 1 weight 0.10000E+01 volume 0.19067E-02 ppm1 8.511 ppm2 0.773 CV 1
ASSI { 328}
(( segid "SUPF" and resid 66 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
2.500 0.800 0.800 peak 328 spectrum 1 weight 0.10000E+01 volume 0.41756E-02 ppm1 8.511 ppm2 0.619 CV 1
ASSI { 330}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 66 and name HA ))
2.100 0.600 0.600 peak 330 spectrum 1 weight 0.10000E+01 volume 0.69397E-02 ppm1 8.716 ppm2 3.925 CV 1
ASSI { 331}
(( segid "SUPF" and resid 67 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.000 1.100 1.100 peak 331 spectrum 1 weight 0.10000E+01 volume 0.23950E-02 ppm1 8.715 ppm2 0.761 CV 1
ASSI { 332}
(( segid "SUPF" and resid 67 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
4.500 2.600 1.500 peak 332 spectrum 1 weight 0.10000E+01 volume 0.68837E-03 ppm1 8.715 ppm2 0.609 CV 1
ASSI { 333}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 67 and name HA ))
2.800 1.000 1.000 peak 333 spectrum 1 weight 0.10000E+01 volume 0.18216E-02 ppm1 8.715 ppm2 4.081 CV 1
ASSI { 334}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 67 and name HB ))
2.500 0.800 0.800 peak 334 spectrum 1 weight 0.10000E+01 volume 0.38561E-02 ppm1 8.715 ppm2 1.209 CV 1
ASSI { 335}
(( segid "SUPF" and resid 67 and name HN ))
( segid "SUPF" and resid 67 and name HD1%)
3.400 1.500 1.500 peak 335 spectrum 1 weight 0.10000E+01 volume 0.20109E-02 ppm1 8.716 ppm2 0.910 CV 1
ASSI { 336}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 67 and name HG11))
2.500 0.800 0.800 peak 336 spectrum 1 weight 0.10000E+01 volume 0.25542E-02 ppm1 8.716 ppm2 1.446 CV 1
OR { 336}
(( segid "SUPF" and resid 67 and name HN ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 338}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 67 and name HN ))
4.400 2.400 1.600 peak 338 spectrum 1 weight 0.10000E+01 volume 0.57998E-03 ppm1 7.962 ppm2 8.714 CV 1
ASSI { 339}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 67 and name HA ))
2.000 0.500 0.500 peak 339 spectrum 1 weight 0.10000E+01 volume 0.14940E-01 ppm1 7.969 ppm2 4.062 CV 1
ASSI { 340}
(( segid "SUPF" and resid 68 and name HN ))
( segid "SUPF" and resid 67 and name HD1%)
3.600 1.600 1.600 peak 340 spectrum 1 weight 0.10000E+01 volume 0.36094E-02 ppm1 7.970 ppm2 0.902 CV 1
ASSI { 341}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 67 and name HG11))
5.000 3.100 1.000 peak 341 spectrum 1 weight 0.10000E+01 volume 0.49594E-03 ppm1 7.966 ppm2 1.449 CV 1
OR { 341}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 67 and name HG12))
ASSI { 342}
(( segid "SUPF" and resid 68 and name HN ))
( segid "SUPF" and resid 67 and name HG2%)
2.500 0.800 0.800 peak 342 spectrum 1 weight 0.10000E+01 volume 0.52216E-02 ppm1 7.968 ppm2 0.848 CV 1
ASSI { 343}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 68 and name HB ))
3.700 1.700 1.700 peak 343 spectrum 1 weight 0.10000E+01 volume 0.97545E-03 ppm1 7.967 ppm2 3.729 CV 1
ASSI { 344}
(( segid "SUPF" and resid 68 and name HN ))
( segid "SUPF" and resid 68 and name HG2%)
2.700 0.900 0.900 peak 344 spectrum 1 weight 0.10000E+01 volume 0.33506E-02 ppm1 7.970 ppm2 0.975 CV 1
ASSI { 345}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 69 and name HN ))
4.200 2.200 1.800 peak 345 spectrum 1 weight 0.10000E+01 volume 0.54148E-03 ppm1 7.967 ppm2 8.541 CV 1
ASSI { 346}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 70 and name HG2 ))
3.500 3.500 2.500 peak 346 spectrum 1 weight 0.10000E+01 volume 0.76830E-03 ppm1 7.967 ppm2 1.693 CV 1
OR { 346}
(( segid "SUPF" and resid 68 and name HN ))
(( segid "SUPF" and resid 70 and name HG1 ))
ASSI { 347}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 68 and name HB ))
2.500 0.800 0.800 peak 347 spectrum 1 weight 0.10000E+01 volume 0.42474E-02 ppm1 8.544 ppm2 3.704 CV 1
ASSI { 348}
(( segid "SUPF" and resid 69 and name HN ))
( segid "SUPF" and resid 68 and name HG2%)
3.800 1.900 1.900 peak 348 spectrum 1 weight 0.10000E+01 volume 0.17636E-02 ppm1 8.544 ppm2 0.972 CV 1
ASSI { 349}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 69 and name HA ))
2.800 1.000 1.000 peak 349 spectrum 1 weight 0.10000E+01 volume 0.25894E-02 ppm1 8.547 ppm2 4.603 CV 1
ASSI { 350}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 69 and name HB1 ))
2.900 1.100 1.100 peak 350 spectrum 1 weight 0.10000E+01 volume 0.38176E-02 ppm1 8.543 ppm2 2.487 CV 1
ASSI { 351}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 69 and name HB2 ))
2.400 0.700 0.700 peak 351 spectrum 1 weight 0.10000E+01 volume 0.46001E-02 ppm1 8.546 ppm2 3.103 CV 1
ASSI { 352}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 74 and name HN ))
3.100 1.200 1.200 peak 352 spectrum 1 weight 0.10000E+01 volume 0.13511E-02 ppm1 8.549 ppm2 7.697 CV 1
ASSI { 353}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 75 and name HA ))
3.800 1.800 1.800 peak 353 spectrum 1 weight 0.10000E+01 volume 0.87227E-03 ppm1 8.543 ppm2 4.269 CV 1
ASSI { 354}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 76 and name HN ))
4.100 2.100 1.900 peak 354 spectrum 1 weight 0.10000E+01 volume 0.65482E-03 ppm1 8.541 ppm2 9.074 CV 1
ASSI { 355}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 76 and name HG1 ))
3.100 1.200 1.200 peak 355 spectrum 1 weight 0.10000E+01 volume 0.13057E-02 ppm1 8.543 ppm2 1.614 CV 1
OR { 355}
(( segid "SUPF" and resid 69 and name HN ))
(( segid "SUPF" and resid 76 and name HG2 ))
ASSI { 357}
(( segid "SUPF" and resid 70 and name HN ))
(( segid "SUPF" and resid 69 and name HA ))
2.700 0.900 0.900 peak 357 spectrum 1 weight 0.10000E+01 volume 0.21693E-02 ppm1 8.959 ppm2 4.599 CV 1
ASSI { 358}
(( segid "SUPF" and resid 70 and name HN ))
(( segid "SUPF" and resid 70 and name HB2 ))
3.100 1.200 1.200 peak 358 spectrum 1 weight 0.10000E+01 volume 0.14128E-02 ppm1 8.955 ppm2 1.889 CV 1
OR { 358}
(( segid "SUPF" and resid 70 and name HN ))
(( segid "SUPF" and resid 70 and name HB1 ))
ASSI { 359}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HA ))
3.200 1.300 1.300 peak 359 spectrum 1 weight 0.10000E+01 volume 0.13634E-02 ppm1 8.786 ppm2 4.102 CV 1
ASSI { 360}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HB2 ))
3.300 1.400 1.400 peak 360 spectrum 1 weight 0.10000E+01 volume 0.12275E-02 ppm1 8.787 ppm2 1.879 CV 1
OR { 360}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HB1 ))
ASSI { 361}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HG2 ))
4.500 2.500 1.500 peak 361 spectrum 1 weight 0.10000E+01 volume 0.66271E-03 ppm1 8.783 ppm2 1.699 CV 1
OR { 361}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 70 and name HG1 ))
ASSI { 362}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 71 and name HA ))
2.400 0.700 0.700 peak 362 spectrum 1 weight 0.10000E+01 volume 0.73114E-02 ppm1 8.785 ppm2 4.763 CV 1
ASSI { 363}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 71 and name HB1 ))
3.300 1.400 1.400 peak 363 spectrum 1 weight 0.10000E+01 volume 0.30979E-02 ppm1 8.784 ppm2 3.008 CV 1
ASSI { 364}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 71 and name HB2 ))
2.800 1.000 1.000 peak 364 spectrum 1 weight 0.10000E+01 volume 0.18237E-02 ppm1 8.784 ppm2 2.858 CV 1
ASSI { 365}
(( segid "SUPF" and resid 71 and name HN ))
(( segid "SUPF" and resid 71 and name HD21))
4.000 2.000 2.000 peak 365 spectrum 1 weight 0.10000E+01 volume 0.43456E-03 ppm1 8.781 ppm2 7.907 CV 1
ASSI { 367}
(( segid "SUPF" and resid 71 and name HD21))
(( segid "SUPF" and resid 71 and name HB1 ))
3.100 1.200 1.200 peak 367 spectrum 1 weight 0.10000E+01 volume 0.15723E-02 ppm1 7.910 ppm2 3.015 CV 1
ASSI { 368}
(( segid "SUPF" and resid 71 and name HD22))
(( segid "SUPF" and resid 71 and name HB1 ))
4.300 2.300 1.700 peak 368 spectrum 1 weight 0.10000E+01 volume 0.71933E-03 ppm1 7.008 ppm2 3.010 CV 1
ASSI { 369}
(( segid "SUPF" and resid 71 and name HD21))
(( segid "SUPF" and resid 71 and name HB2 ))
3.700 1.700 1.700 peak 369 spectrum 1 weight 0.10000E+01 volume 0.39329E-03 ppm1 7.912 ppm2 2.855 CV 1
ASSI { 370}
(( segid "SUPF" and resid 71 and name HD22))
(( segid "SUPF" and resid 71 and name HD21))
1.800 0.400 0.400 peak 370 spectrum 1 weight 0.10000E+01 volume 0.17903E-01 ppm1 7.013 ppm2 7.909 CV 1
ASSI { 372}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 71 and name HN ))
2.600 0.800 0.800 peak 372 spectrum 1 weight 0.10000E+01 volume 0.37442E-02 ppm1 8.102 ppm2 8.777 CV 1
ASSI { 373}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 71 and name HA ))
2.700 0.900 0.900 peak 373 spectrum 1 weight 0.10000E+01 volume 0.54625E-02 ppm1 8.103 ppm2 4.764 CV 1
ASSI { 374}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 71 and name HB1 ))
3.200 1.200 1.200 peak 374 spectrum 1 weight 0.10000E+01 volume 0.23087E-02 ppm1 8.105 ppm2 3.016 CV 1
ASSI { 375}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 71 and name HB2 ))
3.000 1.100 1.100 peak 375 spectrum 1 weight 0.10000E+01 volume 0.12837E-02 ppm1 8.105 ppm2 2.862 CV 1
ASSI { 376}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 72 and name HA ))
2.700 0.900 0.900 peak 376 spectrum 1 weight 0.10000E+01 volume 0.32299E-02 ppm1 8.104 ppm2 4.378 CV 1
ASSI { 377}
(( segid "SUPF" and resid 72 and name HN ))
( segid "SUPF" and resid 72 and name HG2%)
2.500 0.800 0.800 peak 377 spectrum 1 weight 0.10000E+01 volume 0.58083E-02 ppm1 8.103 ppm2 1.194 CV 1
ASSI { 378}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 73 and name HN ))
2.400 0.700 0.700 peak 378 spectrum 1 weight 0.10000E+01 volume 0.51131E-02 ppm1 8.104 ppm2 8.310 CV 1
ASSI { 379}
(( segid "SUPF" and resid 72 and name HN ))
(( segid "SUPF" and resid 73 and name HA ))
5.100 3.200 0.900 peak 379 spectrum 1 weight 0.10000E+01 volume 0.50765E-03 ppm1 8.104 ppm2 4.004 CV 1
ASSI { 382}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 69 and name HB2 ))
3.800 1.800 1.800 peak 382 spectrum 1 weight 0.10000E+01 volume 0.84065E-03 ppm1 8.322 ppm2 3.086 CV 1
ASSI { 383}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 71 and name HN ))
3.500 1.500 1.500 peak 383 spectrum 1 weight 0.10000E+01 volume 0.91540E-03 ppm1 8.322 ppm2 8.771 CV 1
ASSI { 385}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 72 and name HA ))
3.000 1.100 1.100 peak 385 spectrum 1 weight 0.10000E+01 volume 0.21216E-02 ppm1 8.324 ppm2 4.384 CV 1
ASSI { 386}
(( segid "SUPF" and resid 73 and name HN ))
( segid "SUPF" and resid 72 and name HG2%)
4.400 2.400 1.600 peak 386 spectrum 1 weight 0.10000E+01 volume 0.77589E-03 ppm1 8.324 ppm2 1.192 CV 1
ASSI { 387}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 73 and name HA ))
2.100 0.600 0.600 peak 387 spectrum 1 weight 0.10000E+01 volume 0.95979E-02 ppm1 8.323 ppm2 3.969 CV 1
ASSI { 388}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 73 and name HG2 ))
3.000 1.100 1.100 peak 388 spectrum 1 weight 0.10000E+01 volume 0.25510E-02 ppm1 8.323 ppm2 2.318 CV 1
OR { 388}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 73 and name HG1 ))
ASSI { 390}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 74 and name HG2 ))
4.300 2.300 1.700 peak 390 spectrum 1 weight 0.10000E+01 volume 0.49058E-03 ppm1 8.323 ppm2 1.423 CV 1
OR { 390}
(( segid "SUPF" and resid 73 and name HN ))
(( segid "SUPF" and resid 74 and name HG1 ))
ASSI { 391}
(( segid "SUPF" and resid 73 and name HE22))
(( segid "SUPF" and resid 73 and name HE21))
1.500 0.300 0.700 peak 391 spectrum 1 weight 0.10000E+01 volume 0.35302E-01 ppm1 6.745 ppm2 7.432 CV 1
ASSI { 394}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HB1 ))
3.000 1.100 1.100 peak 394 spectrum 1 weight 0.10000E+01 volume 0.49697E-02 ppm1 7.702 ppm2 1.631 CV 1
OR { 394}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HD1 ))
OR { 394}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HD2 ))
ASSI { 396}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 69 and name HB1 ))
3.500 1.500 1.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.10270E-02 ppm1 7.702 ppm2 2.492 CV 1
ASSI { 397}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 69 and name HB2 ))
3.000 1.100 1.100 peak 397 spectrum 1 weight 0.10000E+01 volume 0.18994E-02 ppm1 7.696 ppm2 3.105 CV 1
ASSI { 398}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 72 and name HN ))
3.800 1.800 1.800 peak 398 spectrum 1 weight 0.10000E+01 volume 0.66482E-03 ppm1 7.701 ppm2 8.117 CV 1
ASSI { 399}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 73 and name HN ))
2.700 0.900 0.900 peak 399 spectrum 1 weight 0.10000E+01 volume 0.26444E-02 ppm1 7.697 ppm2 8.317 CV 1
ASSI { 401}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 73 and name HA ))
2.900 1.100 1.100 peak 401 spectrum 1 weight 0.10000E+01 volume 0.21391E-02 ppm1 7.701 ppm2 3.970 CV 1
ASSI { 402}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HA ))
2.700 0.900 0.900 peak 402 spectrum 1 weight 0.10000E+01 volume 0.34310E-02 ppm1 7.700 ppm2 4.405 CV 1
ASSI { 403}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HB2 ))
2.700 0.900 0.900 peak 403 spectrum 1 weight 0.10000E+01 volume 0.23582E-02 ppm1 7.699 ppm2 1.814 CV 1
ASSI { 404}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HG2 ))
2.700 0.900 0.900 peak 404 spectrum 1 weight 0.10000E+01 volume 0.32528E-02 ppm1 7.702 ppm2 1.433 CV 1
OR { 404}
(( segid "SUPF" and resid 74 and name HN ))
(( segid "SUPF" and resid 74 and name HG1 ))
ASSI { 405}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 74 and name HA ))
2.500 0.800 0.800 peak 405 spectrum 1 weight 0.10000E+01 volume 0.46532E-02 ppm1 8.678 ppm2 4.416 CV 1
ASSI { 406}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 74 and name HB1 ))
3.700 1.700 1.700 peak 406 spectrum 1 weight 0.10000E+01 volume 0.44441E-03 ppm1 8.679 ppm2 1.639 CV 1
ASSI { 407}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 74 and name HB2 ))
3.900 1.900 1.900 peak 407 spectrum 1 weight 0.10000E+01 volume 0.79776E-03 ppm1 8.680 ppm2 1.814 CV 1
ASSI { 408}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 75 and name HA ))
3.100 1.200 1.200 peak 408 spectrum 1 weight 0.10000E+01 volume 0.99184E-03 ppm1 8.683 ppm2 4.238 CV 1
ASSI { 409}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 75 and name HB1 ))
3.300 1.300 1.300 peak 409 spectrum 1 weight 0.10000E+01 volume 0.19397E-02 ppm1 8.679 ppm2 3.951 CV 1
ASSI { 410}
(( segid "SUPF" and resid 75 and name HN ))
(( segid "SUPF" and resid 75 and name HB2 ))
2.900 1.000 1.000 peak 410 spectrum 1 weight 0.10000E+01 volume 0.18742E-02 ppm1 8.680 ppm2 4.133 CV 1
ASSI { 411}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 77 and name HA2 ))
4.200 2.200 1.800 peak 411 spectrum 1 weight 0.10000E+01 volume 0.99714E-03 ppm1 9.068 ppm2 4.082 CV 1
ASSI { 413}
(( segid "SUPF" and resid 76 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.900 1.900 1.900 peak 413 spectrum 1 weight 0.10000E+01 volume 0.39848E-03 ppm1 9.077 ppm2 0.749 CV 1
ASSI { 414}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 68 and name HA ))
2.900 1.000 1.000 peak 414 spectrum 1 weight 0.10000E+01 volume 0.19140E-02 ppm1 9.076 ppm2 4.794 CV 1
ASSI { 415}
(( segid "SUPF" and resid 76 and name HN ))
( segid "SUPF" and resid 68 and name HG2%)
4.600 2.600 1.400 peak 415 spectrum 1 weight 0.10000E+01 volume 0.70921E-03 ppm1 9.080 ppm2 0.966 CV 1
ASSI { 416}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 75 and name HA ))
2.200 0.600 0.600 peak 416 spectrum 1 weight 0.10000E+01 volume 0.54544E-02 ppm1 9.075 ppm2 4.240 CV 1
ASSI { 417}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 75 and name HB1 ))
3.600 1.700 1.700 peak 417 spectrum 1 weight 0.10000E+01 volume 0.71156E-03 ppm1 9.071 ppm2 3.939 CV 1
ASSI { 418}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HA ))
3.200 1.300 1.300 peak 418 spectrum 1 weight 0.10000E+01 volume 0.11436E-02 ppm1 9.072 ppm2 4.522 CV 1
ASSI { 419}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HB1 ))
3.700 1.700 1.700 peak 419 spectrum 1 weight 0.10000E+01 volume 0.16614E-02 ppm1 9.078 ppm2 1.211 CV 1
ASSI { 420}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HB2 ))
3.000 1.100 1.100 peak 420 spectrum 1 weight 0.10000E+01 volume 0.89341E-03 ppm1 9.080 ppm2 2.213 CV 1
ASSI { 421}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HG1 ))
2.800 1.000 1.000 peak 421 spectrum 1 weight 0.10000E+01 volume 0.19737E-02 ppm1 9.071 ppm2 1.603 CV 1
OR { 421}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 76 and name HG2 ))
ASSI { 422}
(( segid "SUPF" and resid 76 and name HN ))
(( segid "SUPF" and resid 77 and name HN ))
2.700 0.900 0.900 peak 422 spectrum 1 weight 0.10000E+01 volume 0.20322E-02 ppm1 9.076 ppm2 9.585 CV 1
ASSI { 423}
(( segid "SUPF" and resid 77 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
4.000 2.000 2.000 peak 423 spectrum 1 weight 0.10000E+01 volume 0.47501E-03 ppm1 9.578 ppm2 0.732 CV 1
ASSI { 424}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 75 and name HA ))
4.000 2.000 2.000 peak 424 spectrum 1 weight 0.10000E+01 volume 0.57295E-03 ppm1 9.588 ppm2 4.236 CV 1
ASSI { 426}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 76 and name HA ))
3.700 1.800 1.800 peak 426 spectrum 1 weight 0.10000E+01 volume 0.51361E-03 ppm1 9.589 ppm2 4.505 CV 1
ASSI { 427}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 77 and name HA1 ))
3.200 1.300 1.300 peak 427 spectrum 1 weight 0.10000E+01 volume 0.20557E-02 ppm1 9.584 ppm2 3.274 CV 1
ASSI { 428}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 77 and name HA2 ))
2.800 1.000 1.000 peak 428 spectrum 1 weight 0.10000E+01 volume 0.18926E-02 ppm1 9.585 ppm2 4.087 CV 1
ASSI { 429}
(( segid "SUPF" and resid 77 and name HN ))
(( segid "SUPF" and resid 78 and name HN ))
2.800 0.900 0.900 peak 429 spectrum 1 weight 0.10000E+01 volume 0.19484E-02 ppm1 9.582 ppm2 7.172 CV 1
ASSI { 430}
(( segid "SUPF" and resid 78 and name HN ))
( segid "SUPF" and resid 42 and name HD1%)
4.000 2.000 2.000 peak 430 spectrum 1 weight 0.10000E+01 volume 0.61247E-03 ppm1 7.173 ppm2 0.490 CV 1
ASSI { 431}
(( segid "SUPF" and resid 78 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.300 1.400 1.400 peak 431 spectrum 1 weight 0.10000E+01 volume 0.92564E-03 ppm1 7.171 ppm2 0.749 CV 1
ASSI { 432}
(( segid "SUPF" and resid 78 and name HN ))
(( segid "SUPF" and resid 76 and name HB1 ))
4.200 2.200 1.800 peak 432 spectrum 1 weight 0.10000E+01 volume 0.79679E-03 ppm1 7.170 ppm2 1.222 CV 1
ASSI { 434}
(( segid "SUPF" and resid 78 and name HN ))
(( segid "SUPF" and resid 77 and name HA1 ))
3.700 1.700 1.700 peak 434 spectrum 1 weight 0.10000E+01 volume 0.12949E-02 ppm1 7.170 ppm2 3.272 CV 1
ASSI { 435}
(( segid "SUPF" and resid 78 and name HN ))
(( segid "SUPF" and resid 77 and name HA2 ))
3.400 1.500 1.500 peak 435 spectrum 1 weight 0.10000E+01 volume 0.10812E-02 ppm1 7.172 ppm2 4.087 CV 1
ASSI { 436}
(( segid "SUPF" and resid 78 and name HN ))
(( segid "SUPF" and resid 78 and name HA ))
2.900 1.100 1.100 peak 436 spectrum 1 weight 0.10000E+01 volume 0.13058E-02 ppm1 7.171 ppm2 5.181 CV 1
ASSI { 437}
(( segid "SUPF" and resid 78 and name HN ))
( segid "SUPF" and resid 78 and name HD% )
3.300 1.400 1.400 peak 437 spectrum 1 weight 0.10000E+01 volume 0.10507E-02 ppm1 7.175 ppm2 6.725 CV 1
ASSI { 439}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 39 and name HB ))
2.900 1.100 1.100 peak 439 spectrum 1 weight 0.10000E+01 volume 0.12781E-02 ppm1 8.980 ppm2 1.570 CV 1
ASSI { 441}
(( segid "SUPF" and resid 79 and name HN ))
( segid "SUPF" and resid 42 and name HD1%)
2.900 1.100 1.100 peak 441 spectrum 1 weight 0.10000E+01 volume 0.13534E-02 ppm1 8.977 ppm2 0.484 CV 1
ASSI { 442}
(( segid "SUPF" and resid 79 and name HN ))
( segid "SUPF" and resid 66 and name HG1%)
3.900 1.900 1.900 peak 442 spectrum 1 weight 0.10000E+01 volume 0.64259E-03 ppm1 8.984 ppm2 0.758 CV 1
ASSI { 443}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 67 and name HN ))
4.500 2.500 1.500 peak 443 spectrum 1 weight 0.10000E+01 volume 0.56326E-03 ppm1 8.980 ppm2 8.703 CV 1
ASSI { 444}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 78 and name HN ))
4.100 2.100 1.900 peak 444 spectrum 1 weight 0.10000E+01 volume 0.55552E-03 ppm1 8.982 ppm2 7.178 CV 1
ASSI { 445}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 78 and name HA ))
2.400 0.700 0.700 peak 445 spectrum 1 weight 0.10000E+01 volume 0.40899E-02 ppm1 8.980 ppm2 5.172 CV 1
ASSI { 446}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 78 and name HB1 ))
3.700 1.800 1.800 peak 446 spectrum 1 weight 0.10000E+01 volume 0.22961E-02 ppm1 8.983 ppm2 2.933 CV 1
ASSI { 447}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 78 and name HB2 ))
2.800 1.000 1.000 peak 447 spectrum 1 weight 0.10000E+01 volume 0.14547E-02 ppm1 8.981 ppm2 3.215 CV 1
ASSI { 448}
(( segid "SUPF" and resid 79 and name HN ))
( segid "SUPF" and resid 78 and name HD% )
3.400 1.400 1.400 peak 448 spectrum 1 weight 0.10000E+01 volume 0.99641E-03 ppm1 8.977 ppm2 6.725 CV 1
ASSI { 449}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 79 and name HA1 ))
2.800 1.000 1.000 peak 449 spectrum 1 weight 0.10000E+01 volume 0.13437E-02 ppm1 8.978 ppm2 4.271 CV 1
ASSI { 450}
(( segid "SUPF" and resid 79 and name HN ))
(( segid "SUPF" and resid 79 and name HA2 ))
3.000 1.100 1.100 peak 450 spectrum 1 weight 0.10000E+01 volume 0.16358E-02 ppm1 8.981 ppm2 3.964 CV 1
ASSI { 452}
(( segid "SUPF" and resid 80 and name HN ))
( segid "SUPF" and resid 65 and name HG2%)
2.900 1.000 1.000 peak 452 spectrum 1 weight 0.10000E+01 volume 0.29568E-02 ppm1 8.725 ppm2 0.951 CV 1
ASSI { 453}
(( segid "SUPF" and resid 80 and name HN ))
( segid "SUPF" and resid 66 and name HG2%)
2.800 2.800 3.200 peak 453 spectrum 1 weight 0.10000E+01 volume 0.11767E-02 ppm1 8.726 ppm2 0.647 CV 1
ASSI { 454}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 79 and name HA1 ))
2.800 0.900 0.900 peak 454 spectrum 1 weight 0.10000E+01 volume 0.29829E-02 ppm1 8.724 ppm2 4.272 CV 1
ASSI { 455}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 79 and name HA2 ))
2.400 0.700 0.700 peak 455 spectrum 1 weight 0.10000E+01 volume 0.42349E-02 ppm1 8.724 ppm2 3.952 CV 1
ASSI { 456}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 80 and name HA ))
3.100 1.200 1.200 peak 456 spectrum 1 weight 0.10000E+01 volume 0.13143E-02 ppm1 8.725 ppm2 5.843 CV 1
ASSI { 457}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 80 and name HB1 ))
4.000 2.000 2.000 peak 457 spectrum 1 weight 0.10000E+01 volume 0.12172E-02 ppm1 8.725 ppm2 2.672 CV 1
ASSI { 458}
(( segid "SUPF" and resid 80 and name HN ))
(( segid "SUPF" and resid 80 and name HB2 ))
3.200 1.300 1.300 peak 458 spectrum 1 weight 0.10000E+01 volume 0.77517E-03 ppm1 8.724 ppm2 2.857 CV 1
ASSI { 459}
(( segid "SUPF" and resid 80 and name HN ))
( segid "SUPF" and resid 80 and name HD% )
3.300 1.400 1.400 peak 459 spectrum 1 weight 0.10000E+01 volume 0.10530E-02 ppm1 8.723 ppm2 7.170 CV 1
ASSI { 460}
(( segid "SUPF" and resid 81 and name HN ))
( segid "SUPF" and resid 64 and name HB% )
4.700 2.700 1.300 peak 460 spectrum 1 weight 0.10000E+01 volume 0.47197E-03 ppm1 9.085 ppm2 1.320 CV 1
ASSI { 461}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 37 and name HA ))
4.000 2.000 2.000 peak 461 spectrum 1 weight 0.10000E+01 volume 0.49910E-03 ppm1 9.079 ppm2 4.249 CV 1
ASSI { 462}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 37 and name HB ))
3.500 1.500 1.500 peak 462 spectrum 1 weight 0.10000E+01 volume 0.76089E-03 ppm1 9.077 ppm2 1.779 CV 1
ASSI { 463}
(( segid "SUPF" and resid 81 and name HN ))
( segid "SUPF" and resid 39 and name HG2%)
3.000 1.200 1.200 peak 463 spectrum 1 weight 0.10000E+01 volume 0.17763E-02 ppm1 9.077 ppm2 0.701 CV 1
ASSI { 464}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 80 and name HA ))
2.300 0.600 0.600 peak 464 spectrum 1 weight 0.10000E+01 volume 0.73258E-02 ppm1 9.078 ppm2 5.841 CV 1
ASSI { 465}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 80 and name HB1 ))
3.100 1.200 1.200 peak 465 spectrum 1 weight 0.10000E+01 volume 0.11666E-02 ppm1 9.076 ppm2 2.673 CV 1
ASSI { 466}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 80 and name HB2 ))
3.900 1.900 1.900 peak 466 spectrum 1 weight 0.10000E+01 volume 0.15347E-02 ppm1 9.075 ppm2 2.861 CV 1
ASSI { 467}
(( segid "SUPF" and resid 81 and name HN ))
( segid "SUPF" and resid 80 and name HD% )
4.000 2.000 2.000 peak 467 spectrum 1 weight 0.10000E+01 volume 0.56306E-03 ppm1 9.082 ppm2 7.163 CV 1
ASSI { 468}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 81 and name HA ))
2.900 1.000 1.000 peak 468 spectrum 1 weight 0.10000E+01 volume 0.15313E-02 ppm1 9.079 ppm2 4.708 CV 1
ASSI { 469}
(( segid "SUPF" and resid 81 and name HN ))
(( segid "SUPF" and resid 81 and name HB ))
2.800 1.000 1.000 peak 469 spectrum 1 weight 0.10000E+01 volume 0.22426E-02 ppm1 9.080 ppm2 1.153 CV 1
ASSI { 470}
(( segid "SUPF" and resid 81 and name HN ))
( segid "SUPF" and resid 81 and name HG2%)
3.000 1.200 1.200 peak 470 spectrum 1 weight 0.10000E+01 volume 0.16209E-02 ppm1 9.079 ppm2 0.406 CV 1
ASSI { 475}
(( segid "SUPF" and resid 82 and name HN ))
(( segid "SUPF" and resid 63 and name HB2 ))
3.800 1.800 1.800 peak 475 spectrum 1 weight 0.10000E+01 volume 0.85637E-03 ppm1 9.517 ppm2 2.006 CV 1
OR { 475}
(( segid "SUPF" and resid 82 and name HN ))
(( segid "SUPF" and resid 63 and name HB1 ))
ASSI { 477}
(( segid "SUPF" and resid 82 and name HN ))
(( segid "SUPF" and resid 81 and name HA ))
2.200 0.600 0.600 peak 477 spectrum 1 weight 0.10000E+01 volume 0.56593E-02 ppm1 9.511 ppm2 4.705 CV 1
ASSI { 478}
(( segid "SUPF" and resid 82 and name HN ))
( segid "SUPF" and resid 81 and name HG1%)
2.800 1.000 1.000 peak 478 spectrum 1 weight 0.10000E+01 volume 0.26250E-02 ppm1 9.511 ppm2 0.570 CV 1
ASSI { 479}
(( segid "SUPF" and resid 82 and name HN ))
( segid "SUPF" and resid 81 and name HG2%)
4.300 2.300 1.700 peak 479 spectrum 1 weight 0.10000E+01 volume 0.10085E-02 ppm1 9.512 ppm2 0.394 CV 1
ASSI { 480}
(( segid "SUPF" and resid 82 and name HN ))
(( segid "SUPF" and resid 82 and name HB ))
2.700 0.900 0.900 peak 480 spectrum 1 weight 0.10000E+01 volume 0.21857E-02 ppm1 9.511 ppm2 3.935 CV 1
ASSI { 481}
(( segid "SUPF" and resid 82 and name HN ))
( segid "SUPF" and resid 82 and name HG2%)
3.900 1.900 1.900 peak 481 spectrum 1 weight 0.10000E+01 volume 0.11424E-02 ppm1 9.513 ppm2 1.160 CV 1
ASSI { 483}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 35 and name HA ))
3.500 1.500 1.500 peak 483 spectrum 1 weight 0.10000E+01 volume 0.86480E-03 ppm1 8.472 ppm2 4.394 CV 1
ASSI { 484}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 35 and name HB ))
2.700 0.900 0.900 peak 484 spectrum 1 weight 0.10000E+01 volume 0.24814E-02 ppm1 8.474 ppm2 4.534 CV 1
ASSI { 485}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 37 and name HN ))
4.200 2.200 1.800 peak 485 spectrum 1 weight 0.10000E+01 volume 0.45943E-03 ppm1 8.466 ppm2 9.917 CV 1
ASSI { 486}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 82 and name HB ))
4.300 2.300 1.700 peak 486 spectrum 1 weight 0.10000E+01 volume 0.44976E-03 ppm1 8.477 ppm2 3.945 CV 1
ASSI { 487}
(( segid "SUPF" and resid 83 and name HN ))
( segid "SUPF" and resid 82 and name HG2%)
3.100 1.200 1.200 peak 487 spectrum 1 weight 0.10000E+01 volume 0.25917E-02 ppm1 8.479 ppm2 1.148 CV 1
ASSI { 489}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 83 and name HB2 ))
2.700 0.900 0.900 peak 489 spectrum 1 weight 0.10000E+01 volume 0.22146E-02 ppm1 8.474 ppm2 1.987 CV 1
ASSI { 490}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 83 and name HG1 ))
3.800 1.800 1.800 peak 490 spectrum 1 weight 0.10000E+01 volume 0.10495E-02 ppm1 8.474 ppm2 2.249 CV 1
ASSI { 491}
(( segid "SUPF" and resid 83 and name HN ))
(( segid "SUPF" and resid 84 and name HA ))
3.700 3.700 2.300 peak 491 spectrum 1 weight 0.10000E+01 volume 0.87149E-03 ppm1 8.478 ppm2 4.110 CV 1
ASSI { 492}
(( segid "SUPF" and resid 83 and name HN ))
( segid "SUPF" and resid 89 and name HB% )
3.900 1.900 1.900 peak 492 spectrum 1 weight 0.10000E+01 volume 0.80631E-03 ppm1 8.475 ppm2 1.567 CV 1
ASSI { 494}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 62 and name HN ))
3.600 1.600 1.600 peak 494 spectrum 1 weight 0.10000E+01 volume 0.83848E-03 ppm1 8.352 ppm2 9.112 CV 1
ASSI { 495}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 83 and name HA ))
2.200 0.600 0.600 peak 495 spectrum 1 weight 0.10000E+01 volume 0.68632E-02 ppm1 8.356 ppm2 5.097 CV 1
ASSI { 496}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 83 and name HB1 ))
2.300 0.600 0.600 peak 496 spectrum 1 weight 0.10000E+01 volume 0.36767E-02 ppm1 8.354 ppm2 2.538 CV 1
ASSI { 497}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 83 and name HB2 ))
4.000 2.000 2.000 peak 497 spectrum 1 weight 0.10000E+01 volume 0.61350E-03 ppm1 8.358 ppm2 2.037 CV 1
ASSI { 498}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 83 and name HG1 ))
5.000 3.100 1.000 peak 498 spectrum 1 weight 0.10000E+01 volume 0.45766E-03 ppm1 8.358 ppm2 2.245 CV 1
ASSI { 499}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HA ))
2.400 0.700 0.700 peak 499 spectrum 1 weight 0.10000E+01 volume 0.54483E-02 ppm1 8.356 ppm2 4.110 CV 1
ASSI { 500}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HB1 ))
2.200 0.600 0.600 peak 500 spectrum 1 weight 0.10000E+01 volume 0.69620E-02 ppm1 8.356 ppm2 1.724 CV 1
ASSI { 501}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HB2 ))
3.000 1.100 1.100 peak 501 spectrum 1 weight 0.10000E+01 volume 0.46049E-02 ppm1 8.356 ppm2 1.904 CV 1
ASSI { 502}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HG1 ))
2.900 1.000 1.000 peak 502 spectrum 1 weight 0.10000E+01 volume 0.27125E-02 ppm1 8.356 ppm2 1.380 CV 1
OR { 502}
(( segid "SUPF" and resid 84 and name HN ))
(( segid "SUPF" and resid 84 and name HG2 ))
ASSI { 505}
(( segid "SUPF" and resid 85 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
3.500 1.500 1.500 peak 505 spectrum 1 weight 0.10000E+01 volume 0.10150E-02 ppm1 7.708 ppm2 0.808 CV 1
ASSI { 509}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 83 and name HG1 ))
4.500 2.600 1.500 peak 509 spectrum 1 weight 0.10000E+01 volume 0.57278E-03 ppm1 7.706 ppm2 2.236 CV 1
ASSI { 510}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 84 and name HN ))
2.500 0.800 0.800 peak 510 spectrum 1 weight 0.10000E+01 volume 0.40028E-02 ppm1 7.706 ppm2 8.351 CV 1
ASSI { 511}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 84 and name HB2 ))
3.400 1.400 1.400 peak 511 spectrum 1 weight 0.10000E+01 volume 0.19286E-02 ppm1 7.708 ppm2 1.898 CV 1
ASSI { 512}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 84 and name HD1 ))
3.100 1.200 1.200 peak 512 spectrum 1 weight 0.10000E+01 volume 0.18440E-02 ppm1 7.705 ppm2 1.718 CV 1
OR { 512}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 84 and name HD2 ))
ASSI { 513}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 85 and name HA ))
2.800 1.000 1.000 peak 513 spectrum 1 weight 0.10000E+01 volume 0.28144E-02 ppm1 7.707 ppm2 4.886 CV 1
ASSI { 514}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 85 and name HB1 ))
3.500 1.500 1.500 peak 514 spectrum 1 weight 0.10000E+01 volume 0.75210E-03 ppm1 7.709 ppm2 2.981 CV 1
ASSI { 515}
(( segid "SUPF" and resid 85 and name HN ))
(( segid "SUPF" and resid 85 and name HB2 ))
3.300 1.400 1.400 peak 515 spectrum 1 weight 0.10000E+01 volume 0.14672E-02 ppm1 7.710 ppm2 2.739 CV 1
ASSI { 516}
(( segid "SUPF" and resid 86 and name HN ))
( segid "SUPF" and resid 35 and name HG2%)
3.500 1.500 1.500 peak 516 spectrum 1 weight 0.10000E+01 volume 0.91847E-03 ppm1 8.745 ppm2 0.801 CV 1
ASSI { 517}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 85 and name HA ))
2.600 0.900 0.900 peak 517 spectrum 1 weight 0.10000E+01 volume 0.37874E-02 ppm1 8.747 ppm2 4.905 CV 1
ASSI { 518}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 85 and name HB1 ))
3.100 1.200 1.200 peak 518 spectrum 1 weight 0.10000E+01 volume 0.21002E-02 ppm1 8.747 ppm2 2.985 CV 1
ASSI { 519}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 85 and name HB2 ))
3.400 1.500 1.500 peak 519 spectrum 1 weight 0.10000E+01 volume 0.11292E-02 ppm1 8.749 ppm2 2.752 CV 1
ASSI { 520}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 86 and name HA ))
3.000 1.100 1.100 peak 520 spectrum 1 weight 0.10000E+01 volume 0.18218E-02 ppm1 8.747 ppm2 4.026 CV 1
ASSI { 521}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 86 and name HB1 ))
2.700 0.900 0.900 peak 521 spectrum 1 weight 0.10000E+01 volume 0.31701E-02 ppm1 8.746 ppm2 1.865 CV 1
OR { 521}
(( segid "SUPF" and resid 86 and name HN ))
(( segid "SUPF" and resid 86 and name HB2 ))
ASSI { 523}
(( segid "SUPF" and resid 86 and name HN ))
( segid "SUPF" and resid 89 and name HB% )
4.600 2.700 1.400 peak 523 spectrum 1 weight 0.10000E+01 volume 0.47881E-03 ppm1 8.750 ppm2 1.574 CV 1
ASSI { 524}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HN ))
2.900 1.100 1.100 peak 524 spectrum 1 weight 0.10000E+01 volume 0.18023E-02 ppm1 8.656 ppm2 8.747 CV 1
ASSI { 525}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HA ))
3.300 1.400 1.400 peak 525 spectrum 1 weight 0.10000E+01 volume 0.12165E-02 ppm1 8.661 ppm2 4.046 CV 1
ASSI { 526}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HB1 ))
2.900 1.100 1.100 peak 526 spectrum 1 weight 0.10000E+01 volume 0.23662E-02 ppm1 8.661 ppm2 1.853 CV 1
OR { 526}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HB2 ))
ASSI { 527}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HD1 ))
2.900 2.900 3.100 peak 527 spectrum 1 weight 0.10000E+01 volume 0.92949E-03 ppm1 8.665 ppm2 2.983 CV 1
OR { 527}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 86 and name HD2 ))
ASSI { 528}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 87 and name HA ))
2.800 1.000 1.000 peak 528 spectrum 1 weight 0.10000E+01 volume 0.32467E-02 ppm1 8.661 ppm2 4.230 CV 1
ASSI { 529}
(( segid "SUPF" and resid 87 and name HN ))
( segid "SUPF" and resid 87 and name HB% )
2.300 0.700 0.700 peak 529 spectrum 1 weight 0.10000E+01 volume 0.96383E-02 ppm1 8.660 ppm2 1.517 CV 1
ASSI { 530}
(( segid "SUPF" and resid 87 and name HN ))
(( segid "SUPF" and resid 88 and name HN ))
2.700 0.900 0.900 peak 530 spectrum 1 weight 0.10000E+01 volume 0.28928E-02 ppm1 8.660 ppm2 8.357 CV 1
ASSI { 535}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 87 and name HA ))
3.400 1.400 1.400 peak 535 spectrum 1 weight 0.10000E+01 volume 0.14146E-02 ppm1 8.358 ppm2 4.240 CV 1
ASSI { 536}
(( segid "SUPF" and resid 88 and name HN ))
( segid "SUPF" and resid 87 and name HB% )
2.400 0.700 0.700 peak 536 spectrum 1 weight 0.10000E+01 volume 0.62482E-02 ppm1 8.358 ppm2 1.523 CV 1
ASSI { 537}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 88 and name HA ))
2.800 1.000 1.000 peak 537 spectrum 1 weight 0.10000E+01 volume 0.27488E-02 ppm1 8.358 ppm2 4.326 CV 1
ASSI { 538}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 88 and name HB1 ))
3.300 1.400 1.400 peak 538 spectrum 1 weight 0.10000E+01 volume 0.24466E-02 ppm1 8.361 ppm2 3.868 CV 1
ASSI { 539}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 88 and name HB2 ))
2.400 0.700 0.700 peak 539 spectrum 1 weight 0.10000E+01 volume 0.38056E-02 ppm1 8.359 ppm2 4.047 CV 1
ASSI { 540}
(( segid "SUPF" and resid 88 and name HN ))
(( segid "SUPF" and resid 89 and name HN ))
2.600 0.800 0.800 peak 540 spectrum 1 weight 0.10000E+01 volume 0.36072E-02 ppm1 8.359 ppm2 7.538 CV 1
ASSI { 546}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 83 and name HB2 ))
3.500 1.600 1.600 peak 546 spectrum 1 weight 0.10000E+01 volume 0.59057E-03 ppm1 7.545 ppm2 1.993 CV 1
ASSI { 547}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 84 and name HG1 ))
3.400 3.400 2.600 peak 547 spectrum 1 weight 0.10000E+01 volume 0.41823E-03 ppm1 7.542 ppm2 1.382 CV 1
OR { 547}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 84 and name HG2 ))
ASSI { 548}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 85 and name HN ))
3.500 1.500 1.500 peak 548 spectrum 1 weight 0.10000E+01 volume 0.77300E-03 ppm1 7.539 ppm2 7.729 CV 1
ASSI { 550}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 88 and name HB1 ))
3.700 1.700 1.700 peak 550 spectrum 1 weight 0.10000E+01 volume 0.91443E-03 ppm1 7.540 ppm2 3.868 CV 1
ASSI { 551}
(( segid "SUPF" and resid 89 and name HN ))
( segid "SUPF" and resid 89 and name HB% )
2.300 0.700 0.700 peak 551 spectrum 1 weight 0.10000E+01 volume 0.67536E-02 ppm1 7.541 ppm2 1.547 CV 1
ASSI { 552}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 90 and name HN ))
2.600 0.800 0.800 peak 552 spectrum 1 weight 0.10000E+01 volume 0.35465E-02 ppm1 7.539 ppm2 8.538 CV 1
ASSI { 553}
(( segid "SUPF" and resid 89 and name HN ))
(( segid "SUPF" and resid 92 and name HN ))
3.700 1.700 1.700 peak 553 spectrum 1 weight 0.10000E+01 volume 0.77023E-03 ppm1 7.540 ppm2 7.892 CV 1
ASSI { 554}
(( segid "SUPF" and resid 52 and name HN ))
( segid "SUPF" and resid 46 and name HG2%)
4.000 2.000 2.000 peak 554 spectrum 1 weight 0.10000E+01 volume 0.11464E-02 ppm1 8.545 ppm2 1.108 CV 1
ASSI { 555}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 87 and name HA ))
3.200 1.300 1.300 peak 555 spectrum 1 weight 0.10000E+01 volume 0.14128E-02 ppm1 8.550 ppm2 4.220 CV 1
ASSI { 557}
(( segid "SUPF" and resid 90 and name HN ))
( segid "SUPF" and resid 89 and name HB% )
2.800 1.000 1.000 peak 557 spectrum 1 weight 0.10000E+01 volume 0.22191E-02 ppm1 8.549 ppm2 1.551 CV 1
ASSI { 559}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 90 and name HA ))
2.800 1.000 1.000 peak 559 spectrum 1 weight 0.10000E+01 volume 0.26690E-02 ppm1 8.552 ppm2 4.004 CV 1
ASSI { 560}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 90 and name HB2 ))
2.800 1.000 1.000 peak 560 spectrum 1 weight 0.10000E+01 volume 0.45224E-02 ppm1 8.549 ppm2 2.064 CV 1
ASSI { 561}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 90 and name HG2 ))
2.400 0.700 0.700 peak 561 spectrum 1 weight 0.10000E+01 volume 0.43596E-02 ppm1 8.549 ppm2 2.541 CV 1
ASSI { 562}
(( segid "SUPF" and resid 90 and name HN ))
(( segid "SUPF" and resid 91 and name HN ))
2.600 0.800 0.800 peak 562 spectrum 1 weight 0.10000E+01 volume 0.35699E-02 ppm1 8.548 ppm2 7.913 CV 1
ASSI { 564}
(( segid "SUPF" and resid 91 and name HN ))
( segid "SUPF" and resid 58 and name HD% )
4.700 2.800 1.300 peak 564 spectrum 1 weight 0.10000E+01 volume 0.48758E-03 ppm1 7.922 ppm2 7.359 CV 1
ASSI { 565}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 88 and name HN ))
3.700 1.700 1.700 peak 565 spectrum 1 weight 0.10000E+01 volume 0.71415E-03 ppm1 7.921 ppm2 8.360 CV 1
ASSI { 566}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 88 and name HA ))
3.200 1.300 1.300 peak 566 spectrum 1 weight 0.10000E+01 volume 0.13901E-02 ppm1 7.917 ppm2 4.313 CV 1
ASSI { 569}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 90 and name HG2 ))
3.600 1.600 1.600 peak 569 spectrum 1 weight 0.10000E+01 volume 0.79788E-03 ppm1 7.921 ppm2 2.533 CV 1
ASSI { 570}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 91 and name HB1 ))
2.700 0.900 0.900 peak 570 spectrum 1 weight 0.10000E+01 volume 0.34057E-02 ppm1 7.919 ppm2 2.342 CV 1
ASSI { 571}
(( segid "SUPF" and resid 91 and name HN ))
(( segid "SUPF" and resid 91 and name HB2 ))
2.100 0.600 0.600 peak 571 spectrum 1 weight 0.10000E+01 volume 0.96871E-02 ppm1 7.920 ppm2 2.061 CV 1
ASSI { 575}
(( segid "SUPF" and resid 92 and name HN ))
( segid "SUPF" and resid 37 and name HD1%)
4.100 2.100 1.900 peak 575 spectrum 1 weight 0.10000E+01 volume 0.53352E-03 ppm1 7.909 ppm2 0.688 CV 1
ASSI { 576}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 89 and name HA ))
3.100 1.200 1.200 peak 576 spectrum 1 weight 0.10000E+01 volume 0.11412E-02 ppm1 7.909 ppm2 4.102 CV 1
ASSI { 577}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 90 and name HN ))
3.800 1.800 1.800 peak 577 spectrum 1 weight 0.10000E+01 volume 0.63530E-03 ppm1 7.903 ppm2 8.541 CV 1
ASSI { 578}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 91 and name HA ))
3.200 1.300 1.300 peak 578 spectrum 1 weight 0.10000E+01 volume 0.15392E-02 ppm1 7.911 ppm2 3.968 CV 1
ASSI { 579}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 91 and name HB1 ))
2.800 1.000 1.000 peak 579 spectrum 1 weight 0.10000E+01 volume 0.19154E-02 ppm1 7.914 ppm2 2.323 CV 1
ASSI { 580}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 91 and name HG1 ))
3.500 1.500 1.500 peak 580 spectrum 1 weight 0.10000E+01 volume 0.20678E-02 ppm1 7.909 ppm2 1.742 CV 1
ASSI { 581}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 92 and name HA ))
2.600 0.900 0.900 peak 581 spectrum 1 weight 0.10000E+01 volume 0.41915E-02 ppm1 7.910 ppm2 2.033 CV 1
ASSI { 582}
(( segid "SUPF" and resid 92 and name HN ))
( segid "SUPF" and resid 92 and name HB% )
2.300 0.600 0.600 peak 582 spectrum 1 weight 0.10000E+01 volume 0.85595E-02 ppm1 7.909 ppm2 1.432 CV 1
ASSI { 583}
(( segid "SUPF" and resid 92 and name HN ))
(( segid "SUPF" and resid 93 and name HN ))
2.600 0.900 0.900 peak 583 spectrum 1 weight 0.10000E+01 volume 0.29984E-02 ppm1 7.912 ppm2 7.139 CV 1
ASSI { 585}
(( segid "SUPF" and resid 93 and name HN ))
( segid "SUPF" and resid 37 and name HD1%)
3.900 1.900 1.900 peak 585 spectrum 1 weight 0.10000E+01 volume 0.40610E-03 ppm1 7.142 ppm2 0.690 CV 1
ASSI { 586}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 90 and name HA ))
3.000 1.100 1.100 peak 586 spectrum 1 weight 0.10000E+01 volume 0.17456E-02 ppm1 7.145 ppm2 3.992 CV 1
ASSI { 588}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 92 and name HA ))
3.400 1.400 1.400 peak 588 spectrum 1 weight 0.10000E+01 volume 0.11861E-02 ppm1 7.139 ppm2 2.030 CV 1
ASSI { 589}
(( segid "SUPF" and resid 93 and name HN ))
( segid "SUPF" and resid 92 and name HB% )
2.900 1.100 1.100 peak 589 spectrum 1 weight 0.10000E+01 volume 0.23797E-02 ppm1 7.146 ppm2 1.424 CV 1
ASSI { 591}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 93 and name HB1 ))
3.000 1.200 1.200 peak 591 spectrum 1 weight 0.10000E+01 volume 0.19672E-02 ppm1 7.142 ppm2 3.059 CV 1
ASSI { 592}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 93 and name HB2 ))
2.600 0.800 0.800 peak 592 spectrum 1 weight 0.10000E+01 volume 0.34665E-02 ppm1 7.143 ppm2 2.798 CV 1
ASSI { 594}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 94 and name HB2 ))
4.800 2.900 1.200 peak 594 spectrum 1 weight 0.10000E+01 volume 0.44215E-03 ppm1 7.145 ppm2 1.867 CV 1
OR { 594}
(( segid "SUPF" and resid 93 and name HN ))
(( segid "SUPF" and resid 94 and name HB1 ))
ASSI { 595}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HB1 ))
3.200 1.300 1.300 peak 595 spectrum 1 weight 0.10000E+01 volume 0.23783E-02 ppm1 7.046 ppm2 1.791 CV 1
OR { 595}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HD1 ))
OR { 595}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HD2 ))
ASSI { 598}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 93 and name HN ))
2.400 0.700 0.700 peak 598 spectrum 1 weight 0.10000E+01 volume 0.55823E-02 ppm1 7.045 ppm2 7.150 CV 1
ASSI { 599}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 93 and name HA ))
3.300 1.400 1.400 peak 599 spectrum 1 weight 0.10000E+01 volume 0.11997E-02 ppm1 7.046 ppm2 4.291 CV 1
ASSI { 600}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 93 and name HB1 ))
4.000 2.000 2.000 peak 600 spectrum 1 weight 0.10000E+01 volume 0.39722E-03 ppm1 7.048 ppm2 3.035 CV 1
ASSI { 601}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 93 and name HB2 ))
4.000 2.000 2.000 peak 601 spectrum 1 weight 0.10000E+01 volume 0.77662E-03 ppm1 7.046 ppm2 2.805 CV 1
ASSI { 602}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HA ))
2.500 0.800 0.800 peak 602 spectrum 1 weight 0.10000E+01 volume 0.50441E-02 ppm1 7.045 ppm2 3.904 CV 1
ASSI { 603}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HB2 ))
2.100 0.600 0.600 peak 603 spectrum 1 weight 0.10000E+01 volume 0.93781E-02 ppm1 7.045 ppm2 1.877 CV 1
ASSI { 604}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HG2 ))
3.200 1.300 1.300 peak 604 spectrum 1 weight 0.10000E+01 volume 0.19878E-02 ppm1 7.045 ppm2 1.573 CV 1
OR { 604}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 94 and name HG1 ))
ASSI { 605}
(( segid "SUPF" and resid 94 and name HN ))
(( segid "SUPF" and resid 95 and name HN ))
2.700 0.900 0.900 peak 605 spectrum 1 weight 0.10000E+01 volume 0.35441E-02 ppm1 7.044 ppm2 7.774 CV 1
ASSI { 608}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 94 and name HA ))
3.400 1.400 1.400 peak 608 spectrum 1 weight 0.10000E+01 volume 0.11388E-02 ppm1 7.773 ppm2 3.913 CV 1
ASSI { 609}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 94 and name HB1 ))
2.600 0.900 0.900 peak 609 spectrum 1 weight 0.10000E+01 volume 0.53299E-02 ppm1 7.776 ppm2 1.856 CV 1
OR { 609}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 94 and name HB2 ))
ASSI { 610}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 94 and name HG1 ))
4.000 2.000 2.000 peak 610 spectrum 1 weight 0.10000E+01 volume 0.75595E-03 ppm1 7.776 ppm2 1.573 CV 1
ASSI { 611}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 95 and name HA ))
2.900 1.000 1.000 peak 611 spectrum 1 weight 0.10000E+01 volume 0.23205E-02 ppm1 7.774 ppm2 5.143 CV 1
ASSI { 612}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 95 and name HB1 ))
3.000 1.100 1.100 peak 612 spectrum 1 weight 0.10000E+01 volume 0.47195E-02 ppm1 7.776 ppm2 2.499 CV 1
ASSI { 613}
(( segid "SUPF" and resid 95 and name HN ))
(( segid "SUPF" and resid 95 and name HB2 ))
2.400 0.700 0.700 peak 613 spectrum 1 weight 0.10000E+01 volume 0.56368E-02 ppm1 7.776 ppm2 2.825 CV 1
ASSI { 614}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 95 and name HA ))
4.200 2.200 1.800 peak 614 spectrum 1 weight 0.10000E+01 volume 0.60772E-03 ppm1 8.181 ppm2 5.142 CV 1
ASSI { 615}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 96 and name HD1 ))
3.700 1.700 1.700 peak 615 spectrum 1 weight 0.10000E+01 volume 0.20638E-02 ppm1 8.176 ppm2 3.987 CV 1
ASSI { 616}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 96 and name HD2 ))
3.300 1.400 1.400 peak 616 spectrum 1 weight 0.10000E+01 volume 0.75559E-03 ppm1 8.172 ppm2 4.117 CV 1
ASSI { 617}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 96 and name HG1 ))
2.900 1.000 1.000 peak 617 spectrum 1 weight 0.10000E+01 volume 0.25352E-02 ppm1 8.175 ppm2 2.081 CV 1
OR { 617}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 96 and name HG2 ))
ASSI { 618}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 97 and name HA ))
2.700 0.900 0.900 peak 618 spectrum 1 weight 0.10000E+01 volume 0.32324E-02 ppm1 8.178 ppm2 6.001 CV 1
ASSI { 619}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 97 and name HB1 ))
3.300 1.400 1.400 peak 619 spectrum 1 weight 0.10000E+01 volume 0.38383E-02 ppm1 8.178 ppm2 2.485 CV 1
ASSI { 620}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 97 and name HB2 ))
2.800 1.000 1.000 peak 620 spectrum 1 weight 0.10000E+01 volume 0.22962E-02 ppm1 8.178 ppm2 2.795 CV 1
ASSI { 621}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 97 and name HD21))
3.400 1.500 1.500 peak 621 spectrum 1 weight 0.10000E+01 volume 0.14938E-02 ppm1 8.177 ppm2 8.010 CV 1
ASSI { 622}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 98 and name HD1 ))
2.900 1.000 1.000 peak 622 spectrum 1 weight 0.10000E+01 volume 0.18000E-02 ppm1 8.176 ppm2 3.565 CV 1
ASSI { 623}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 98 and name HD2 ))
3.900 1.900 1.900 peak 623 spectrum 1 weight 0.10000E+01 volume 0.11128E-02 ppm1 8.177 ppm2 3.194 CV 1
ASSI { 624}
(( segid "SUPF" and resid 97 and name HN ))
(( segid "SUPF" and resid 107 and name HN ))
4.100 2.100 1.900 peak 624 spectrum 1 weight 0.10000E+01 volume 0.52398E-03 ppm1 8.174 ppm2 8.817 CV 1
ASSI { 625}
(( segid "SUPF" and resid 97 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
4.500 2.600 1.500 peak 625 spectrum 1 weight 0.10000E+01 volume 0.49727E-03 ppm1 8.176 ppm2 1.046 CV 1
OR { 625}
(( segid "SUPF" and resid 97 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 627}
(( segid "SUPF" and resid 97 and name HD21))
(( segid "SUPF" and resid 97 and name HA ))
2.500 0.800 0.800 peak 627 spectrum 1 weight 0.10000E+01 volume 0.29150E-02 ppm1 8.001 ppm2 5.995 CV 1
ASSI { 628}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 97 and name HA ))
4.200 2.200 1.800 peak 628 spectrum 1 weight 0.10000E+01 volume 0.15346E-02 ppm1 6.948 ppm2 5.998 CV 1
ASSI { 629}
(( segid "SUPF" and resid 97 and name HD21))
(( segid "SUPF" and resid 97 and name HB1 ))
2.900 1.100 1.100 peak 629 spectrum 1 weight 0.10000E+01 volume 0.15350E-02 ppm1 8.001 ppm2 2.494 CV 1
ASSI { 630}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 97 and name HB1 ))
4.200 2.200 1.800 peak 630 spectrum 1 weight 0.10000E+01 volume 0.74186E-03 ppm1 6.953 ppm2 2.470 CV 1
ASSI { 631}
(( segid "SUPF" and resid 97 and name HD21))
(( segid "SUPF" and resid 97 and name HB2 ))
3.300 1.400 1.400 peak 631 spectrum 1 weight 0.10000E+01 volume 0.19384E-02 ppm1 8.002 ppm2 2.769 CV 1
ASSI { 632}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 97 and name HB2 ))
4.000 2.000 2.000 peak 632 spectrum 1 weight 0.10000E+01 volume 0.11888E-02 ppm1 6.954 ppm2 2.760 CV 1
ASSI { 633}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 97 and name HD21))
1.700 0.400 0.500 peak 633 spectrum 1 weight 0.10000E+01 volume 0.17214E-01 ppm1 6.950 ppm2 7.996 CV 1
ASSI { 635}
(( segid "SUPF" and resid 97 and name HD21))
(( segid "SUPF" and resid 106 and name HA ))
2.900 1.000 1.000 peak 635 spectrum 1 weight 0.10000E+01 volume 0.18141E-02 ppm1 8.001 ppm2 5.489 CV 1
ASSI { 636}
(( segid "SUPF" and resid 97 and name HD22))
(( segid "SUPF" and resid 106 and name HA ))
3.800 1.800 1.800 peak 636 spectrum 1 weight 0.10000E+01 volume 0.11709E-02 ppm1 6.949 ppm2 5.491 CV 1
ASSI { 638}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 98 and name HA ))
2.200 0.600 0.600 peak 638 spectrum 1 weight 0.10000E+01 volume 0.98889E-02 ppm1 8.011 ppm2 4.448 CV 1
ASSI { 639}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 98 and name HB1 ))
3.700 1.700 1.700 peak 639 spectrum 1 weight 0.10000E+01 volume 0.16991E-02 ppm1 8.011 ppm2 2.127 CV 1
ASSI { 640}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 98 and name HG1 ))
4.300 2.300 1.700 peak 640 spectrum 1 weight 0.10000E+01 volume 0.75029E-03 ppm1 8.009 ppm2 1.960 CV 1
OR { 640}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 98 and name HG2 ))
ASSI { 641}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 99 and name HA ))
2.800 1.000 1.000 peak 641 spectrum 1 weight 0.10000E+01 volume 0.22913E-02 ppm1 8.014 ppm2 4.282 CV 1
ASSI { 642}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 99 and name HB ))
2.400 0.700 0.700 peak 642 spectrum 1 weight 0.10000E+01 volume 0.62476E-02 ppm1 8.010 ppm2 1.787 CV 1
ASSI { 643}
(( segid "SUPF" and resid 99 and name HN ))
( segid "SUPF" and resid 99 and name HD1%)
3.900 1.900 1.900 peak 643 spectrum 1 weight 0.10000E+01 volume 0.10871E-02 ppm1 8.009 ppm2 0.742 CV 1
ASSI { 644}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 99 and name HG11))
3.500 1.600 1.600 peak 644 spectrum 1 weight 0.10000E+01 volume 0.37837E-02 ppm1 8.010 ppm2 1.486 CV 1
ASSI { 645}
(( segid "SUPF" and resid 99 and name HN ))
(( segid "SUPF" and resid 99 and name HG12))
2.700 0.900 0.900 peak 645 spectrum 1 weight 0.10000E+01 volume 0.23033E-02 ppm1 8.009 ppm2 1.122 CV 1
ASSI { 646}
(( segid "SUPF" and resid 99 and name HN ))
( segid "SUPF" and resid 99 and name HG2%)
4.000 2.000 2.000 peak 646 spectrum 1 weight 0.10000E+01 volume 0.13087E-02 ppm1 8.017 ppm2 0.565 CV 1
ASSI { 647}
(( segid "SUPF" and resid 100 and name HN ))
( segid "SUPF" and resid 99 and name HG2%)
3.100 1.200 1.200 peak 647 spectrum 1 weight 0.10000E+01 volume 0.25765E-02 ppm1 8.490 ppm2 0.571 CV 1
ASSI { 649}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 99 and name HA ))
2.100 0.600 0.600 peak 649 spectrum 1 weight 0.10000E+01 volume 0.87203E-02 ppm1 8.490 ppm2 4.280 CV 1
ASSI { 650}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 100 and name HA ))
3.000 1.100 1.100 peak 650 spectrum 1 weight 0.10000E+01 volume 0.14810E-02 ppm1 8.492 ppm2 3.800 CV 1
ASSI { 651}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 100 and name HB ))
2.600 0.800 0.800 peak 651 spectrum 1 weight 0.10000E+01 volume 0.31475E-02 ppm1 8.489 ppm2 1.270 CV 1
ASSI { 652}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 102 and name HN ))
3.600 1.600 1.600 peak 652 spectrum 1 weight 0.10000E+01 volume 0.73487E-03 ppm1 8.493 ppm2 8.020 CV 1
ASSI { 653}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 102 and name HA2 ))
3.700 1.700 1.700 peak 653 spectrum 1 weight 0.10000E+01 volume 0.11984E-02 ppm1 8.488 ppm2 4.138 CV 1
ASSI { 654}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 103 and name HN ))
3.100 1.200 1.200 peak 654 spectrum 1 weight 0.10000E+01 volume 0.13585E-02 ppm1 8.488 ppm2 7.734 CV 1
ASSI { 655}
(( segid "SUPF" and resid 100 and name HN ))
(( segid "SUPF" and resid 105 and name HN ))
3.500 1.500 1.500 peak 655 spectrum 1 weight 0.10000E+01 volume 0.88624E-03 ppm1 8.483 ppm2 8.854 CV 1
ASSI { 656}
(( segid "SUPF" and resid 101 and name HN ))
( segid "SUPF" and resid 50 and name HG2%)
3.700 1.700 1.700 peak 656 spectrum 1 weight 0.10000E+01 volume 0.83360E-03 ppm1 8.970 ppm2 1.293 CV 1
ASSI { 657}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 100 and name HN ))
4.500 2.500 1.500 peak 657 spectrum 1 weight 0.10000E+01 volume 0.42441E-03 ppm1 8.969 ppm2 8.504 CV 1
ASSI { 658}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 100 and name HA ))
2.200 0.600 0.600 peak 658 spectrum 1 weight 0.10000E+01 volume 0.83119E-02 ppm1 8.971 ppm2 3.790 CV 1
ASSI { 659}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 100 and name HG11))
5.000 3.100 1.000 peak 659 spectrum 1 weight 0.10000E+01 volume 0.49355E-03 ppm1 8.969 ppm2 0.775 CV 1
ASSI { 660}
(( segid "SUPF" and resid 101 and name HN ))
( segid "SUPF" and resid 100 and name HG2%)
2.800 1.000 1.000 peak 660 spectrum 1 weight 0.10000E+01 volume 0.25673E-02 ppm1 8.972 ppm2 0.461 CV 1
ASSI { 661}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 101 and name HA ))
2.200 0.600 0.600 peak 661 spectrum 1 weight 0.10000E+01 volume 0.85462E-02 ppm1 8.970 ppm2 4.245 CV 1
ASSI { 662}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 101 and name HB1 ))
3.600 1.600 1.600 peak 662 spectrum 1 weight 0.10000E+01 volume 0.12384E-02 ppm1 8.973 ppm2 2.196 CV 1
ASSI { 663}
(( segid "SUPF" and resid 101 and name HN ))
(( segid "SUPF" and resid 101 and name HB2 ))
3.400 1.400 1.400 peak 663 spectrum 1 weight 0.10000E+01 volume 0.93732E-03 ppm1 8.969 ppm2 2.982 CV 1
ASSI { 666}
(( segid "SUPF" and resid 102 and name HN ))
( segid "SUPF" and resid 99 and name HD1%)
5.200 3.400 0.800 peak 666 spectrum 1 weight 0.10000E+01 volume 0.46373E-03 ppm1 8.045 ppm2 0.730 CV 1
ASSI { 667}
(( segid "SUPF" and resid 102 and name HN ))
( segid "SUPF" and resid 99 and name HG2%)
2.600 0.900 0.900 peak 667 spectrum 1 weight 0.10000E+01 volume 0.39399E-02 ppm1 8.042 ppm2 0.567 CV 1
ASSI { 669}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 100 and name HA ))
3.300 1.300 1.300 peak 669 spectrum 1 weight 0.10000E+01 volume 0.14582E-02 ppm1 8.041 ppm2 3.789 CV 1
ASSI { 670}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 101 and name HN ))
2.900 1.000 1.000 peak 670 spectrum 1 weight 0.10000E+01 volume 0.19518E-02 ppm1 8.041 ppm2 8.973 CV 1
ASSI { 671}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 101 and name HA ))
2.800 1.000 1.000 peak 671 spectrum 1 weight 0.10000E+01 volume 0.34405E-02 ppm1 8.043 ppm2 4.245 CV 1
ASSI { 672}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 102 and name HA1 ))
2.800 1.000 1.000 peak 672 spectrum 1 weight 0.10000E+01 volume 0.54476E-02 ppm1 8.043 ppm2 3.467 CV 1
ASSI { 673}
(( segid "SUPF" and resid 102 and name HN ))
(( segid "SUPF" and resid 102 and name HA2 ))
2.500 0.800 0.800 peak 673 spectrum 1 weight 0.10000E+01 volume 0.38163E-02 ppm1 8.043 ppm2 4.119 CV 1
ASSI { 676}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 43 and name HG1 ))
4.300 2.300 1.700 peak 676 spectrum 1 weight 0.10000E+01 volume 0.36088E-03 ppm1 7.748 ppm2 1.959 CV 1
ASSI { 677}
(( segid "SUPF" and resid 103 and name HN ))
( segid "SUPF" and resid 99 and name HG2%)
2.900 1.000 1.000 peak 677 spectrum 1 weight 0.10000E+01 volume 0.30176E-02 ppm1 7.747 ppm2 0.568 CV 1
ASSI { 678}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 100 and name HA ))
4.100 2.100 1.900 peak 678 spectrum 1 weight 0.10000E+01 volume 0.49521E-03 ppm1 7.746 ppm2 3.791 CV 1
ASSI { 679}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 102 and name HN ))
2.700 0.900 0.900 peak 679 spectrum 1 weight 0.10000E+01 volume 0.28741E-02 ppm1 7.749 ppm2 8.030 CV 1
ASSI { 680}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 102 and name HA1 ))
3.500 1.500 1.500 peak 680 spectrum 1 weight 0.10000E+01 volume 0.93642E-03 ppm1 7.748 ppm2 3.482 CV 1
ASSI { 681}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 102 and name HA2 ))
3.600 1.600 1.600 peak 681 spectrum 1 weight 0.10000E+01 volume 0.96497E-03 ppm1 7.751 ppm2 4.116 CV 1
ASSI { 682}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 103 and name HA ))
2.700 0.900 0.900 peak 682 spectrum 1 weight 0.10000E+01 volume 0.32669E-02 ppm1 7.750 ppm2 4.660 CV 1
ASSI { 683}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 103 and name HB1 ))
2.600 0.800 0.800 peak 683 spectrum 1 weight 0.10000E+01 volume 0.37494E-02 ppm1 7.750 ppm2 1.826 CV 1
ASSI { 684}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 103 and name HB2 ))
2.600 0.900 0.900 peak 684 spectrum 1 weight 0.10000E+01 volume 0.42214E-02 ppm1 7.750 ppm2 1.636 CV 1
ASSI { 685}
(( segid "SUPF" and resid 103 and name HN ))
(( segid "SUPF" and resid 104 and name HN ))
3.400 1.500 1.500 peak 685 spectrum 1 weight 0.10000E+01 volume 0.23868E-02 ppm1 7.747 ppm2 8.477 CV 1
ASSI { 686}
(( segid "SUPF" and resid 104 and name HN ))
( segid "SUPF" and resid 99 and name HD1%)
4.200 2.200 1.800 peak 686 spectrum 1 weight 0.10000E+01 volume 0.46981E-03 ppm1 8.475 ppm2 0.717 CV 1
ASSI { 688}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HA ))
2.100 0.500 0.500 peak 688 spectrum 1 weight 0.10000E+01 volume 0.12130E-01 ppm1 8.470 ppm2 4.656 CV 1
ASSI { 689}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HB1 ))
3.400 1.500 1.500 peak 689 spectrum 1 weight 0.10000E+01 volume 0.14812E-02 ppm1 8.472 ppm2 1.834 CV 1
ASSI { 690}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HB2 ))
2.900 1.000 1.000 peak 690 spectrum 1 weight 0.10000E+01 volume 0.72102E-02 ppm1 8.472 ppm2 1.610 CV 1
ASSI { 691}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HD2 ))
3.300 1.400 1.400 peak 691 spectrum 1 weight 0.10000E+01 volume 0.12051E-02 ppm1 8.472 ppm2 3.133 CV 1
OR { 691}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 103 and name HD1 ))
ASSI { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HB1 ))
2.400 0.700 0.700 peak 692 spectrum 1 weight 0.10000E+01 volume 0.66578E-02 ppm1 8.472 ppm2 1.678 CV 1
OR { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HB2 ))
OR { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HG1 ))
OR { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HG2 ))
OR { 692}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HD2 ))
ASSI { 693}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HA ))
2.700 0.900 0.900 peak 693 spectrum 1 weight 0.10000E+01 volume 0.24621E-02 ppm1 8.472 ppm2 4.191 CV 1
ASSI { 694}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HG1 ))
4.000 2.000 2.000 peak 694 spectrum 1 weight 0.10000E+01 volume 0.13334E-02 ppm1 8.468 ppm2 1.342 CV 1
OR { 694}
(( segid "SUPF" and resid 104 and name HN ))
(( segid "SUPF" and resid 104 and name HG2 ))
ASSI { 696}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HB2 ))
4.000 2.000 2.000 peak 696 spectrum 1 weight 0.10000E+01 volume 0.10670E-02 ppm1 8.840 ppm2 1.612 CV 1
ASSI { 697}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 99 and name HA ))
3.200 1.300 1.300 peak 697 spectrum 1 weight 0.10000E+01 volume 0.13025E-02 ppm1 8.845 ppm2 4.308 CV 1
ASSI { 698}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 41 and name HA1 ))
4.000 2.000 2.000 peak 698 spectrum 1 weight 0.10000E+01 volume 0.75854E-03 ppm1 8.840 ppm2 4.011 CV 1
ASSI { 699}
(( segid "SUPF" and resid 105 and name HN ))
( segid "SUPF" and resid 99 and name HD1%)
4.200 2.200 1.800 peak 699 spectrum 1 weight 0.10000E+01 volume 0.57091E-03 ppm1 8.840 ppm2 0.709 CV 1
ASSI { 701}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HN ))
3.900 1.900 1.900 peak 701 spectrum 1 weight 0.10000E+01 volume 0.12054E-02 ppm1 8.845 ppm2 8.475 CV 1
ASSI { 702}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HG1 ))
3.700 1.700 1.700 peak 702 spectrum 1 weight 0.10000E+01 volume 0.71722E-03 ppm1 8.838 ppm2 1.683 CV 1
OR { 702}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HG2 ))
OR { 702}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HB1 ))
OR { 702}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HB2 ))
ASSI { 703}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 104 and name HA ))
2.100 0.600 0.600 peak 703 spectrum 1 weight 0.10000E+01 volume 0.95841E-02 ppm1 8.841 ppm2 4.174 CV 1
ASSI { 704}
(( segid "SUPF" and resid 105 and name HN ))
(( segid "SUPF" and resid 105 and name HA ))
3.000 1.100 1.100 peak 704 spectrum 1 weight 0.10000E+01 volume 0.16983E-02 ppm1 8.840 ppm2 4.692 CV 1
ASSI { 705}
(( segid "SUPF" and resid 105 and name HN ))
( segid "SUPF" and resid 105 and name HB% )
2.500 0.800 0.800 peak 705 spectrum 1 weight 0.10000E+01 volume 0.51547E-02 ppm1 8.841 ppm2 1.278 CV 1
ASSI { 707}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 39 and name HA ))
3.700 1.700 1.700 peak 707 spectrum 1 weight 0.10000E+01 volume 0.89064E-03 ppm1 8.214 ppm2 4.508 CV 1
ASSI { 710}
(( segid "SUPF" and resid 106 and name HN ))
( segid "SUPF" and resid 39 and name HG1%)
3.400 1.400 1.400 peak 710 spectrum 1 weight 0.10000E+01 volume 0.91395E-03 ppm1 8.210 ppm2 0.731 CV 1
ASSI { 711}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 40 and name HN ))
3.100 1.200 1.200 peak 711 spectrum 1 weight 0.10000E+01 volume 0.12507E-02 ppm1 8.211 ppm2 8.939 CV 1
ASSI { 712}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 40 and name HA1 ))
3.700 1.700 1.700 peak 712 spectrum 1 weight 0.10000E+01 volume 0.63295E-03 ppm1 8.212 ppm2 3.743 CV 1
ASSI { 713}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 105 and name HA ))
2.400 0.700 0.700 peak 713 spectrum 1 weight 0.10000E+01 volume 0.61820E-02 ppm1 8.211 ppm2 4.676 CV 1
ASSI { 714}
(( segid "SUPF" and resid 106 and name HN ))
( segid "SUPF" and resid 105 and name HB% )
2.400 0.700 0.700 peak 714 spectrum 1 weight 0.10000E+01 volume 0.77656E-02 ppm1 8.211 ppm2 1.278 CV 1
ASSI { 715}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 106 and name HA ))
2.900 1.100 1.100 peak 715 spectrum 1 weight 0.10000E+01 volume 0.18895E-02 ppm1 8.210 ppm2 5.495 CV 1
ASSI { 716}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 106 and name HB1 ))
3.100 1.200 1.200 peak 716 spectrum 1 weight 0.10000E+01 volume 0.26842E-02 ppm1 8.211 ppm2 2.542 CV 1
ASSI { 717}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 106 and name HB2 ))
2.900 1.100 1.100 peak 717 spectrum 1 weight 0.10000E+01 volume 0.18496E-02 ppm1 8.209 ppm2 2.701 CV 1
ASSI { 718}
(( segid "SUPF" and resid 106 and name HN ))
(( segid "SUPF" and resid 107 and name HN ))
3.900 1.900 1.900 peak 718 spectrum 1 weight 0.10000E+01 volume 0.79131E-03 ppm1 8.213 ppm2 8.801 CV 1
ASSI { 719}
(( segid "SUPF" and resid 106 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
4.100 2.100 1.900 peak 719 spectrum 1 weight 0.10000E+01 volume 0.82300E-03 ppm1 8.208 ppm2 1.081 CV 1
ASSI { 720}
(( segid "SUPF" and resid 106 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
3.700 1.700 1.700 peak 720 spectrum 1 weight 0.10000E+01 volume 0.66108E-03 ppm1 8.210 ppm2 1.015 CV 1
ASSI { 721}
(( segid "SUPF" and resid 106 and name HD21))
(( segid "SUPF" and resid 106 and name HB1 ))
3.200 1.200 1.200 peak 721 spectrum 1 weight 0.10000E+01 volume 0.11041E-02 ppm1 7.626 ppm2 2.529 CV 1
ASSI { 722}
(( segid "SUPF" and resid 106 and name HD21))
(( segid "SUPF" and resid 106 and name HB2 ))
3.300 1.400 1.400 peak 722 spectrum 1 weight 0.10000E+01 volume 0.10489E-02 ppm1 7.627 ppm2 2.702 CV 1
ASSI { 723}
(( segid "SUPF" and resid 106 and name HD22))
(( segid "SUPF" and resid 106 and name HB2 ))
4.400 2.500 1.600 peak 723 spectrum 1 weight 0.10000E+01 volume 0.62398E-03 ppm1 6.843 ppm2 2.711 CV 1
ASSI { 724}
(( segid "SUPF" and resid 106 and name HD22))
(( segid "SUPF" and resid 106 and name HD21))
1.700 0.400 0.500 peak 724 spectrum 1 weight 0.10000E+01 volume 0.22402E-01 ppm1 6.845 ppm2 7.622 CV 1
ASSI { 727}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 106 and name HB2 ))
4.000 2.000 2.000 peak 727 spectrum 1 weight 0.10000E+01 volume 0.12199E-02 ppm1 8.825 ppm2 2.720 CV 1
ASSI { 728}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 96 and name HA ))
3.400 1.400 1.400 peak 728 spectrum 1 weight 0.10000E+01 volume 0.81577E-03 ppm1 8.827 ppm2 4.690 CV 1
ASSI { 729}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 97 and name HA ))
3.900 1.900 1.900 peak 729 spectrum 1 weight 0.10000E+01 volume 0.54451E-03 ppm1 8.826 ppm2 5.993 CV 1
ASSI { 730}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 97 and name HD21))
4.100 2.100 1.900 peak 730 spectrum 1 weight 0.10000E+01 volume 0.47945E-03 ppm1 8.827 ppm2 7.994 CV 1
ASSI { 731}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 97 and name HD22))
3.300 3.300 2.700 peak 731 spectrum 1 weight 0.10000E+01 volume 0.45164E-03 ppm1 8.819 ppm2 6.937 CV 1
ASSI { 732}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 106 and name HA ))
2.200 0.600 0.600 peak 732 spectrum 1 weight 0.10000E+01 volume 0.78529E-02 ppm1 8.825 ppm2 5.490 CV 1
ASSI { 733}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 107 and name HA ))
3.000 1.100 1.100 peak 733 spectrum 1 weight 0.10000E+01 volume 0.13945E-02 ppm1 8.825 ppm2 5.334 CV 1
ASSI { 734}
(( segid "SUPF" and resid 107 and name HN ))
(( segid "SUPF" and resid 107 and name HB ))
2.700 0.900 0.900 peak 734 spectrum 1 weight 0.10000E+01 volume 0.27477E-02 ppm1 8.824 ppm2 2.035 CV 1
ASSI { 735}
(( segid "SUPF" and resid 107 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
2.800 0.900 0.900 peak 735 spectrum 1 weight 0.10000E+01 volume 0.29988E-02 ppm1 8.824 ppm2 1.042 CV 1
OR { 735}
(( segid "SUPF" and resid 107 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
ASSI { 736}
(( segid "SUPF" and resid 108 and name HN ))
( segid "SUPF" and resid 37 and name HG2%)
2.700 0.900 0.900 peak 736 spectrum 1 weight 0.10000E+01 volume 0.28706E-02 ppm1 8.790 ppm2 0.720 CV 1
ASSI { 737}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 38 and name HN ))
3.100 1.200 1.200 peak 737 spectrum 1 weight 0.10000E+01 volume 0.12524E-02 ppm1 8.790 ppm2 9.420 CV 1
ASSI { 738}
(( segid "SUPF" and resid 108 and name HN ))
( segid "SUPF" and resid 38 and name HD% )
3.500 1.500 1.500 peak 738 spectrum 1 weight 0.10000E+01 volume 0.79848E-03 ppm1 8.789 ppm2 6.982 CV 1
ASSI { 739}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 39 and name HA ))
3.600 1.700 1.700 peak 739 spectrum 1 weight 0.10000E+01 volume 0.99997E-03 ppm1 8.794 ppm2 4.520 CV 1
ASSI { 740}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 107 and name HA ))
2.100 0.600 0.600 peak 740 spectrum 1 weight 0.10000E+01 volume 0.97539E-02 ppm1 8.791 ppm2 5.357 CV 1
ASSI { 741}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 107 and name HB ))
4.000 2.000 2.000 peak 741 spectrum 1 weight 0.10000E+01 volume 0.81252E-03 ppm1 8.792 ppm2 2.023 CV 1
ASSI { 742}
(( segid "SUPF" and resid 108 and name HN ))
( segid "SUPF" and resid 107 and name HG1%)
2.900 1.000 1.000 peak 742 spectrum 1 weight 0.10000E+01 volume 0.30334E-02 ppm1 8.792 ppm2 1.054 CV 1
OR { 742}
(( segid "SUPF" and resid 108 and name HN ))
( segid "SUPF" and resid 107 and name HG2%)
ASSI { 743}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 108 and name HA ))
2.700 0.900 0.900 peak 743 spectrum 1 weight 0.10000E+01 volume 0.27052E-02 ppm1 8.793 ppm2 4.927 CV 1
ASSI { 744}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 108 and name HB1 ))
3.100 1.200 1.200 peak 744 spectrum 1 weight 0.10000E+01 volume 0.14500E-02 ppm1 8.793 ppm2 3.006 CV 1
ASSI { 745}
(( segid "SUPF" and resid 108 and name HN ))
(( segid "SUPF" and resid 108 and name HB2 ))
3.800 1.800 1.800 peak 745 spectrum 1 weight 0.10000E+01 volume 0.63217E-03 ppm1 8.797 ppm2 2.804 CV 1
ASSI { 748}
(( segid "SUPF" and resid 108 and name HD21))
(( segid "SUPF" and resid 108 and name HB1 ))
3.200 1.300 1.300 peak 748 spectrum 1 weight 0.10000E+01 volume 0.98521E-03 ppm1 7.064 ppm2 2.997 CV 1
ASSI { 749}
(( segid "SUPF" and resid 108 and name HD22))
(( segid "SUPF" and resid 108 and name HB1 ))
4.200 2.200 1.800 peak 749 spectrum 1 weight 0.10000E+01 volume 0.91763E-03 ppm1 6.975 ppm2 3.003 CV 1
ASSI { 750}
(( segid "SUPF" and resid 108 and name HD21))
(( segid "SUPF" and resid 108 and name HB2 ))
3.200 1.300 1.300 peak 750 spectrum 1 weight 0.10000E+01 volume 0.13137E-02 ppm1 7.065 ppm2 2.798 CV 1
ASSI { 751}
(( segid "SUPF" and resid 108 and name HD22))
(( segid "SUPF" and resid 108 and name HB2 ))
4.500 2.600 1.500 peak 751 spectrum 1 weight 0.10000E+01 volume 0.58504E-03 ppm1 6.975 ppm2 2.805 CV 1
ASSI { 752}
(( segid "SUPF" and resid 108 and name HD22))
( segid "SUPF" and resid 112 and name HD1%)
4.200 2.200 1.800 peak 752 spectrum 1 weight 0.10000E+01 volume 0.34211E-03 ppm1 6.974 ppm2 0.892 CV 1
ASSI { 754}
(( segid "SUPF" and resid 109 and name HN ))
( segid "SUPF" and resid 109 and name HD1%)
4.300 2.400 1.700 peak 754 spectrum 1 weight 0.10000E+01 volume 0.86902E-03 ppm1 9.232 ppm2 1.290 CV 1
ASSI { 756}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 108 and name HA ))
2.400 0.700 0.700 peak 756 spectrum 1 weight 0.10000E+01 volume 0.55017E-02 ppm1 9.232 ppm2 4.918 CV 1
ASSI { 757}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 108 and name HB1 ))
3.300 1.300 1.300 peak 757 spectrum 1 weight 0.10000E+01 volume 0.18904E-02 ppm1 9.231 ppm2 3.017 CV 1
ASSI { 758}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 108 and name HB2 ))
3.100 1.200 1.200 peak 758 spectrum 1 weight 0.10000E+01 volume 0.24089E-02 ppm1 9.232 ppm2 2.794 CV 1
ASSI { 759}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 108 and name HD21))
3.900 1.900 1.900 peak 759 spectrum 1 weight 0.10000E+01 volume 0.43314E-03 ppm1 9.228 ppm2 7.068 CV 1
ASSI { 760}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 109 and name HA ))
3.100 1.200 1.200 peak 760 spectrum 1 weight 0.10000E+01 volume 0.97479E-03 ppm1 9.231 ppm2 4.465 CV 1
ASSI { 761}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 109 and name HB1 ))
2.500 0.800 0.800 peak 761 spectrum 1 weight 0.10000E+01 volume 0.39216E-02 ppm1 9.231 ppm2 1.783 CV 1
OR { 761}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 109 and name HB2 ))
ASSI { 762}
(( segid "SUPF" and resid 109 and name HN ))
(( segid "SUPF" and resid 109 and name HG ))
2.400 0.700 0.700 peak 762 spectrum 1 weight 0.10000E+01 volume 0.40922E-02 ppm1 9.230 ppm2 2.029 CV 1
ASSI { 763}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 110 and name HA ))
3.300 1.400 1.400 peak 763 spectrum 1 weight 0.10000E+01 volume 0.93257E-03 ppm1 9.228 ppm2 4.171 CV 1
ASSI { 764}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 37 and name HA ))
2.900 1.100 1.100 peak 764 spectrum 1 weight 0.10000E+01 volume 0.14922E-02 ppm1 9.227 ppm2 4.264 CV 1
ASSI { 766}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 109 and name HA ))
2.400 0.700 0.700 peak 766 spectrum 1 weight 0.10000E+01 volume 0.37983E-02 ppm1 9.225 ppm2 4.466 CV 1
ASSI { 767}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 109 and name HB2 ))
3.300 1.400 1.400 peak 767 spectrum 1 weight 0.10000E+01 volume 0.10399E-02 ppm1 9.224 ppm2 1.794 CV 1
OR { 767}
(( segid "SUPF" and resid 110 and name HN ))
(( segid "SUPF" and resid 109 and name HB1 ))
ASSI { 768}
(( segid "SUPF" and resid 110 and name HN ))
( segid "SUPF" and resid 109 and name HD2%)
4.000 2.000 2.000 peak 768 spectrum 1 weight 0.10000E+01 volume 0.12440E-02 ppm1 9.225 ppm2 0.856 CV 1
ASSI { 769}
(( segid "SUPF" and resid 110 and name HN ))
( segid "SUPF" and resid 110 and name HB% )
2.600 0.800 0.800 peak 769 spectrum 1 weight 0.10000E+01 volume 0.36429E-02 ppm1 9.225 ppm2 1.490 CV 1
ASSI { 772}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 109 and name HB2 ))
3.200 1.300 1.300 peak 772 spectrum 1 weight 0.10000E+01 volume 0.98304E-03 ppm1 8.887 ppm2 1.795 CV 1
OR { 772}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 109 and name HB1 ))
ASSI { 773}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 110 and name HN ))
3.100 1.200 1.200 peak 773 spectrum 1 weight 0.10000E+01 volume 0.92479E-03 ppm1 8.890 ppm2 9.250 CV 1
ASSI { 774}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 110 and name HA ))
3.700 1.700 1.700 peak 774 spectrum 1 weight 0.10000E+01 volume 0.63199E-03 ppm1 8.886 ppm2 4.143 CV 1
ASSI { 775}
(( segid "SUPF" and resid 111 and name HN ))
( segid "SUPF" and resid 110 and name HB% )
2.900 1.100 1.100 peak 775 spectrum 1 weight 0.10000E+01 volume 0.21462E-02 ppm1 8.888 ppm2 1.497 CV 1
ASSI { 776}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 111 and name HA ))
2.900 1.000 1.000 peak 776 spectrum 1 weight 0.10000E+01 volume 0.26653E-02 ppm1 8.886 ppm2 4.446 CV 1
ASSI { 777}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 111 and name HB1 ))
2.500 0.800 0.800 peak 777 spectrum 1 weight 0.10000E+01 volume 0.29997E-02 ppm1 8.887 ppm2 2.852 CV 1
ASSI { 778}
(( segid "SUPF" and resid 111 and name HN ))
(( segid "SUPF" and resid 111 and name HB2 ))
3.900 1.900 1.900 peak 778 spectrum 1 weight 0.10000E+01 volume 0.17394E-02 ppm1 8.885 ppm2 3.182 CV 1
ASSI { 779}
(( segid "SUPF" and resid 111 and name HN ))
( segid "SUPF" and resid 111 and name HD% )
2.800 1.000 1.000 peak 779 spectrum 1 weight 0.10000E+01 volume 0.27903E-02 ppm1 8.886 ppm2 7.071 CV 1
ASSI { 780}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 111 and name HN ))
3.100 1.200 1.200 peak 780 spectrum 1 weight 0.10000E+01 volume 0.91510E-03 ppm1 7.147 ppm2 8.873 CV 1
ASSI { 781}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 111 and name HA ))
3.300 1.400 1.400 peak 781 spectrum 1 weight 0.10000E+01 volume 0.10306E-02 ppm1 7.146 ppm2 4.430 CV 1
ASSI { 782}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 112 and name HA ))
3.100 1.200 1.200 peak 782 spectrum 1 weight 0.10000E+01 volume 0.12449E-02 ppm1 7.151 ppm2 3.940 CV 1
ASSI { 783}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 112 and name HB1 ))
3.700 1.800 1.800 peak 783 spectrum 1 weight 0.10000E+01 volume 0.18669E-02 ppm1 7.147 ppm2 1.539 CV 1
ASSI { 784}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 112 and name HB2 ))
3.200 1.200 1.200 peak 784 spectrum 1 weight 0.10000E+01 volume 0.75216E-03 ppm1 7.146 ppm2 1.428 CV 1
ASSI { 785}
(( segid "SUPF" and resid 112 and name HN ))
( segid "SUPF" and resid 112 and name HD1%)
4.200 2.200 1.800 peak 785 spectrum 1 weight 0.10000E+01 volume 0.98304E-03 ppm1 7.143 ppm2 0.894 CV 1
ASSI { 786}
(( segid "SUPF" and resid 112 and name HN ))
(( segid "SUPF" and resid 112 and name HG ))
2.900 1.000 1.000 peak 786 spectrum 1 weight 0.10000E+01 volume 0.16495E-02 ppm1 7.141 ppm2 0.721 CV 1
ASSI { 788}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 110 and name HA ))
3.500 1.600 1.600 peak 788 spectrum 1 weight 0.10000E+01 volume 0.66217E-03 ppm1 7.467 ppm2 4.143 CV 1
ASSI { 789}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 112 and name HN ))
2.900 1.000 1.000 peak 789 spectrum 1 weight 0.10000E+01 volume 0.17376E-02 ppm1 7.472 ppm2 7.157 CV 1
ASSI { 790}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 112 and name HA ))
3.200 1.300 1.300 peak 790 spectrum 1 weight 0.10000E+01 volume 0.15134E-02 ppm1 7.472 ppm2 3.954 CV 1
ASSI { 791}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 112 and name HB1 ))
4.100 2.100 1.900 peak 791 spectrum 1 weight 0.10000E+01 volume 0.68765E-03 ppm1 7.469 ppm2 1.541 CV 1
ASSI { 792}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 112 and name HB2 ))
3.600 1.600 1.600 peak 792 spectrum 1 weight 0.10000E+01 volume 0.46531E-03 ppm1 7.474 ppm2 1.442 CV 1
ASSI { 793}
(( segid "SUPF" and resid 113 and name HN ))
( segid "SUPF" and resid 112 and name HD2%)
3.400 1.400 1.400 peak 793 spectrum 1 weight 0.10000E+01 volume 0.42475E-03 ppm1 7.463 ppm2 0.673 CV 1
ASSI { 794}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 113 and name HA1 ))
2.800 1.000 1.000 peak 794 spectrum 1 weight 0.10000E+01 volume 0.28706E-02 ppm1 7.472 ppm2 3.869 CV 1
ASSI { 795}
(( segid "SUPF" and resid 113 and name HN ))
(( segid "SUPF" and resid 113 and name HA2 ))
2.700 0.900 0.900 peak 795 spectrum 1 weight 0.10000E+01 volume 0.35480E-02 ppm1 7.471 ppm2 3.651 CV 1
ASSI { 797}
(( segid "SUPF" and resid 114 and name HN ))
(( segid "SUPF" and resid 113 and name HN ))
4.000 2.000 2.000 peak 797 spectrum 1 weight 0.10000E+01 volume 0.48423E-03 ppm1 7.959 ppm2 7.475 CV 1
ASSI { 798}
(( segid "SUPF" and resid 114 and name HN ))
(( segid "SUPF" and resid 113 and name HA2 ))
2.700 0.900 0.900 peak 798 spectrum 1 weight 0.10000E+01 volume 0.25383E-02 ppm1 7.955 ppm2 3.653 CV 1
ASSI { 799}
(( segid "SUPF" and resid 114 and name HN ))
( segid "SUPF" and resid 114 and name HB% )
2.700 0.900 0.900 peak 799 spectrum 1 weight 0.10000E+01 volume 0.34809E-02 ppm1 7.953 ppm2 1.166 CV 1
ASSI { 800}
(( segid "SUPF" and resid 114 and name HN ))
(( segid "SUPF" and resid 115 and name HN ))
4.300 2.300 1.700 peak 800 spectrum 1 weight 0.10000E+01 volume 0.63783E-03 ppm1 7.951 ppm2 7.666 CV 1
ASSI { 801}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 114 and name HA ))
2.600 0.800 0.800 peak 801 spectrum 1 weight 0.10000E+01 volume 0.40635E-02 ppm1 7.665 ppm2 3.841 CV 1
ASSI { 802}
(( segid "SUPF" and resid 115 and name HN ))
( segid "SUPF" and resid 114 and name HB% )
3.300 1.300 1.300 peak 802 spectrum 1 weight 0.10000E+01 volume 0.16809E-02 ppm1 7.668 ppm2 1.166 CV 1
ASSI { 803}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HA ))
3.000 1.100 1.100 peak 803 spectrum 1 weight 0.10000E+01 volume 0.17462E-02 ppm1 7.666 ppm2 4.462 CV 1
ASSI { 804}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HB1 ))
3.500 1.600 1.600 peak 804 spectrum 1 weight 0.10000E+01 volume 0.72716E-03 ppm1 7.671 ppm2 1.732 CV 1
ASSI { 805}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HB2 ))
3.100 1.200 1.200 peak 805 spectrum 1 weight 0.10000E+01 volume 0.18605E-02 ppm1 7.665 ppm2 1.571 CV 1
ASSI { 806}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HG2 ))
3.400 1.400 1.400 peak 806 spectrum 1 weight 0.10000E+01 volume 0.97112E-03 ppm1 7.667 ppm2 1.364 CV 1
OR { 806}
(( segid "SUPF" and resid 115 and name HN ))
(( segid "SUPF" and resid 115 and name HG1 ))
ASSI { 808}
(( segid "SUPF" and resid 117 and name HN ))
(( segid "SUPF" and resid 116 and name HA ))
2.500 0.800 0.800 peak 808 spectrum 1 weight 0.10000E+01 volume 0.58018E-02 ppm1 8.509 ppm2 4.386 CV 1
ASSI { 809}
(( segid "SUPF" and resid 117 and name HN ))
(( segid "SUPF" and resid 117 and name HG2 ))
3.700 1.700 1.700 peak 809 spectrum 1 weight 0.10000E+01 volume 0.54446E-03 ppm1 8.510 ppm2 1.664 CV 1
OR { 809}
(( segid "SUPF" and resid 117 and name HN ))
(( segid "SUPF" and resid 117 and name HG1 ))
ASSI { 810}
(( segid "SUPF" and resid 118 and name HN ))
(( segid "SUPF" and resid 117 and name HA ))
3.100 1.200 1.200 peak 810 spectrum 1 weight 0.10000E+01 volume 0.15664E-02 ppm1 8.167 ppm2 4.366 CV 1
ASSI { 812}
(( segid "SUPF" and resid 119 and name HD22))
(( segid "SUPF" and resid 119 and name HD21))
1.800 0.400 0.400 peak 812 spectrum 1 weight 0.10000E+01 volume 0.16863E-01 ppm1 6.907 ppm2 7.606 CV 1
ASSI { 814}
(( segid "SUPF" and resid 120 and name HN ))
(( segid "SUPF" and resid 120 and name HA ))
3.600 1.600 1.600 peak 814 spectrum 1 weight 0.10000E+01 volume 0.70265E-03 ppm1 8.082 ppm2 4.136 CV 1
ASSI { 815}
(( segid "SUPF" and resid 120 and name HN ))
(( segid "SUPF" and resid 120 and name HB ))
3.400 1.400 1.400 peak 815 spectrum 1 weight 0.10000E+01 volume 0.98142E-03 ppm1 8.086 ppm2 2.117 CV 1
ASSI { 816}
(( segid "SUPF" and resid 120 and name HN ))
( segid "SUPF" and resid 120 and name HG2%)
3.500 1.500 1.500 peak 816 spectrum 1 weight 0.10000E+01 volume 0.94238E-03 ppm1 8.082 ppm2 0.919 CV 1
OR { 816}
(( segid "SUPF" and resid 120 and name HN ))
( segid "SUPF" and resid 120 and name HG1%)
ASSI { 817}
(( segid "SUPF" and resid 121 and name HE22))
(( segid "SUPF" and resid 121 and name HE21))
1.700 0.300 0.500 peak 817 spectrum 1 weight 0.10000E+01 volume 0.28395E-01 ppm1 6.816 ppm2 7.520 CV 1
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