Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
20380 | 2fo8 RC | 6876 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
! Unambigous Restraints
ASSI { 4}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 106 and name HN ))
3.200 1.200 1.200 peak 4 spectrum 1 weight 0.10000E+01 volume 0.16789E-02 ppm1 0.786 ppm2 8.655 CV 1
ASSI { 5}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 85 and name HN ))
4.300 2.300 1.700 peak 5 spectrum 1 weight 0.10000E+01 volume 0.16661E-03 ppm1 0.787 ppm2 8.596 CV 1
ASSI { 7}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 22 and name HN ))
3.500 1.500 1.500 peak 7 spectrum 1 weight 0.10000E+01 volume 0.12761E-02 ppm1 0.731 ppm2 9.385 CV 1
ASSI { 8}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 85 and name HN ))
3.800 1.800 1.800 peak 8 spectrum 1 weight 0.10000E+01 volume 0.63594E-03 ppm1 0.676 ppm2 8.594 CV 1
ASSI { 11}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 75 and name HN ))
6.000 5.900 0.000 peak 11 spectrum 1 weight 0.10000E+01 volume 0.12888E-04 ppm1 0.660 ppm2 9.823 CV 1
ASSI { 13}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 107 and name HN ))
4.400 2.400 1.600 peak 13 spectrum 1 weight 0.10000E+01 volume 0.23784E-03 ppm1 0.660 ppm2 9.155 CV 1
ASSI { 18}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 24 and name HN ))
3.200 1.300 1.300 peak 18 spectrum 1 weight 0.10000E+01 volume 0.83943E-03 ppm1 0.600 ppm2 9.082 CV 1
ASSI { 24}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 106 and name HN ))
1.500 1.500 4.500 peak 24 spectrum 1 weight 0.10000E+01 volume 0.38834E+00 ppm1 0.570 ppm2 8.653 CV 1
ASSI { 33}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 107 and name HN ))
4.100 2.100 1.900 peak 33 spectrum 1 weight 0.10000E+01 volume 0.32814E-03 ppm1 0.266 ppm2 9.204 CV 1
ASSI { 36}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 24 and name HN ))
4.000 2.000 2.000 peak 36 spectrum 1 weight 0.10000E+01 volume 0.63594E-03 ppm1 0.125 ppm2 9.081 CV 1
ASSI { 41}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HN ))
4.500 2.500 1.500 peak 41 spectrum 1 weight 0.10000E+01 volume 0.31881E-03 ppm1 -0.817 ppm2 9.339 CV 1
ASSI { 42}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 37 and name HN ))
4.500 2.500 1.500 peak 42 spectrum 1 weight 0.10000E+01 volume 0.30525E-03 ppm1 -0.816 ppm2 9.101 CV 1
ASSI { 43}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 36 and name HE1 ))
4.600 2.700 1.400 peak 43 spectrum 1 weight 0.10000E+01 volume 0.46635E-03 ppm1 -1.275 ppm2 10.265 CV 1
ASSI { 47}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 106 and name HN ))
3.900 1.900 1.900 peak 47 spectrum 1 weight 0.10000E+01 volume 0.14499E-02 ppm1 0.960 ppm2 8.645 CV 1
ASSI { 51}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 109 and name HN ))
4.800 2.900 1.200 peak 51 spectrum 1 weight 0.10000E+01 volume 0.36333E-03 ppm1 0.928 ppm2 9.085 CV 1
ASSI { 52}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 76 and name HN ))
4.300 2.300 1.700 peak 52 spectrum 1 weight 0.10000E+01 volume 0.50874E-03 ppm1 0.910 ppm2 8.746 CV 1
ASSI { 53}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 22 and name HN ))
4.000 2.000 2.000 peak 53 spectrum 1 weight 0.10000E+01 volume 0.55114E-03 ppm1 0.909 ppm2 9.385 CV 1
ASSI { 54}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 16 and name HN ))
4.400 2.400 1.600 peak 54 spectrum 1 weight 0.10000E+01 volume 0.62321E-03 ppm1 0.906 ppm2 8.618 CV 1
ASSI { 55}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 109 and name HN ))
3.800 1.800 1.800 peak 55 spectrum 1 weight 0.10000E+01 volume 0.52570E-03 ppm1 2.820 ppm2 9.078 CV 1
ASSI { 58}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 37 and name HN ))
4.100 2.100 1.900 peak 58 spectrum 1 weight 0.10000E+01 volume 0.80551E-03 ppm1 2.630 ppm2 9.102 CV 1
ASSI { 59}
(( segid " " and resid 103 and name HB1 ))
(( segid " " and resid 103 and name HN ))
2.900 1.100 1.100 peak 59 spectrum 1 weight 0.10000E+01 volume 0.64441E-03 ppm1 2.591 ppm2 9.213 CV 1
ASSI { 61}
(( segid " " and resid 90 and name HG1 ))
(( segid " " and resid 90 and name HN ))
3.200 1.300 1.300 peak 61 spectrum 1 weight 0.10000E+01 volume 0.47059E-03 ppm1 2.498 ppm2 8.971 CV 1
ASSI { 63}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 107 and name HN ))
4.400 2.400 1.600 peak 63 spectrum 1 weight 0.10000E+01 volume 0.55962E-03 ppm1 2.406 ppm2 9.204 CV 1
ASSI { 72}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 24 and name HN ))
5.500 3.800 0.500 peak 72 spectrum 1 weight 0.10000E+01 volume 0.43243E-04 ppm1 1.949 ppm2 9.075 CV 1
ASSI { 73}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 108 and name HN ))
4.200 2.200 1.800 peak 73 spectrum 1 weight 0.10000E+01 volume 0.21748E-03 ppm1 1.923 ppm2 9.160 CV 1
ASSI { 76}
(( segid " " and resid 108 and name HB1 ))
(( segid " " and resid 16 and name HN ))
3.100 1.200 1.200 peak 76 spectrum 1 weight 0.10000E+01 volume 0.12379E-02 ppm1 1.784 ppm2 8.655 CV 1
ASSI { 84}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 107 and name HN ))
3.500 1.600 2.500 peak 84 spectrum 1 weight 0.10000E+01 volume 0.13651E-02 ppm1 1.541 ppm2 9.203 CV 1
ASSI { 85}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 106 and name HN ))
4.000 2.000 2.000 peak 85 spectrum 1 weight 0.10000E+01 volume 0.27006E-03 ppm1 1.535 ppm2 8.655 CV 1
ASSI { 92}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 109 and name HN ))
2.900 1.100 1.100 peak 92 spectrum 1 weight 0.10000E+01 volume 0.13948E-02 ppm1 1.325 ppm2 9.089 CV 1
ASSI { 94}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 22 and name HN ))
4.800 2.800 1.200 peak 94 spectrum 1 weight 0.10000E+01 volume 0.11447E-03 ppm1 1.315 ppm2 9.389 CV 1
ASSI { 98}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 88 and name HN ))
3.400 1.400 1.400 peak 98 spectrum 1 weight 0.10000E+01 volume 0.17594E-02 ppm1 1.248 ppm2 9.391 CV 1
ASSI { 109}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 75 and name HN ))
4.300 2.300 1.700 peak 109 spectrum 1 weight 0.10000E+01 volume 0.58081E-03 ppm1 2.982 ppm2 9.824 CV 1
ASSI { 114}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 90 and name HA ))
3.500 1.600 1.600 peak 114 spectrum 1 weight 0.10000E+01 volume 0.60626E-03 ppm1 4.486 ppm2 4.641 CV 1
ASSI { 119}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 88 and name HN ))
4.200 2.200 1.800 peak 119 spectrum 1 weight 0.10000E+01 volume 0.43243E-03 ppm1 5.331 ppm2 9.393 CV 1
ASSI { 121}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 75 and name HN ))
6.000 5.800 0.000 peak 121 spectrum 1 weight 0.10000E+01 volume 0.50027E-04 ppm1 9.080 ppm2 9.822 CV 1
ASSI { 122}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 75 and name HN ))
2.300 0.600 0.600 peak 122 spectrum 1 weight 0.10000E+01 volume 0.43667E-02 ppm1 5.326 ppm2 9.825 CV 1
ASSI { 123}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 107 and name HN ))
3.800 1.800 1.800 peak 123 spectrum 1 weight 0.10000E+01 volume 0.80128E-03 ppm1 8.654 ppm2 9.197 CV 1
ASSI { 124}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 73 and name HN ))
4.400 2.400 1.600 peak 124 spectrum 1 weight 0.10000E+01 volume 0.10556E-03 ppm1 5.087 ppm2 9.614 CV 1
ASSI { 125}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 85 and name HN ))
4.200 2.200 1.800 peak 125 spectrum 1 weight 0.10000E+01 volume 0.30397E-03 ppm1 5.322 ppm2 8.590 CV 1
ASSI { 126}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HB2 ))
2.900 1.000 1.000 peak 126 spectrum 1 weight 0.10000E+01 volume 0.17255E-02 ppm1 -0.143 ppm2 0.012 CV 1
ASSI { 130}
( segid " " and resid 26 and name HD2%)
( segid " " and resid 87 and name HD2%)
4.700 2.700 1.300 peak 130 spectrum 1 weight 0.10000E+01 volume 0.50451E-03 ppm1 -1.271 ppm2 -0.813 CV 1
ASSI { 132}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 88 and name HN ))
4.000 2.000 2.000 peak 132 spectrum 1 weight 0.10000E+01 volume 0.51299E-03 ppm1 5.005 ppm2 9.391 CV 1
ASSI { 141}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 85 and name HN ))
4.100 2.100 1.900 peak 141 spectrum 1 weight 0.10000E+01 volume 0.10472E-02 ppm1 4.884 ppm2 8.627 CV 1
ASSI { 142}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 85 and name HG1%)
3.100 1.200 1.200 peak 142 spectrum 1 weight 0.10000E+01 volume 0.94544E-03 ppm1 -0.815 ppm2 0.592 CV 1
ASSI { 145}
( segid " " and resid 26 and name HD1%)
( segid " " and resid 24 and name HG2%)
3.400 1.500 1.500 peak 145 spectrum 1 weight 0.10000E+01 volume 0.13143E-02 ppm1 -0.651 ppm2 0.125 CV 1
ASSI { 150}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 24 and name HG2%)
2.900 1.100 1.100 peak 150 spectrum 1 weight 0.10000E+01 volume 0.10514E-02 ppm1 -0.463 ppm2 0.124 CV 1
ASSI { 151}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 85 and name HG2%)
4.800 2.900 1.200 peak 151 spectrum 1 weight 0.10000E+01 volume 0.21919E-03 ppm1 -0.461 ppm2 0.267 CV 1
ASSI { 152}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 85 and name HG1%)
2.900 1.000 1.000 peak 152 spectrum 1 weight 0.10000E+01 volume 0.25819E-02 ppm1 -0.462 ppm2 0.593 CV 1
ASSI { 154}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 87 and name HB2 ))
4.100 2.100 1.900 peak 154 spectrum 1 weight 0.10000E+01 volume 0.30949E-03 ppm1 -1.279 ppm2 1.244 CV 1
ASSI { 156}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 103 and name HB2 ))
3.300 1.400 1.400 peak 156 spectrum 1 weight 0.10000E+01 volume 0.12253E-02 ppm1 -1.278 ppm2 2.254 CV 1
ASSI { 157}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 103 and name HB1 ))
3.500 1.500 1.500 peak 157 spectrum 1 weight 0.10000E+01 volume 0.63169E-03 ppm1 -1.275 ppm2 2.591 CV 1
ASSI { 159}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 16 and name HN ))
4.800 2.900 1.200 peak 159 spectrum 1 weight 0.10000E+01 volume 0.28151E-03 ppm1 4.045 ppm2 8.658 CV 1
ASSI { 164}
(( segid " " and resid 88 and name HB ))
(( segid " " and resid 88 and name HN ))
2.700 0.900 0.900 peak 164 spectrum 1 weight 0.10000E+01 volume 0.19247E-02 ppm1 3.833 ppm2 9.394 CV 1
ASSI { 165}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 106 and name HN ))
4.400 2.400 1.600 peak 165 spectrum 1 weight 0.10000E+01 volume 0.40063E-03 ppm1 7.823 ppm2 8.655 CV 1
ASSI { 168}
(( segid " " and resid 36 and name HE3 ))
(( segid " " and resid 37 and name HN ))
4.400 2.400 1.600 peak 168 spectrum 1 weight 0.10000E+01 volume 0.30271E-03 ppm1 7.072 ppm2 9.103 CV 1
ASSI { 172}
( segid " " and resid 37 and name HD% )
(( segid " " and resid 37 and name HN ))
3.100 1.200 1.200 peak 172 spectrum 1 weight 0.10000E+01 volume 0.14966E-02 ppm1 6.839 ppm2 9.103 CV 1
ASSI { 173}
( segid " " and resid 37 and name HD% )
(( segid " " and resid 90 and name HN ))
3.600 1.600 1.600 peak 173 spectrum 1 weight 0.10000E+01 volume 0.42056E-03 ppm1 6.836 ppm2 8.974 CV 1
ASSI { 176}
(( segid " " and resid 74 and name HD2 ))
(( segid " " and resid 75 and name HN ))
2.900 2.900 3.100 peak 176 spectrum 1 weight 0.10000E+01 volume 0.11192E-03 ppm1 6.733 ppm2 9.826 CV 1
ASSI { 177}
(( segid " " and resid 74 and name HD2 ))
(( segid " " and resid 24 and name HN ))
3.300 1.400 1.400 peak 177 spectrum 1 weight 0.10000E+01 volume 0.61049E-03 ppm1 6.733 ppm2 9.081 CV 1
ASSI { 178}
( segid " " and resid 106 and name HD% )
(( segid " " and resid 85 and name HN ))
4.600 2.600 1.400 peak 178 spectrum 1 weight 0.10000E+01 volume 0.34934E-03 ppm1 6.707 ppm2 8.591 CV 1
ASSI { 181}
( segid " " and resid 103 and name HD% )
(( segid " " and resid 87 and name HN ))
3.400 3.400 2.600 peak 181 spectrum 1 weight 0.10000E+01 volume 0.42819E-03 ppm1 6.689 ppm2 9.339 CV 1
ASSI { 182}
( segid " " and resid 106 and name HE% )
(( segid " " and resid 106 and name HN ))
2.300 2.300 3.700 peak 182 spectrum 1 weight 0.10000E+01 volume 0.38114E-03 ppm1 6.575 ppm2 8.652 CV 1
ASSI { 184}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HB2 ))
3.600 1.600 1.600 peak 184 spectrum 1 weight 0.10000E+01 volume 0.14244E-02 ppm1 -0.815 ppm2 1.240 CV 1
ASSI { 187}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 25 and name HB1 ))
4.400 2.400 1.600 peak 187 spectrum 1 weight 0.10000E+01 volume 0.48331E-03 ppm1 -0.652 ppm2 1.587 CV 1
ASSI { 189}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 103 and name HB2 ))
3.600 1.600 1.600 peak 189 spectrum 1 weight 0.10000E+01 volume 0.22342E-03 ppm1 -0.654 ppm2 2.254 CV 1
ASSI { 191}
(( segid " " and resid 9 and name HD2 ))
(( segid " " and resid 9 and name HE1 ))
4.400 2.400 1.600 peak 191 spectrum 1 weight 0.10000E+01 volume 0.46211E-03 ppm1 7.014 ppm2 7.725 CV 1
ASSI { 193}
(( segid " " and resid 3 and name HD2 ))
(( segid " " and resid 3 and name HE1 ))
4.600 2.700 1.400 peak 193 spectrum 1 weight 0.10000E+01 volume 0.28151E-03 ppm1 6.893 ppm2 8.057 CV 1
ASSI { 194}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 7 and name HB2 ))
2.900 1.000 1.000 peak 194 spectrum 1 weight 0.10000E+01 volume 0.38198E-02 ppm1 -0.650 ppm2 1.719 CV 1
ASSI { 210}
(( segid " " and resid 93 and name HH2 ))
(( segid " " and resid 93 and name HZ2 ))
2.400 0.700 0.700 peak 210 spectrum 1 weight 0.10000E+01 volume 0.57234E-02 ppm1 7.195 ppm2 7.390 CV 1
ASSI { 214}
(( segid " " and resid 36 and name HZ3 ))
(( segid " " and resid 36 and name HE3 ))
2.500 0.800 0.800 peak 214 spectrum 1 weight 0.10000E+01 volume 0.22978E-02 ppm1 6.755 ppm2 7.072 CV 1
ASSI { 222}
( segid " " and resid 106 and name HE% )
( segid " " and resid 106 and name HD% )
2.100 0.500 0.500 peak 222 spectrum 1 weight 0.10000E+01 volume 0.12718E-01 ppm1 6.576 ppm2 6.695 CV 1
ASSI { 224}
(( segid " " and resid 40 and name HA1 ))
( segid " " and resid 37 and name HE% )
4.400 2.400 1.600 peak 224 spectrum 1 weight 0.10000E+01 volume 0.60626E-03 ppm1 4.242 ppm2 6.719 CV 1
ASSI { 227}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 36 and name HB2 ))
3.200 1.200 1.200 peak 227 spectrum 1 weight 0.10000E+01 volume 0.62745E-04 ppm1 -0.462 ppm2 2.638 CV 1
ASSI { 231}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 89 and name HE% )
2.400 2.400 3.600 peak 231 spectrum 1 weight 0.10000E+01 volume 0.46635E-02 ppm1 4.118 ppm2 6.472 CV 1
ASSI { 233}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 83 and name HE1 ))
4.300 2.400 1.700 peak 233 spectrum 1 weight 0.10000E+01 volume 0.12082E-03 ppm1 3.994 ppm2 7.791 CV 1
ASSI { 237}
(( segid " " and resid 85 and name HA ))
( segid " " and resid 38 and name HD% )
5.900 4.300 0.100 peak 237 spectrum 1 weight 0.10000E+01 volume 0.84367E-04 ppm1 3.993 ppm2 7.496 CV 1
ASSI { 238}
(( segid " " and resid 94 and name HB ))
(( segid " " and resid 93 and name HD1 ))
4.500 2.500 1.500 peak 238 spectrum 1 weight 0.10000E+01 volume 0.15517E-03 ppm1 3.990 ppm2 7.111 CV 1
ASSI { 248}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 36 and name HD1 ))
3.600 1.600 1.600 peak 248 spectrum 1 weight 0.10000E+01 volume 0.12931E-02 ppm1 3.872 ppm2 7.416 CV 1
ASSI { 253}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 51 and name HD% )
2.700 0.900 0.900 peak 253 spectrum 1 weight 0.10000E+01 volume 0.20265E-02 ppm1 3.795 ppm2 6.660 CV 1
ASSI { 254}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 72 and name HE1 ))
5.500 3.800 0.500 peak 254 spectrum 1 weight 0.10000E+01 volume 0.23657E-03 ppm1 3.789 ppm2 7.351 CV 1
ASSI { 255}
(( segid " " and resid 40 and name HA2 ))
( segid " " and resid 37 and name HD% )
4.100 2.100 1.900 peak 255 spectrum 1 weight 0.10000E+01 volume 0.34468E-03 ppm1 3.789 ppm2 6.814 CV 1
ASSI { 256}
(( segid " " and resid 40 and name HA2 ))
( segid " " and resid 37 and name HE% )
5.200 3.400 0.800 peak 256 spectrum 1 weight 0.10000E+01 volume 0.14160E-03 ppm1 3.752 ppm2 6.718 CV 1
ASSI { 258}
(( segid " " and resid 33 and name HA2 ))
( segid " " and resid 34 and name HE% )
4.200 2.200 1.800 peak 258 spectrum 1 weight 0.10000E+01 volume 0.50027E-03 ppm1 3.700 ppm2 7.111 CV 1
ASSI { 261}
(( segid " " and resid 59 and name HD1 ))
( segid " " and resid 58 and name HD% )
4.500 2.600 1.500 peak 261 spectrum 1 weight 0.10000E+01 volume 0.45363E-03 ppm1 3.682 ppm2 6.817 CV 1
ASSI { 265}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 37 and name HE% )
4.900 3.100 1.100 peak 265 spectrum 1 weight 0.10000E+01 volume 0.30482E-03 ppm1 3.596 ppm2 6.719 CV 1
ASSI { 267}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 93 and name HE3 ))
4.800 2.900 1.200 peak 267 spectrum 1 weight 0.10000E+01 volume 0.44515E-03 ppm1 3.589 ppm2 7.563 CV 1
ASSI { 268}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 93 and name HZ3 ))
5.400 3.700 0.600 peak 268 spectrum 1 weight 0.10000E+01 volume 0.33365E-03 ppm1 3.591 ppm2 7.168 CV 1
ASSI { 270}
(( segid " " and resid 19 and name HA2 ))
(( segid " " and resid 51 and name HZ ))
5.500 3.700 0.500 peak 270 spectrum 1 weight 0.10000E+01 volume 0.55538E-04 ppm1 3.568 ppm2 7.317 CV 1
ASSI { 273}
(( segid " " and resid 96 and name HD1 ))
( segid " " and resid 34 and name HE% )
3.500 1.500 1.500 peak 273 spectrum 1 weight 0.10000E+01 volume 0.10895E-02 ppm1 3.566 ppm2 7.114 CV 1
ASSI { 274}
(( segid " " and resid 19 and name HA2 ))
( segid " " and resid 51 and name HD% )
3.900 1.900 1.900 peak 274 spectrum 1 weight 0.10000E+01 volume 0.47059E-03 ppm1 3.551 ppm2 6.651 CV 1
ASSI { 275}
(( segid " " and resid 92 and name HD1 ))
( segid " " and resid 37 and name HE% )
3.800 3.800 2.200 peak 275 spectrum 1 weight 0.10000E+01 volume 0.34595E-03 ppm1 3.505 ppm2 6.719 CV 1
ASSI { 276}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 104 and name HN ))
4.300 2.300 1.700 peak 276 spectrum 1 weight 0.10000E+01 volume 0.36163E-03 ppm1 3.485 ppm2 7.563 CV 1
ASSI { 277}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 102 and name HE ))
3.400 3.400 2.600 peak 277 spectrum 1 weight 0.10000E+01 volume 0.94544E-03 ppm1 3.481 ppm2 7.169 CV 1
ASSI { 278}
(( segid " " and resid 9 and name HB1 ))
( segid " " and resid 103 and name HD% )
4.600 2.700 1.400 peak 278 spectrum 1 weight 0.10000E+01 volume 0.30101E-03 ppm1 3.479 ppm2 6.683 CV 1
ASSI { 280}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 38 and name HZ ))
4.200 2.300 1.800 peak 280 spectrum 1 weight 0.10000E+01 volume 0.53418E-03 ppm1 3.462 ppm2 7.274 CV 1
ASSI { 281}
(( segid " " and resid 9 and name HB1 ))
( segid " " and resid 103 and name HE% )
4.300 2.300 1.700 peak 281 spectrum 1 weight 0.10000E+01 volume 0.35697E-03 ppm1 3.459 ppm2 6.918 CV 1
ASSI { 282}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 9 and name HD2 ))
2.800 1.000 1.000 peak 282 spectrum 1 weight 0.10000E+01 volume 0.17298E-02 ppm1 3.456 ppm2 7.014 CV 1
ASSI { 285}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 36 and name HZ2 ))
4.700 2.800 1.300 peak 285 spectrum 1 weight 0.10000E+01 volume 0.17679E-03 ppm1 3.370 ppm2 6.947 CV 1
ASSI { 286}
(( segid " " and resid 11 and name HA2 ))
( segid " " and resid 106 and name HE% )
2.100 2.100 3.900 peak 286 spectrum 1 weight 0.10000E+01 volume 0.14160E-01 ppm1 3.365 ppm2 6.576 CV 1
ASSI { 291}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HD2 ))
3.400 1.400 1.400 peak 291 spectrum 1 weight 0.10000E+01 volume 0.14288E-02 ppm1 3.296 ppm2 7.013 CV 1
ASSI { 292}
(( segid " " and resid 9 and name HB2 ))
( segid " " and resid 103 and name HE% )
3.500 1.500 1.500 peak 292 spectrum 1 weight 0.10000E+01 volume 0.34510E-03 ppm1 3.298 ppm2 6.922 CV 1
ASSI { 293}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HE1 ))
4.900 3.000 1.100 peak 293 spectrum 1 weight 0.10000E+01 volume 0.28871E-03 ppm1 3.289 ppm2 7.725 CV 1
ASSI { 295}
(( segid " " and resid 104 and name HB ))
( segid " " and resid 106 and name HE% )
4.400 2.400 1.600 peak 295 spectrum 1 weight 0.10000E+01 volume 0.38114E-03 ppm1 3.277 ppm2 6.576 CV 1
ASSI { 296}
(( segid " " and resid 104 and name HB ))
(( segid " " and resid 105 and name HN ))
4.300 2.300 1.700 peak 296 spectrum 1 weight 0.10000E+01 volume 0.57658E-03 ppm1 3.273 ppm2 7.829 CV 1
ASSI { 300}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 38 and name HZ ))
3.500 1.500 1.500 peak 300 spectrum 1 weight 0.10000E+01 volume 0.84367E-03 ppm1 3.202 ppm2 7.316 CV 1
ASSI { 302}
(( segid " " and resid 74 and name HB1 ))
(( segid " " and resid 74 and name HD2 ))
4.100 2.100 1.900 peak 302 spectrum 1 weight 0.10000E+01 volume 0.42395E-03 ppm1 3.206 ppm2 6.732 CV 1
ASSI { 304}
(( segid " " and resid 102 and name HD1 ))
(( segid " " and resid 102 and name HE ))
3.600 1.600 1.600 peak 304 spectrum 1 weight 0.10000E+01 volume 0.55538E-03 ppm1 3.157 ppm2 7.138 CV 1
ASSI { 305}
(( segid " " and resid 38 and name HB2 ))
( segid " " and resid 38 and name HD% )
2.300 0.600 0.600 peak 305 spectrum 1 weight 0.10000E+01 volume 0.40954E-02 ppm1 3.148 ppm2 7.497 CV 1
ASSI { 306}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HZ ))
6.000 5.100 0.000 peak 306 spectrum 1 weight 0.10000E+01 volume 0.52994E-04 ppm1 3.151 ppm2 7.274 CV 1
ASSI { 307}
(( segid " " and resid 106 and name HB1 ))
( segid " " and resid 106 and name HD% )
2.400 0.700 0.700 peak 307 spectrum 1 weight 0.10000E+01 volume 0.59778E-02 ppm1 3.142 ppm2 6.698 CV 1
ASSI { 310}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HE3 ))
3.100 1.200 1.200 peak 310 spectrum 1 weight 0.10000E+01 volume 0.67408E-03 ppm1 3.120 ppm2 7.073 CV 1
ASSI { 311}
(( segid " " and resid 57 and name HB1 ))
( segid " " and resid 57 and name HD% )
2.600 0.800 0.800 peak 311 spectrum 1 weight 0.10000E+01 volume 0.25310E-02 ppm1 3.115 ppm2 7.206 CV 1
ASSI { 313}
(( segid " " and resid 57 and name HB1 ))
( segid " " and resid 57 and name HE% )
4.200 2.200 1.800 peak 313 spectrum 1 weight 0.10000E+01 volume 0.67833E-03 ppm1 3.105 ppm2 6.921 CV 1
ASSI { 317}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 72 and name HD2 ))
4.000 2.000 2.000 peak 317 spectrum 1 weight 0.10000E+01 volume 0.28065E-03 ppm1 3.005 ppm2 6.660 CV 1
ASSI { 318}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 74 and name HE1 ))
4.800 2.900 1.200 peak 318 spectrum 1 weight 0.10000E+01 volume 0.36121E-03 ppm1 2.999 ppm2 7.791 CV 1
ASSI { 324}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 74 and name HD2 ))
6.000 5.500 0.000 peak 324 spectrum 1 weight 0.10000E+01 volume 0.50027E-04 ppm1 5.704 ppm2 6.733 CV 1
ASSI { 325}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 72 and name HD2 ))
2.900 1.000 1.000 peak 325 spectrum 1 weight 0.10000E+01 volume 0.17551E-02 ppm1 5.703 ppm2 6.661 CV 1
ASSI { 327}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 107 and name HB2 ))
3.500 1.500 1.500 peak 327 spectrum 1 weight 0.10000E+01 volume 0.10005E-02 ppm1 0.662 ppm2 1.005 CV 1
ASSI { 328}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 36 and name HE3 ))
4.300 2.300 1.700 peak 328 spectrum 1 weight 0.10000E+01 volume 0.28574E-03 ppm1 5.578 ppm2 7.109 CV 1
ASSI { 329}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 36 and name HZ2 ))
4.200 2.200 1.800 peak 329 spectrum 1 weight 0.10000E+01 volume 0.30525E-03 ppm1 5.577 ppm2 6.947 CV 1
ASSI { 330}
(( segid " " and resid 55 and name HA ))
( segid " " and resid 73 and name HD% )
3.800 1.800 1.800 peak 330 spectrum 1 weight 0.10000E+01 volume 0.58506E-03 ppm1 5.578 ppm2 6.890 CV 1
ASSI { 332}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 91 and name HG1 ))
3.100 1.200 1.200 peak 332 spectrum 1 weight 0.10000E+01 volume 0.28490E-03 ppm1 0.015 ppm2 0.319 CV 1
ASSI { 333}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 83 and name HD2 ))
4.900 3.000 1.100 peak 333 spectrum 1 weight 0.10000E+01 volume 0.20944E-03 ppm1 5.512 ppm2 6.732 CV 1
ASSI { 334}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 26 and name HG ))
3.300 3.300 2.700 peak 334 spectrum 1 weight 0.10000E+01 volume 0.20605E-02 ppm1 0.126 ppm2 0.372 CV 1
ASSI { 336}
(( segid " " and resid 86 and name HA ))
( segid " " and resid 103 and name HD% )
4.600 2.700 1.400 peak 336 spectrum 1 weight 0.10000E+01 volume 0.18738E-03 ppm1 5.381 ppm2 6.656 CV 1
ASSI { 337}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 36 and name HE3 ))
4.200 2.200 1.800 peak 337 spectrum 1 weight 0.10000E+01 volume 0.29549E-03 ppm1 5.343 ppm2 7.072 CV 1
ASSI { 338}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 36 and name HZ3 ))
1.700 0.300 0.500 peak 338 spectrum 1 weight 0.10000E+01 volume 0.28659E-01 ppm1 5.346 ppm2 6.757 CV 1
ASSI { 339}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 106 and name HE% )
4.900 3.000 1.100 peak 339 spectrum 1 weight 0.10000E+01 volume 0.35316E-03 ppm1 5.333 ppm2 6.577 CV 1
ASSI { 343}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 9 and name HE1 ))
5.600 3.900 0.400 peak 343 spectrum 1 weight 0.10000E+01 volume 0.14414E-03 ppm1 5.167 ppm2 7.722 CV 1
ASSI { 344}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 36 and name HE3 ))
3.700 1.700 1.700 peak 344 spectrum 1 weight 0.10000E+01 volume 0.62321E-03 ppm1 5.163 ppm2 7.073 CV 1
ASSI { 351}
(( segid " " and resid 73 and name HA ))
( segid " " and resid 73 and name HD% )
3.100 1.200 1.200 peak 351 spectrum 1 weight 0.10000E+01 volume 0.14541E-02 ppm1 5.069 ppm2 6.890 CV 1
ASSI { 352}
(( segid " " and resid 106 and name HA ))
( segid " " and resid 106 and name HD% )
3.300 1.400 1.400 peak 352 spectrum 1 weight 0.10000E+01 volume 0.83943E-03 ppm1 5.069 ppm2 6.728 CV 1
ASSI { 354}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 57 and name HD% )
4.500 2.600 1.500 peak 354 spectrum 1 weight 0.10000E+01 volume 0.20392E-03 ppm1 5.001 ppm2 7.205 CV 1
ASSI { 359}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 72 and name HE1 ))
5.600 3.900 0.400 peak 359 spectrum 1 weight 0.10000E+01 volume 0.20647E-03 ppm1 4.895 ppm2 7.352 CV 1
ASSI { 365}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 36 and name HE3 ))
4.200 2.300 1.800 peak 365 spectrum 1 weight 0.10000E+01 volume 0.54267E-03 ppm1 4.882 ppm2 7.073 CV 1
ASSI { 368}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 38 and name HD% )
5.200 3.400 0.800 peak 368 spectrum 1 weight 0.10000E+01 volume 0.31712E-03 ppm1 4.781 ppm2 7.495 CV 1
ASSI { 370}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 37 and name HD% )
2.800 1.000 1.000 peak 370 spectrum 1 weight 0.10000E+01 volume 0.18612E-02 ppm1 4.782 ppm2 6.839 CV 1
ASSI { 373}
(( segid " " and resid 37 and name HA ))
( segid " " and resid 37 and name HE% )
4.700 2.700 1.300 peak 373 spectrum 1 weight 0.10000E+01 volume 0.26370E-03 ppm1 4.780 ppm2 6.731 CV 1
ASSI { 376}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 36 and name HZ3 ))
3.800 1.800 1.800 peak 376 spectrum 1 weight 0.10000E+01 volume 0.38283E-03 ppm1 4.683 ppm2 6.751 CV 1
ASSI { 377}
(( segid " " and resid 90 and name HA ))
( segid " " and resid 34 and name HE% )
3.800 1.800 1.800 peak 377 spectrum 1 weight 0.10000E+01 volume 0.95388E-03 ppm1 4.647 ppm2 7.110 CV 1
ASSI { 378}
(( segid " " and resid 90 and name HA ))
( segid " " and resid 34 and name HD% )
2.900 1.100 1.100 peak 378 spectrum 1 weight 0.10000E+01 volume 0.13058E-02 ppm1 4.647 ppm2 6.498 CV 1
ASSI { 379}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HD2 ))
3.700 1.700 1.700 peak 379 spectrum 1 weight 0.10000E+01 volume 0.12888E-02 ppm1 4.635 ppm2 6.893 CV 1
ASSI { 380}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 3 and name HE1 ))
4.000 2.000 2.000 peak 380 spectrum 1 weight 0.10000E+01 volume 0.10641E-02 ppm1 4.615 ppm2 8.057 CV 1
ASSI { 382}
(( segid " " and resid 58 and name HA ))
( segid " " and resid 58 and name HD% )
3.100 1.200 1.200 peak 382 spectrum 1 weight 0.10000E+01 volume 0.11192E-02 ppm1 4.581 ppm2 6.816 CV 1
ASSI { 383}
(( segid " " and resid 32 and name HB ))
( segid " " and resid 34 and name HD% )
3.600 1.600 1.600 peak 383 spectrum 1 weight 0.10000E+01 volume 0.10514E-02 ppm1 4.577 ppm2 6.498 CV 1
ASSI { 393}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HE1 ))
4.800 2.900 1.200 peak 393 spectrum 1 weight 0.10000E+01 volume 0.19629E-03 ppm1 4.445 ppm2 7.723 CV 1
ASSI { 394}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HD2 ))
2.800 0.900 0.900 peak 394 spectrum 1 weight 0.10000E+01 volume 0.26116E-02 ppm1 4.445 ppm2 7.014 CV 1
ASSI { 395}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 36 and name HE3 ))
4.300 2.300 1.700 peak 395 spectrum 1 weight 0.10000E+01 volume 0.30313E-03 ppm1 4.431 ppm2 7.072 CV 1
ASSI { 396}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 89 and name HE% )
4.500 2.500 1.500 peak 396 spectrum 1 weight 0.10000E+01 volume 0.40106E-03 ppm1 4.433 ppm2 6.468 CV 1
ASSI { 401}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HD2 ))
3.600 1.600 1.600 peak 401 spectrum 1 weight 0.10000E+01 volume 0.83095E-03 ppm1 4.386 ppm2 7.137 CV 1
ASSI { 402}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 9 and name HE1 ))
2.700 0.900 0.900 peak 402 spectrum 1 weight 0.10000E+01 volume 0.32475E-02 ppm1 4.367 ppm2 7.724 CV 1
ASSI { 403}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 9 and name HD2 ))
5.500 3.800 0.500 peak 403 spectrum 1 weight 0.10000E+01 volume 0.12125E-03 ppm1 4.371 ppm2 7.014 CV 1
ASSI { 404}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HB1 ))
2.300 0.700 0.700 peak 404 spectrum 1 weight 0.10000E+01 volume 0.22131E-02 ppm1 -0.137 ppm2 0.750 CV 1
ASSI { 407}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 83 and name HE1 ))
4.500 2.500 1.500 peak 407 spectrum 1 weight 0.10000E+01 volume 0.32559E-03 ppm1 2.895 ppm2 7.790 CV 1
ASSI { 409}
(( segid " " and resid 73 and name HB1 ))
( segid " " and resid 73 and name HD% )
2.700 0.900 0.900 peak 409 spectrum 1 weight 0.10000E+01 volume 0.23615E-02 ppm1 2.823 ppm2 6.892 CV 1
ASSI { 410}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HD2 ))
3.000 1.100 1.100 peak 410 spectrum 1 weight 0.10000E+01 volume 0.13482E-02 ppm1 2.791 ppm2 6.733 CV 1
ASSI { 412}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HE1 ))
3.900 1.900 1.900 peak 412 spectrum 1 weight 0.10000E+01 volume 0.76735E-03 ppm1 2.769 ppm2 7.790 CV 1
ASSI { 413}
(( segid " " and resid 58 and name HB1 ))
( segid " " and resid 58 and name HD% )
3.200 1.300 1.300 peak 413 spectrum 1 weight 0.10000E+01 volume 0.10726E-02 ppm1 2.744 ppm2 6.817 CV 1
ASSI { 416}
(( segid " " and resid 86 and name HB1 ))
( segid " " and resid 38 and name HD% )
4.300 2.300 1.700 peak 416 spectrum 1 weight 0.10000E+01 volume 0.50874E-03 ppm1 2.666 ppm2 7.498 CV 1
ASSI { 417}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HE1 ))
4.100 2.100 1.900 peak 417 spectrum 1 weight 0.10000E+01 volume 0.75464E-03 ppm1 2.670 ppm2 7.316 CV 1
ASSI { 418}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 38 and name HZ ))
4.500 2.500 1.500 peak 418 spectrum 1 weight 0.10000E+01 volume 0.47483E-03 ppm1 2.671 ppm2 7.274 CV 1
ASSI { 419}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 51 and name HE% )
4.100 2.100 1.900 peak 419 spectrum 1 weight 0.10000E+01 volume 0.45363E-03 ppm1 2.672 ppm2 7.115 CV 1
ASSI { 420}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 74 and name HD2 ))
3.400 1.400 1.400 peak 420 spectrum 1 weight 0.10000E+01 volume 0.44092E-03 ppm1 2.659 ppm2 6.733 CV 1
ASSI { 422}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HD1 ))
3.600 1.600 1.600 peak 422 spectrum 1 weight 0.10000E+01 volume 0.21876E-03 ppm1 2.644 ppm2 7.414 CV 1
ASSI { 425}
(( segid " " and resid 58 and name HB2 ))
( segid " " and resid 58 and name HD% )
3.500 1.500 1.500 peak 425 spectrum 1 weight 0.10000E+01 volume 0.57234E-03 ppm1 2.627 ppm2 6.818 CV 1
ASSI { 427}
(( segid " " and resid 103 and name HB1 ))
(( segid " " and resid 36 and name HE3 ))
2.700 0.900 0.900 peak 427 spectrum 1 weight 0.10000E+01 volume 0.27854E-02 ppm1 2.598 ppm2 7.111 CV 1
ASSI { 429}
(( segid " " and resid 73 and name HB2 ))
( segid " " and resid 73 and name HD% )
2.600 0.900 0.900 peak 429 spectrum 1 weight 0.10000E+01 volume 0.31584E-02 ppm1 2.591 ppm2 6.890 CV 1
ASSI { 430}
(( segid " " and resid 91 and name HD1 ))
( segid " " and resid 34 and name HD% )
4.500 2.600 1.500 peak 430 spectrum 1 weight 0.10000E+01 volume 0.47483E-03 ppm1 2.593 ppm2 6.498 CV 1
ASSI { 432}
(( segid " " and resid 56 and name HE1 ))
(( segid " " and resid 74 and name HE1 ))
6.000 6.000 0.000 peak 432 spectrum 1 weight 0.10000E+01 volume 0.10769E-05 ppm1 2.580 ppm2 7.789 CV 1
ASSI { 434}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 37 and name HE% )
4.100 2.100 1.900 peak 434 spectrum 1 weight 0.10000E+01 volume 0.86062E-03 ppm1 2.515 ppm2 6.719 CV 1
ASSI { 437}
(( segid " " and resid 106 and name HB2 ))
( segid " " and resid 106 and name HD% )
2.900 1.000 1.000 peak 437 spectrum 1 weight 0.10000E+01 volume 0.14584E-02 ppm1 2.401 ppm2 6.699 CV 1
ASSI { 438}
(( segid " " and resid 106 and name HB2 ))
( segid " " and resid 106 and name HE% )
4.400 2.500 1.600 peak 438 spectrum 1 weight 0.10000E+01 volume 0.63594E-03 ppm1 2.402 ppm2 6.578 CV 1
ASSI { 439}
(( segid " " and resid 44 and name HG1 ))
( segid " " and resid 38 and name HE% )
3.600 3.600 2.400 peak 439 spectrum 1 weight 0.10000E+01 volume 0.78008E-03 ppm1 2.364 ppm2 6.893 CV 1
ASSI { 440}
(( segid " " and resid 34 and name HB1 ))
( segid " " and resid 34 and name HE% )
4.600 2.700 1.400 peak 440 spectrum 1 weight 0.10000E+01 volume 0.33577E-03 ppm1 2.340 ppm2 7.110 CV 1
ASSI { 442}
(( segid " " and resid 34 and name HB1 ))
( segid " " and resid 34 and name HD% )
2.400 0.700 0.700 peak 442 spectrum 1 weight 0.10000E+01 volume 0.66561E-02 ppm1 2.332 ppm2 6.469 CV 1
ASSI { 446}
(( segid " " and resid 89 and name HB1 ))
( segid " " and resid 89 and name HE% )
6.000 6.000 0.000 peak 446 spectrum 1 weight 0.10000E+01 volume 0.99209E-05 ppm1 2.278 ppm2 6.471 CV 1
ASSI { 448}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 36 and name HE3 ))
4.300 2.300 1.700 peak 448 spectrum 1 weight 0.10000E+01 volume 0.50451E-03 ppm1 2.258 ppm2 7.075 CV 1
ASSI { 449}
(( segid " " and resid 103 and name HB2 ))
( segid " " and resid 103 and name HE% )
3.900 1.900 1.900 peak 449 spectrum 1 weight 0.10000E+01 volume 0.74616E-03 ppm1 2.261 ppm2 6.941 CV 1
ASSI { 450}
(( segid " " and resid 55 and name HB1 ))
( segid " " and resid 57 and name HE% )
3.500 1.500 1.500 peak 450 spectrum 1 weight 0.10000E+01 volume 0.79703E-03 ppm1 2.254 ppm2 6.891 CV 1
ASSI { 452}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 105 and name HN ))
3.700 1.800 2.300 peak 452 spectrum 1 weight 0.10000E+01 volume 0.10769E-02 ppm1 2.235 ppm2 7.791 CV 1
ASSI { 453}
(( segid " " and resid 50 and name HG2 ))
( segid " " and resid 51 and name HD% )
4.000 2.000 2.000 peak 453 spectrum 1 weight 0.10000E+01 volume 0.51722E-03 ppm1 2.192 ppm2 6.655 CV 1
ASSI { 454}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 36 and name HZ2 ))
4.800 2.900 1.200 peak 454 spectrum 1 weight 0.10000E+01 volume 0.42014E-03 ppm1 2.185 ppm2 6.946 CV 1
ASSI { 455}
(( segid " " and resid 43 and name HB1 ))
(( segid " " and resid 38 and name HZ ))
4.900 3.000 1.100 peak 455 spectrum 1 weight 0.10000E+01 volume 0.33153E-03 ppm1 2.176 ppm2 7.277 CV 1
ASSI { 460}
(( segid " " and resid 85 and name HB ))
( segid " " and resid 103 and name HD% )
3.900 1.900 1.900 peak 460 spectrum 1 weight 0.10000E+01 volume 0.55538E-03 ppm1 2.050 ppm2 6.725 CV 1
ASSI { 461}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 36 and name HD1 ))
3.800 1.800 1.800 peak 461 spectrum 1 weight 0.10000E+01 volume 0.11320E-02 ppm1 2.042 ppm2 7.415 CV 1
ASSI { 462}
(( segid " " and resid 85 and name HB ))
( segid " " and resid 103 and name HE% )
2.700 0.900 0.900 peak 462 spectrum 1 weight 0.10000E+01 volume 0.21155E-02 ppm1 2.047 ppm2 6.892 CV 1
ASSI { 463}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 3 and name HE1 ))
4.700 2.700 1.300 peak 463 spectrum 1 weight 0.10000E+01 volume 0.32475E-03 ppm1 2.039 ppm2 8.057 CV 1
ASSI { 464}
(( segid " " and resid 85 and name HB ))
(( segid " " and resid 105 and name HN ))
3.200 1.300 1.300 peak 464 spectrum 1 weight 0.10000E+01 volume 0.10514E-02 ppm1 2.037 ppm2 7.824 CV 1
ASSI { 467}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 51 and name HZ ))
4.500 2.500 1.500 peak 467 spectrum 1 weight 0.10000E+01 volume 0.32390E-03 ppm1 2.016 ppm2 7.318 CV 1
ASSI { 468}
( segid " " and resid 50 and name HE% )
( segid " " and resid 51 and name HE% )
4.400 2.400 1.600 peak 468 spectrum 1 weight 0.10000E+01 volume 0.26878E-03 ppm1 2.014 ppm2 7.116 CV 1
ASSI { 471}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 36 and name HZ2 ))
4.000 2.000 2.000 peak 471 spectrum 1 weight 0.10000E+01 volume 0.66137E-03 ppm1 2.004 ppm2 6.946 CV 1
ASSI { 473}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 74 and name HD2 ))
3.300 1.400 1.400 peak 473 spectrum 1 weight 0.10000E+01 volume 0.94114E-03 ppm1 1.925 ppm2 6.732 CV 1
ASSI { 475}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 36 and name HD1 ))
2.900 1.100 1.100 peak 475 spectrum 1 weight 0.10000E+01 volume 0.61474E-03 ppm1 1.889 ppm2 7.416 CV 1
ASSI { 477}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 105 and name HN ))
3.600 3.600 2.400 peak 477 spectrum 1 weight 0.10000E+01 volume 0.28702E-02 ppm1 1.878 ppm2 7.791 CV 1
ASSI { 478}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 9 and name HE1 ))
5.000 3.200 1.000 peak 478 spectrum 1 weight 0.10000E+01 volume 0.22724E-03 ppm1 1.884 ppm2 7.724 CV 1
ASSI { 479}
(( segid " " and resid 71 and name HB2 ))
( segid " " and resid 57 and name HD% )
5.400 3.700 0.600 peak 479 spectrum 1 weight 0.10000E+01 volume 0.20519E-03 ppm1 1.884 ppm2 7.212 CV 1
ASSI { 482}
(( segid " " and resid 5 and name HB ))
( segid " " and resid 103 and name HE% )
4.300 2.300 1.700 peak 482 spectrum 1 weight 0.10000E+01 volume 0.48755E-03 ppm1 1.874 ppm2 6.928 CV 1
ASSI { 485}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 72 and name HE1 ))
2.700 0.900 0.900 peak 485 spectrum 1 weight 0.10000E+01 volume 0.20561E-02 ppm1 1.833 ppm2 7.351 CV 1
ASSI { 487}
(( segid " " and resid 92 and name HG1 ))
( segid " " and resid 37 and name HD% )
4.100 2.100 1.900 peak 487 spectrum 1 weight 0.10000E+01 volume 0.49179E-03 ppm1 1.826 ppm2 6.839 CV 1
ASSI { 490}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 51 and name HE% )
4.200 2.200 1.800 peak 490 spectrum 1 weight 0.10000E+01 volume 0.27133E-03 ppm1 1.822 ppm2 7.091 CV 1
ASSI { 491}
(( segid " " and resid 92 and name HG1 ))
( segid " " and resid 37 and name HE% )
3.100 1.200 1.200 peak 491 spectrum 1 weight 0.10000E+01 volume 0.68681E-03 ppm1 1.804 ppm2 6.732 CV 1
ASSI { 492}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 105 and name HN ))
4.500 2.600 1.500 peak 492 spectrum 1 weight 0.10000E+01 volume 0.94966E-04 ppm1 1.777 ppm2 7.825 CV 1
ASSI { 493}
(( segid " " and resid 105 and name HB ))
( segid " " and resid 103 and name HE% )
3.100 1.200 1.200 peak 493 spectrum 1 weight 0.10000E+01 volume 0.11786E-02 ppm1 1.781 ppm2 6.925 CV 1
ASSI { 496}
(( segid " " and resid 102 and name HG1 ))
(( segid " " and resid 36 and name HE3 ))
4.700 2.800 1.300 peak 496 spectrum 1 weight 0.10000E+01 volume 0.22809E-03 ppm1 1.725 ppm2 7.111 CV 1
ASSI { 497}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 36 and name HZ2 ))
4.500 2.500 1.500 peak 497 spectrum 1 weight 0.10000E+01 volume 0.47059E-03 ppm1 1.720 ppm2 6.925 CV 1
ASSI { 498}
(( segid " " and resid 90 and name HB1 ))
( segid " " and resid 34 and name HD% )
4.300 2.300 1.700 peak 498 spectrum 1 weight 0.10000E+01 volume 0.45787E-03 ppm1 1.711 ppm2 6.497 CV 1
ASSI { 501}
(( segid " " and resid 92 and name HB1 ))
(( segid " " and resid 93 and name HE3 ))
4.900 3.000 1.100 peak 501 spectrum 1 weight 0.10000E+01 volume 0.50451E-03 ppm1 1.688 ppm2 7.560 CV 1
ASSI { 502}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 36 and name HZ2 ))
3.200 1.200 1.200 peak 502 spectrum 1 weight 0.10000E+01 volume 0.93270E-03 ppm1 1.686 ppm2 6.941 CV 1
ASSI { 503}
(( segid " " and resid 92 and name HB1 ))
( segid " " and resid 37 and name HD% )
2.200 2.200 3.800 peak 503 spectrum 1 weight 0.10000E+01 volume 0.12804E-01 ppm1 1.669 ppm2 6.838 CV 1
ASSI { 504}
(( segid " " and resid 92 and name HB1 ))
( segid " " and resid 37 and name HE% )
4.000 2.000 2.000 peak 504 spectrum 1 weight 0.10000E+01 volume 0.58081E-03 ppm1 1.671 ppm2 6.686 CV 1
ASSI { 508}
(( segid " " and resid 78 and name HD1 ))
( segid " " and resid 51 and name HD% )
4.800 2.900 1.200 peak 508 spectrum 1 weight 0.10000E+01 volume 0.11277E-03 ppm1 1.583 ppm2 6.659 CV 1
ASSI { 509}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 72 and name HE1 ))
4.500 2.600 1.500 peak 509 spectrum 1 weight 0.10000E+01 volume 0.42014E-03 ppm1 1.578 ppm2 7.350 CV 1
ASSI { 514}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 104 and name HN ))
4.600 2.700 1.400 peak 514 spectrum 1 weight 0.10000E+01 volume 0.30058E-03 ppm1 1.558 ppm2 7.559 CV 1
ASSI { 516}
(( segid " " and resid 78 and name HD1 ))
( segid " " and resid 51 and name HE% )
3.900 1.900 1.900 peak 516 spectrum 1 weight 0.10000E+01 volume 0.41929E-03 ppm1 1.559 ppm2 7.110 CV 1
ASSI { 518}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 9 and name HD2 ))
2.900 1.000 1.000 peak 518 spectrum 1 weight 0.10000E+01 volume 0.16195E-02 ppm1 1.535 ppm2 7.014 CV 1
ASSI { 520}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 36 and name HE3 ))
2.900 1.000 1.000 peak 520 spectrum 1 weight 0.10000E+01 volume 0.17551E-02 ppm1 1.491 ppm2 7.072 CV 1
ASSI { 522}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 72 and name HE1 ))
3.600 1.600 1.600 peak 522 spectrum 1 weight 0.10000E+01 volume 0.10091E-02 ppm1 1.478 ppm2 7.351 CV 1
ASSI { 525}
(( segid " " and resid 90 and name HB2 ))
( segid " " and resid 37 and name HD% )
3.700 1.700 1.700 peak 525 spectrum 1 weight 0.10000E+01 volume 0.54690E-03 ppm1 1.450 ppm2 6.815 CV 1
ASSI { 526}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 74 and name HD2 ))
3.100 1.200 1.200 peak 526 spectrum 1 weight 0.10000E+01 volume 0.24038E-02 ppm1 1.451 ppm2 6.744 CV 1
ASSI { 527}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 72 and name HD2 ))
5.700 4.100 0.300 peak 527 spectrum 1 weight 0.10000E+01 volume 0.40488E-04 ppm1 1.447 ppm2 6.662 CV 1
ASSI { 530}
(( segid " " and resid 90 and name HB2 ))
( segid " " and resid 34 and name HD% )
4.600 2.700 1.400 peak 530 spectrum 1 weight 0.10000E+01 volume 0.30949E-03 ppm1 1.416 ppm2 6.495 CV 1
ASSI { 531}
(( segid " " and resid 78 and name HG1 ))
( segid " " and resid 51 and name HE% )
5.400 3.600 0.600 peak 531 spectrum 1 weight 0.10000E+01 volume 0.92418E-04 ppm1 1.378 ppm2 7.116 CV 1
ASSI { 536}
(( segid " " and resid 92 and name HB2 ))
( segid " " and resid 37 and name HD% )
5.000 3.100 1.000 peak 536 spectrum 1 weight 0.10000E+01 volume 0.24208E-03 ppm1 1.352 ppm2 6.839 CV 1
ASSI { 537}
( segid " " and resid 84 and name HB% )
( segid " " and resid 106 and name HD% )
3.200 1.300 1.300 peak 537 spectrum 1 weight 0.10000E+01 volume 0.14924E-02 ppm1 1.349 ppm2 6.697 CV 1
ASSI { 538}
( segid " " and resid 84 and name HB% )
( segid " " and resid 106 and name HE% )
2.600 0.900 0.900 peak 538 spectrum 1 weight 0.10000E+01 volume 0.40063E-02 ppm1 1.348 ppm2 6.575 CV 1
ASSI { 539}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 72 and name HE1 ))
4.900 3.000 1.100 peak 539 spectrum 1 weight 0.10000E+01 volume 0.20308E-03 ppm1 1.333 ppm2 7.351 CV 1
ASSI { 544}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 38 and name HZ ))
3.700 1.700 1.700 peak 544 spectrum 1 weight 0.10000E+01 volume 0.74192E-03 ppm1 1.307 ppm2 7.273 CV 1
ASSI { 547}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 72 and name HD2 ))
3.200 1.300 1.300 peak 547 spectrum 1 weight 0.10000E+01 volume 0.18230E-02 ppm1 1.308 ppm2 6.655 CV 1
ASSI { 550}
( segid " " and resid 35 and name HB% )
( segid " " and resid 37 and name HD% )
3.300 1.300 1.300 peak 550 spectrum 1 weight 0.10000E+01 volume 0.11192E-02 ppm1 1.262 ppm2 6.838 CV 1
ASSI { 552}
( segid " " and resid 35 and name HB% )
( segid " " and resid 89 and name HE% )
4.900 3.000 1.100 peak 552 spectrum 1 weight 0.10000E+01 volume 0.36121E-03 ppm1 1.265 ppm2 6.471 CV 1
ASSI { 553}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 36 and name HD1 ))
4.800 2.800 1.200 peak 553 spectrum 1 weight 0.10000E+01 volume 0.29253E-03 ppm1 1.260 ppm2 7.415 CV 1
ASSI { 556}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 36 and name HZ3 ))
3.700 1.700 1.700 peak 556 spectrum 1 weight 0.10000E+01 volume 0.72496E-03 ppm1 1.238 ppm2 6.759 CV 1
ASSI { 558}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 103 and name HD% )
3.800 1.800 1.800 peak 558 spectrum 1 weight 0.10000E+01 volume 0.20011E-03 ppm1 1.233 ppm2 6.659 CV 1
ASSI { 559}
(( segid " " and resid 87 and name HB2 ))
( segid " " and resid 38 and name HD% )
4.400 2.500 1.600 peak 559 spectrum 1 weight 0.10000E+01 volume 0.66561E-03 ppm1 1.224 ppm2 7.499 CV 1
ASSI { 560}
(( segid " " and resid 4 and name HG1 ))
(( segid " " and resid 3 and name HE1 ))
4.800 2.800 1.200 peak 560 spectrum 1 weight 0.10000E+01 volume 0.15474E-03 ppm1 1.160 ppm2 8.057 CV 1
ASSI { 561}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 72 and name HE1 ))
4.700 2.800 1.300 peak 561 spectrum 1 weight 0.10000E+01 volume 0.39640E-03 ppm1 1.159 ppm2 7.351 CV 1
ASSI { 562}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 74 and name HD2 ))
4.100 2.100 1.900 peak 562 spectrum 1 weight 0.10000E+01 volume 0.10387E-02 ppm1 1.159 ppm2 6.733 CV 1
ASSI { 563}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 72 and name HD2 ))
3.000 1.100 1.100 peak 563 spectrum 1 weight 0.10000E+01 volume 0.89879E-03 ppm1 1.157 ppm2 6.661 CV 1
ASSI { 564}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 9 and name HE1 ))
3.100 1.200 1.200 peak 564 spectrum 1 weight 0.10000E+01 volume 0.23996E-02 ppm1 1.094 ppm2 7.724 CV 1
ASSI { 565}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 36 and name HZ3 ))
6.000 5.400 0.000 peak 565 spectrum 1 weight 0.10000E+01 volume 0.65289E-04 ppm1 1.094 ppm2 6.753 CV 1
ASSI { 567}
( segid " " and resid 8 and name HB% )
(( segid " " and resid 9 and name HD2 ))
4.100 2.100 1.900 peak 567 spectrum 1 weight 0.10000E+01 volume 0.43243E-03 ppm1 1.079 ppm2 7.014 CV 1
ASSI { 568}
(( segid " " and resid 56 and name HG1 ))
(( segid " " and resid 74 and name HE1 ))
4.800 2.900 1.200 peak 568 spectrum 1 weight 0.10000E+01 volume 0.20435E-03 ppm1 1.032 ppm2 7.792 CV 1
ASSI { 570}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 72 and name HE1 ))
4.300 2.300 1.700 peak 570 spectrum 1 weight 0.10000E+01 volume 0.32517E-03 ppm1 0.972 ppm2 7.351 CV 1
ASSI { 571}
( segid " " and resid 70 and name HG2%)
( segid " " and resid 58 and name HD% )
5.400 3.700 0.600 peak 571 spectrum 1 weight 0.10000E+01 volume 0.13101E-03 ppm1 0.974 ppm2 6.819 CV 1
ASSI { 572}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 72 and name HD2 ))
3.100 1.200 1.200 peak 572 spectrum 1 weight 0.10000E+01 volume 0.23106E-02 ppm1 0.972 ppm2 6.661 CV 1
ASSI { 576}
( segid " " and resid 13 and name HG2%)
( segid " " and resid 106 and name HE% )
4.100 2.100 1.900 peak 576 spectrum 1 weight 0.10000E+01 volume 0.68681E-03 ppm1 0.935 ppm2 6.576 CV 1
ASSI { 578}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 51 and name HZ ))
4.600 2.700 1.400 peak 578 spectrum 1 weight 0.10000E+01 volume 0.20858E-03 ppm1 0.921 ppm2 7.278 CV 1
ASSI { 580}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 9 and name HD2 ))
4.800 2.900 1.200 peak 580 spectrum 1 weight 0.10000E+01 volume 0.23572E-03 ppm1 0.834 ppm2 7.014 CV 1
ASSI { 583}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 3 and name HE1 ))
4.400 2.400 1.600 peak 583 spectrum 1 weight 0.10000E+01 volume 0.47059E-03 ppm1 0.831 ppm2 8.057 CV 1
ASSI { 584}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 9 and name HE1 ))
4.700 2.800 1.300 peak 584 spectrum 1 weight 0.10000E+01 volume 0.39089E-03 ppm1 0.834 ppm2 7.724 CV 1
ASSI { 586}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 104 and name HN ))
3.600 1.600 1.600 peak 586 spectrum 1 weight 0.10000E+01 volume 0.33153E-03 ppm1 0.825 ppm2 7.566 CV 1
ASSI { 587}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 93 and name HD1 ))
2.900 1.000 1.000 peak 587 spectrum 1 weight 0.10000E+01 volume 0.21537E-02 ppm1 0.825 ppm2 7.091 CV 1
ASSI { 588}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 83 and name HD2 ))
3.700 1.800 1.800 peak 588 spectrum 1 weight 0.10000E+01 volume 0.67408E-03 ppm1 0.825 ppm2 6.733 CV 1
ASSI { 590}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 105 and name HN ))
3.000 1.100 1.100 peak 590 spectrum 1 weight 0.10000E+01 volume 0.94966E-03 ppm1 0.787 ppm2 7.820 CV 1
ASSI { 591}
( segid " " and resid 105 and name HG1%)
( segid " " and resid 106 and name HD% )
3.700 1.700 1.700 peak 591 spectrum 1 weight 0.10000E+01 volume 0.39852E-03 ppm1 0.787 ppm2 6.698 CV 1
ASSI { 592}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 9 and name HD2 ))
4.000 2.000 2.000 peak 592 spectrum 1 weight 0.10000E+01 volume 0.97936E-03 ppm1 0.785 ppm2 7.014 CV 1
ASSI { 595}
(( segid " " and resid 34 and name HB2 ))
( segid " " and resid 34 and name HD% )
2.700 0.900 0.900 peak 595 spectrum 1 weight 0.10000E+01 volume 0.18824E-02 ppm1 0.745 ppm2 6.498 CV 1
ASSI { 597}
( segid " " and resid 105 and name HG2%)
( segid " " and resid 106 and name HD% )
4.900 3.000 1.100 peak 597 spectrum 1 weight 0.10000E+01 volume 0.22385E-03 ppm1 0.734 ppm2 6.733 CV 1
ASSI { 599}
( segid " " and resid 105 and name HG2%)
( segid " " and resid 103 and name HE% )
3.900 1.900 1.900 peak 599 spectrum 1 weight 0.10000E+01 volume 0.72072E-03 ppm1 0.728 ppm2 6.894 CV 1
ASSI { 601}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 9 and name HD2 ))
4.600 2.600 1.400 peak 601 spectrum 1 weight 0.10000E+01 volume 0.28659E-03 ppm1 0.674 ppm2 7.013 CV 1
ASSI { 603}
(( segid " " and resid 87 and name HG ))
( segid " " and resid 103 and name HD% )
3.300 1.400 1.400 peak 603 spectrum 1 weight 0.10000E+01 volume 0.50027E-03 ppm1 0.673 ppm2 6.696 CV 1
ASSI { 606}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 36 and name HE3 ))
4.800 2.800 1.200 peak 606 spectrum 1 weight 0.10000E+01 volume 0.39301E-03 ppm1 0.658 ppm2 7.073 CV 1
ASSI { 608}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 83 and name HE1 ))
4.300 2.300 1.700 peak 608 spectrum 1 weight 0.10000E+01 volume 0.47906E-03 ppm1 0.646 ppm2 7.792 CV 1
ASSI { 613}
( segid " " and resid 85 and name HG1%)
( segid " " and resid 103 and name HD% )
4.800 2.800 1.200 peak 613 spectrum 1 weight 0.10000E+01 volume 0.20011E-03 ppm1 0.594 ppm2 6.697 CV 1
ASSI { 621}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 9 and name HD2 ))
3.200 1.200 1.200 peak 621 spectrum 1 weight 0.10000E+01 volume 0.16661E-02 ppm1 0.573 ppm2 7.014 CV 1
ASSI { 622}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 9 and name HE1 ))
3.600 1.700 1.700 peak 622 spectrum 1 weight 0.10000E+01 volume 0.94114E-03 ppm1 0.542 ppm2 7.725 CV 1
ASSI { 625}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 36 and name HH2 ))
4.100 2.200 1.900 peak 625 spectrum 1 weight 0.10000E+01 volume 0.52994E-03 ppm1 0.510 ppm2 6.734 CV 1
OR { 625}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 36 and name HZ3 ))
ASSI { 638}
( segid " " and resid 85 and name HG2%)
( segid " " and resid 103 and name HD% )
4.600 2.700 1.400 peak 638 spectrum 1 weight 0.10000E+01 volume 0.31033E-03 ppm1 0.265 ppm2 6.656 CV 1
ASSI { 640}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 96 and name HG1 ))
4.800 2.800 1.200 peak 640 spectrum 1 weight 0.10000E+01 volume 0.31415E-03 ppm1 0.048 ppm2 1.996 CV 1
ASSI { 642}
( segid " " and resid 24 and name HG2%)
( segid " " and resid 103 and name HE% )
3.100 1.200 1.200 peak 642 spectrum 1 weight 0.10000E+01 volume 0.86062E-03 ppm1 0.126 ppm2 6.923 CV 1
ASSI { 644}
( segid " " and resid 24 and name HG2%)
( segid " " and resid 103 and name HD% )
3.800 1.800 1.800 peak 644 spectrum 1 weight 0.10000E+01 volume 0.69105E-03 ppm1 0.124 ppm2 6.694 CV 1
ASSI { 646}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 36 and name HZ2 ))
3.800 1.800 1.800 peak 646 spectrum 1 weight 0.10000E+01 volume 0.30143E-03 ppm1 0.044 ppm2 6.942 CV 1
ASSI { 651}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 38 and name HZ ))
4.400 2.400 1.600 peak 651 spectrum 1 weight 0.10000E+01 volume 0.35697E-03 ppm1 -0.462 ppm2 7.277 CV 1
ASSI { 654}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 103 and name HE% )
3.800 1.800 1.800 peak 654 spectrum 1 weight 0.10000E+01 volume 0.37775E-03 ppm1 -0.461 ppm2 6.925 CV 1
ASSI { 655}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 73 and name HD% )
2.800 1.000 1.000 peak 655 spectrum 1 weight 0.10000E+01 volume 0.17848E-02 ppm1 -0.462 ppm2 6.890 CV 1
ASSI { 657}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 103 and name HD% )
2.800 2.800 3.200 peak 657 spectrum 1 weight 0.10000E+01 volume 0.16237E-02 ppm1 -0.462 ppm2 6.694 CV 1
ASSI { 658}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 36 and name HH2 ))
3.900 1.900 1.900 peak 658 spectrum 1 weight 0.10000E+01 volume 0.44940E-03 ppm1 -0.650 ppm2 6.758 CV 1
OR { 658}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 36 and name HZ3 ))
ASSI { 662}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 103 and name HD% )
5.100 3.200 0.900 peak 662 spectrum 1 weight 0.10000E+01 volume 0.22342E-03 ppm1 -0.809 ppm2 6.695 CV 1
ASSI { 665}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 57 and name HD% )
2.200 2.200 3.800 peak 665 spectrum 1 weight 0.10000E+01 volume 0.62321E-03 ppm1 -0.814 ppm2 7.207 CV 1
ASSI { 666}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 36 and name HE3 ))
4.400 2.400 1.600 peak 666 spectrum 1 weight 0.10000E+01 volume 0.75888E-03 ppm1 -0.813 ppm2 7.073 CV 1
ASSI { 668}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 36 and name HZ3 ))
4.600 2.600 1.400 peak 668 spectrum 1 weight 0.10000E+01 volume 0.36588E-03 ppm1 -1.274 ppm2 6.755 CV 1
ASSI { 669}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 36 and name HD1 ))
4.700 2.800 1.300 peak 669 spectrum 1 weight 0.10000E+01 volume 0.31755E-03 ppm1 -1.276 ppm2 7.415 CV 1
ASSI { 670}
( segid " " and resid 26 and name HD2%)
( segid " " and resid 57 and name HD% )
4.300 2.300 1.700 peak 670 spectrum 1 weight 0.10000E+01 volume 0.29635E-03 ppm1 -1.276 ppm2 7.207 CV 1
ASSI { 671}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 36 and name HE3 ))
4.100 2.100 1.900 peak 671 spectrum 1 weight 0.10000E+01 volume 0.47483E-03 ppm1 -1.274 ppm2 7.073 CV 1
ASSI { 672}
( segid " " and resid 26 and name HD2%)
( segid " " and resid 103 and name HE% )
4.000 2.000 2.000 peak 672 spectrum 1 weight 0.10000E+01 volume 0.32263E-03 ppm1 -1.276 ppm2 6.944 CV 1
ASSI { 675}
(( segid " " and resid 93 and name HB1 ))
(( segid " " and resid 93 and name HA ))
2.800 1.000 1.000 peak 675 spectrum 1 weight 0.10000E+01 volume 0.23868E-02 ppm1 3.311 ppm2 4.548 CV 1
ASSI { 676}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HA ))
2.500 0.800 0.800 peak 676 spectrum 1 weight 0.10000E+01 volume 0.47059E-02 ppm1 3.297 ppm2 4.441 CV 1
ASSI { 677}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 5 and name HA ))
2.300 2.300 3.700 peak 677 spectrum 1 weight 0.10000E+01 volume 0.22851E-01 ppm1 3.297 ppm2 4.366 CV 1
ASSI { 679}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 105 and name HA ))
4.800 2.900 1.200 peak 679 spectrum 1 weight 0.10000E+01 volume 0.24377E-03 ppm1 3.277 ppm2 4.304 CV 1
ASSI { 680}
(( segid " " and resid 104 and name HB ))
(( segid " " and resid 86 and name HA ))
4.900 3.000 1.100 peak 680 spectrum 1 weight 0.10000E+01 volume 0.23826E-03 ppm1 3.272 ppm2 5.396 CV 1
ASSI { 682}
(( segid " " and resid 104 and name HB ))
(( segid " " and resid 103 and name HA ))
4.700 2.800 1.300 peak 682 spectrum 1 weight 0.10000E+01 volume 0.17764E-03 ppm1 3.252 ppm2 4.716 CV 1
ASSI { 683}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HA ))
2.800 1.000 1.000 peak 683 spectrum 1 weight 0.10000E+01 volume 0.24802E-02 ppm1 3.224 ppm2 4.548 CV 1
ASSI { 684}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HA ))
2.200 0.600 0.600 peak 684 spectrum 1 weight 0.10000E+01 volume 0.60626E-02 ppm1 3.211 ppm2 5.570 CV 1
ASSI { 686}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 78 and name HA ))
4.900 3.000 1.100 peak 686 spectrum 1 weight 0.10000E+01 volume 0.21961E-03 ppm1 3.195 ppm2 4.450 CV 1
ASSI { 688}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 84 and name HA ))
4.400 2.400 1.600 peak 688 spectrum 1 weight 0.10000E+01 volume 0.41972E-03 ppm1 3.178 ppm2 4.473 CV 1
ASSI { 689}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 37 and name HA ))
4.000 2.000 2.000 peak 689 spectrum 1 weight 0.10000E+01 volume 0.84791E-03 ppm1 3.167 ppm2 4.772 CV 1
ASSI { 691}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 13 and name HA ))
2.900 1.100 1.100 peak 691 spectrum 1 weight 0.10000E+01 volume 0.45787E-02 ppm1 3.148 ppm2 5.334 CV 1
ASSI { 692}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 106 and name HA ))
2.900 1.100 1.100 peak 692 spectrum 1 weight 0.10000E+01 volume 0.11786E-02 ppm1 3.151 ppm2 5.097 CV 1
ASSI { 693}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 43 and name HA ))
2.300 0.600 0.600 peak 693 spectrum 1 weight 0.10000E+01 volume 0.32856E-02 ppm1 3.148 ppm2 4.878 CV 1
ASSI { 697}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 58 and name HA ))
4.600 2.700 1.400 peak 697 spectrum 1 weight 0.10000E+01 volume 0.29974E-03 ppm1 3.110 ppm2 4.551 CV 1
ASSI { 698}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 71 and name HA ))
3.500 1.500 1.500 peak 698 spectrum 1 weight 0.10000E+01 volume 0.30143E-03 ppm1 3.096 ppm2 5.103 CV 1
ASSI { 700}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 103 and name HA ))
5.900 4.300 0.100 peak 700 spectrum 1 weight 0.10000E+01 volume 0.12931E-03 ppm1 3.090 ppm2 4.714 CV 1
ASSI { 701}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 73 and name HA ))
5.700 4.000 0.300 peak 701 spectrum 1 weight 0.10000E+01 volume 0.11659E-03 ppm1 3.004 ppm2 5.083 CV 1
ASSI { 703}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HA ))
2.900 1.100 1.100 peak 703 spectrum 1 weight 0.10000E+01 volume 0.21961E-02 ppm1 2.991 ppm2 5.326 CV 1
ASSI { 704}
(( segid " " and resid 3 and name HB1 ))
(( segid " " and resid 22 and name HA ))
2.700 0.900 0.900 peak 704 spectrum 1 weight 0.10000E+01 volume 0.26200E-02 ppm1 2.991 ppm2 4.413 CV 1
ASSI { 705}
(( segid " " and resid 3 and name HB1 ))
(( segid " " and resid 3 and name HA ))
3.000 1.100 1.100 peak 705 spectrum 1 weight 0.10000E+01 volume 0.22554E-02 ppm1 2.990 ppm2 4.634 CV 1
ASSI { 708}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 108 and name HA ))
4.500 2.500 1.500 peak 708 spectrum 1 weight 0.10000E+01 volume 0.23784E-03 ppm1 2.894 ppm2 4.815 CV 1
ASSI { 709}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 51 and name HA ))
2.600 0.800 0.800 peak 709 spectrum 1 weight 0.10000E+01 volume 0.27812E-02 ppm1 2.883 ppm2 5.079 CV 1
ASSI { 710}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 78 and name HA ))
3.600 1.600 2.400 peak 710 spectrum 1 weight 0.10000E+01 volume 0.53418E-03 ppm1 2.884 ppm2 4.452 CV 1
ASSI { 711}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 52 and name HB ))
3.800 1.800 1.800 peak 711 spectrum 1 weight 0.10000E+01 volume 0.52994E-03 ppm1 2.883 ppm2 4.344 CV 1
ASSI { 713}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HA ))
2.100 0.600 0.600 peak 713 spectrum 1 weight 0.10000E+01 volume 0.77160E-02 ppm1 2.826 ppm2 4.630 CV 1
ASSI { 714}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 22 and name HA ))
4.100 2.100 1.900 peak 714 spectrum 1 weight 0.10000E+01 volume 0.11828E-02 ppm1 2.825 ppm2 4.413 CV 1
ASSI { 715}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 81 and name HA1 ))
4.500 2.500 1.500 peak 715 spectrum 1 weight 0.10000E+01 volume 0.10472E-03 ppm1 2.811 ppm2 4.254 CV 1
ASSI { 717}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HA ))
2.900 1.100 1.100 peak 717 spectrum 1 weight 0.10000E+01 volume 0.13863E-02 ppm1 2.793 ppm2 4.907 CV 1
ASSI { 719}
(( segid " " and resid 50 and name HG1 ))
(( segid " " and resid 50 and name HA ))
4.000 2.000 2.000 peak 719 spectrum 1 weight 0.10000E+01 volume 0.80975E-03 ppm1 2.770 ppm2 4.458 CV 1
ASSI { 722}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 30 and name HA ))
6.000 6.000 0.000 peak 722 spectrum 1 weight 0.10000E+01 volume 0.98357E-05 ppm1 2.717 ppm2 4.705 CV 1
ASSI { 725}
(( segid " " and resid 86 and name HB1 ))
(( segid " " and resid 86 and name HA ))
2.300 0.600 0.600 peak 725 spectrum 1 weight 0.10000E+01 volume 0.48755E-02 ppm1 2.694 ppm2 5.392 CV 1
ASSI { 726}
(( segid " " and resid 86 and name HB1 ))
(( segid " " and resid 104 and name HA ))
4.600 2.600 1.400 peak 726 spectrum 1 weight 0.10000E+01 volume 0.29719E-03 ppm1 2.696 ppm2 5.316 CV 1
ASSI { 730}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 26 and name HA ))
4.200 2.200 1.800 peak 730 spectrum 1 weight 0.10000E+01 volume 0.21325E-03 ppm1 2.660 ppm2 4.716 CV 1
ASSI { 732}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 62 and name HA ))
3.100 1.200 1.200 peak 732 spectrum 1 weight 0.10000E+01 volume 0.38665E-02 ppm1 2.654 ppm2 4.258 CV 1
ASSI { 733}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HA ))
3.100 1.200 1.200 peak 733 spectrum 1 weight 0.10000E+01 volume 0.14881E-02 ppm1 2.640 ppm2 5.003 CV 1
ASSI { 734}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 47 and name HA ))
2.300 0.600 0.600 peak 734 spectrum 1 weight 0.10000E+01 volume 0.81823E-02 ppm1 2.625 ppm2 4.459 CV 1
ASSI { 736}
(( segid " " and resid 110 and name HB2 ))
(( segid " " and resid 110 and name HA ))
2.800 1.000 1.000 peak 736 spectrum 1 weight 0.10000E+01 volume 0.34129E-02 ppm1 2.613 ppm2 4.532 CV 1
ASSI { 737}
(( segid " " and resid 73 and name HB2 ))
(( segid " " and resid 55 and name HA ))
4.600 2.700 1.400 peak 737 spectrum 1 weight 0.10000E+01 volume 0.32729E-03 ppm1 2.594 ppm2 5.577 CV 1
ASSI { 738}
(( segid " " and resid 103 and name HB1 ))
(( segid " " and resid 103 and name HA ))
3.000 1.100 1.100 peak 738 spectrum 1 weight 0.10000E+01 volume 0.20944E-02 ppm1 2.589 ppm2 4.686 CV 1
ASSI { 741}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HA ))
3.100 1.200 1.200 peak 741 spectrum 1 weight 0.10000E+01 volume 0.11574E-02 ppm1 2.536 ppm2 4.782 CV 1
ASSI { 742}
(( segid " " and resid 71 and name HG1 ))
(( segid " " and resid 71 and name HA ))
4.100 2.100 1.900 peak 742 spectrum 1 weight 0.10000E+01 volume 0.28320E-03 ppm1 2.535 ppm2 5.100 CV 1
ASSI { 743}
(( segid " " and resid 71 and name HG1 ))
(( segid " " and resid 57 and name HA ))
4.700 2.800 1.300 peak 743 spectrum 1 weight 0.10000E+01 volume 0.37436E-03 ppm1 2.534 ppm2 5.000 CV 1
ASSI { 745}
(( segid " " and resid 90 and name HG1 ))
(( segid " " and resid 90 and name HA ))
4.000 2.000 2.000 peak 745 spectrum 1 weight 0.10000E+01 volume 0.43243E-03 ppm1 2.494 ppm2 4.646 CV 1
ASSI { 747}
(( segid " " and resid 27 and name HB1 ))
(( segid " " and resid 26 and name HA ))
5.100 3.200 0.900 peak 747 spectrum 1 weight 0.10000E+01 volume 0.17212E-03 ppm1 2.426 ppm2 4.713 CV 1
ASSI { 750}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 13 and name HA ))
2.500 0.800 0.800 peak 750 spectrum 1 weight 0.10000E+01 volume 0.21791E-02 ppm1 2.401 ppm2 5.330 CV 1
ASSI { 754}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 84 and name HA ))
4.500 2.500 1.500 peak 754 spectrum 1 weight 0.10000E+01 volume 0.32220E-03 ppm1 2.376 ppm2 4.500 CV 1
ASSI { 756}
(( segid " " and resid 101 and name HG1 ))
(( segid " " and resid 101 and name HA ))
2.700 0.900 0.900 peak 756 spectrum 1 weight 0.10000E+01 volume 0.50027E-02 ppm1 2.327 ppm2 4.320 CV 1
ASSI { 757}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 71 and name HA ))
2.700 0.900 0.900 peak 757 spectrum 1 weight 0.10000E+01 volume 0.15474E-02 ppm1 2.321 ppm2 5.101 CV 1
ASSI { 758}
(( segid " " and resid 54 and name HG1 ))
(( segid " " and resid 54 and name HA ))
4.700 2.700 1.300 peak 758 spectrum 1 weight 0.10000E+01 volume 0.26667E-03 ppm1 2.323 ppm2 4.853 CV 1
ASSI { 760}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 28 and name HA ))
5.700 4.100 0.300 peak 760 spectrum 1 weight 0.10000E+01 volume 0.11701E-03 ppm1 2.294 ppm2 4.815 CV 1
ASSI { 761}
(( segid " " and resid 89 and name HB1 ))
(( segid " " and resid 100 and name HA ))
4.700 2.700 1.300 peak 761 spectrum 1 weight 0.10000E+01 volume 0.23190E-03 ppm1 2.280 ppm2 4.485 CV 1
ASSI { 762}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 46 and name HA ))
2.300 0.700 0.700 peak 762 spectrum 1 weight 0.10000E+01 volume 0.60201E-02 ppm1 2.279 ppm2 4.324 CV 1
ASSI { 764}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 103 and name HA ))
2.600 0.800 0.800 peak 764 spectrum 1 weight 0.10000E+01 volume 0.16322E-02 ppm1 2.261 ppm2 4.687 CV 1
ASSI { 769}
(( segid " " and resid 60 and name HB1 ))
(( segid " " and resid 60 and name HA ))
2.400 0.700 0.700 peak 769 spectrum 1 weight 0.10000E+01 volume 0.52994E-02 ppm1 2.225 ppm2 4.432 CV 1
ASSI { 771}
(( segid " " and resid 53 and name HB ))
(( segid " " and resid 53 and name HA ))
2.600 0.800 0.800 peak 771 spectrum 1 weight 0.10000E+01 volume 0.27091E-02 ppm1 2.176 ppm2 5.382 CV 1
ASSI { 773}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 73 and name HA ))
3.800 1.800 1.800 peak 773 spectrum 1 weight 0.10000E+01 volume 0.10387E-02 ppm1 2.168 ppm2 5.073 CV 1
ASSI { 774}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 26 and name HA ))
5.900 4.400 0.100 peak 774 spectrum 1 weight 0.10000E+01 volume 0.11574E-03 ppm1 2.168 ppm2 4.735 CV 1
ASSI { 778}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 30 and name HA ))
2.400 0.700 0.700 peak 778 spectrum 1 weight 0.10000E+01 volume 0.37223E-02 ppm1 2.110 ppm2 4.766 CV 1
ASSI { 779}
(( segid " " and resid 44 and name HB1 ))
(( segid " " and resid 44 and name HA ))
2.600 0.800 0.800 peak 779 spectrum 1 weight 0.10000E+01 volume 0.42819E-02 ppm1 2.063 ppm2 4.300 CV 1
ASSI { 781}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 109 and name HA ))
4.600 2.600 1.400 peak 781 spectrum 1 weight 0.10000E+01 volume 0.40742E-03 ppm1 2.045 ppm2 5.512 CV 1
ASSI { 783}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 59 and name HA ))
3.100 1.200 1.200 peak 783 spectrum 1 weight 0.10000E+01 volume 0.20308E-02 ppm1 2.047 ppm2 4.507 CV 1
ASSI { 784}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 15 and name HA ))
5.400 3.600 0.600 peak 784 spectrum 1 weight 0.10000E+01 volume 0.22173E-03 ppm1 2.040 ppm2 4.978 CV 1
ASSI { 785}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 16 and name HA ))
2.300 0.600 0.600 peak 785 spectrum 1 weight 0.10000E+01 volume 0.63594E-02 ppm1 2.038 ppm2 4.612 CV 1
ASSI { 786}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 53 and name HA ))
3.900 1.900 1.900 peak 786 spectrum 1 weight 0.10000E+01 volume 0.38453E-03 ppm1 2.022 ppm2 5.388 CV 1
ASSI { 791}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 29 and name HA ))
3.900 1.900 1.900 peak 791 spectrum 1 weight 0.10000E+01 volume 0.40149E-03 ppm1 1.994 ppm2 5.578 CV 1
ASSI { 795}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 58 and name HA ))
4.100 2.100 1.900 peak 795 spectrum 1 weight 0.10000E+01 volume 0.81399E-03 ppm1 1.940 ppm2 4.579 CV 1
ASSI { 796}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 59 and name HA ))
3.600 1.600 1.600 peak 796 spectrum 1 weight 0.10000E+01 volume 0.29549E-03 ppm1 1.945 ppm2 4.511 CV 1
ASSI { 801}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 63 and name HA ))
2.600 0.900 0.900 peak 801 spectrum 1 weight 0.10000E+01 volume 0.40699E-02 ppm1 1.901 ppm2 4.234 CV 1
ASSI { 803}
(( segid " " and resid 43 and name HB2 ))
(( segid " " and resid 55 and name HA ))
3.200 3.200 2.800 peak 803 spectrum 1 weight 0.10000E+01 volume 0.67408E-03 ppm1 1.888 ppm2 5.577 CV 1
ASSI { 804}
(( segid " " and resid 50 and name HB1 ))
(( segid " " and resid 50 and name HA ))
1.800 0.400 0.400 peak 804 spectrum 1 weight 0.10000E+01 volume 0.28405E-01 ppm1 1.880 ppm2 4.452 CV 1
ASSI { 805}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 5 and name HA ))
2.900 1.100 1.100 peak 805 spectrum 1 weight 0.10000E+01 volume 0.18738E-02 ppm1 1.883 ppm2 4.367 CV 1
ASSI { 809}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 78 and name HA ))
1.300 0.200 0.900 peak 809 spectrum 1 weight 0.10000E+01 volume 0.20308E+00 ppm1 1.819 ppm2 4.458 CV 1
ASSI { 811}
(( segid " " and resid 108 and name HB1 ))
(( segid " " and resid 15 and name HA ))
2.500 0.800 0.800 peak 811 spectrum 1 weight 0.10000E+01 volume 0.22512E-02 ppm1 1.795 ppm2 4.977 CV 1
ASSI { 812}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 74 and name HA ))
4.300 2.300 1.700 peak 812 spectrum 1 weight 0.10000E+01 volume 0.57658E-03 ppm1 1.787 ppm2 5.335 CV 1
ASSI { 813}
(( segid " " and resid 108 and name HB1 ))
(( segid " " and resid 108 and name HA ))
2.700 0.900 0.900 peak 813 spectrum 1 weight 0.10000E+01 volume 0.28999E-02 ppm1 1.787 ppm2 4.767 CV 1
ASSI { 814}
(( segid " " and resid 105 and name HB ))
(( segid " " and resid 105 and name HA ))
2.700 0.900 0.900 peak 814 spectrum 1 weight 0.10000E+01 volume 0.19247E-02 ppm1 1.781 ppm2 4.305 CV 1
ASSI { 815}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 28 and name HB1 ))
6.000 6.000 0.000 peak 815 spectrum 1 weight 0.10000E+01 volume 0.44940E-04 ppm1 1.782 ppm2 4.152 CV 1
ASSI { 816}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HA ))
2.700 0.900 0.900 peak 816 spectrum 1 weight 0.10000E+01 volume 0.23868E-02 ppm1 1.767 ppm2 4.235 CV 1
ASSI { 817}
(( segid " " and resid 90 and name HB1 ))
(( segid " " and resid 90 and name HA ))
2.500 0.800 0.800 peak 817 spectrum 1 weight 0.10000E+01 volume 0.23868E-02 ppm1 1.727 ppm2 4.647 CV 1
ASSI { 818}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 26 and name HA ))
6.000 4.800 0.000 peak 818 spectrum 1 weight 0.10000E+01 volume 0.45363E-04 ppm1 1.717 ppm2 4.735 CV 1
ASSI { 820}
(( segid " " and resid 102 and name HG1 ))
(( segid " " and resid 88 and name HA ))
3.000 1.100 1.100 peak 820 spectrum 1 weight 0.10000E+01 volume 0.76312E-03 ppm1 1.705 ppm2 5.165 CV 1
ASSI { 824}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 28 and name HA ))
4.200 2.200 1.800 peak 824 spectrum 1 weight 0.10000E+01 volume 0.42819E-03 ppm1 1.663 ppm2 4.787 CV 1
ASSI { 825}
(( segid " " and resid 63 and name HD1 ))
(( segid " " and resid 65 and name HA ))
3.600 3.600 2.400 peak 825 spectrum 1 weight 0.10000E+01 volume 0.14414E-02 ppm1 1.655 ppm2 4.164 CV 1
ASSI { 826}
(( segid " " and resid 63 and name HD1 ))
(( segid " " and resid 63 and name HA ))
4.100 2.100 1.900 peak 826 spectrum 1 weight 0.10000E+01 volume 0.48331E-03 ppm1 1.646 ppm2 4.234 CV 1
ASSI { 827}
(( segid " " and resid 4 and name HB1 ))
(( segid " " and resid 3 and name HA ))
5.900 4.400 0.100 peak 827 spectrum 1 weight 0.10000E+01 volume 0.29677E-04 ppm1 1.617 ppm2 4.639 CV 1
ASSI { 828}
(( segid " " and resid 21 and name HB1 ))
(( segid " " and resid 1 and name HA ))
3.700 1.700 1.700 peak 828 spectrum 1 weight 0.10000E+01 volume 0.36375E-03 ppm1 1.616 ppm2 4.492 CV 1
ASSI { 831}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 65 and name HA ))
2.800 1.000 1.000 peak 831 spectrum 1 weight 0.10000E+01 volume 0.29338E-02 ppm1 1.575 ppm2 4.162 CV 1
ASSI { 833}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 9 and name HA ))
2.200 0.600 0.600 peak 833 spectrum 1 weight 0.10000E+01 volume 0.85215E-02 ppm1 1.568 ppm2 4.460 CV 1
ASSI { 838}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 23 and name HA ))
3.800 1.800 1.800 peak 838 spectrum 1 weight 0.10000E+01 volume 0.42395E-03 ppm1 1.541 ppm2 4.954 CV 1
ASSI { 844}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 86 and name HA ))
5.100 3.200 0.900 peak 844 spectrum 1 weight 0.10000E+01 volume 0.43243E-03 ppm1 1.490 ppm2 5.390 CV 1
ASSI { 845}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 88 and name HA ))
4.400 2.400 1.600 peak 845 spectrum 1 weight 0.10000E+01 volume 0.28532E-03 ppm1 1.486 ppm2 5.165 CV 1
ASSI { 846}
(( segid " " and resid 108 and name HD1 ))
(( segid " " and resid 15 and name HA ))
3.700 1.700 1.700 peak 846 spectrum 1 weight 0.10000E+01 volume 0.66561E-03 ppm1 1.486 ppm2 4.976 CV 1
ASSI { 847}
(( segid " " and resid 108 and name HD1 ))
(( segid " " and resid 108 and name HA ))
4.600 2.600 1.400 peak 847 spectrum 1 weight 0.10000E+01 volume 0.22300E-03 ppm1 1.479 ppm2 4.781 CV 1
ASSI { 849}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 1 and name HA ))
3.900 1.900 1.900 peak 849 spectrum 1 weight 0.10000E+01 volume 0.96662E-03 ppm1 1.475 ppm2 4.458 CV 1
ASSI { 850}
( segid " " and resid 67 and name HB% )
(( segid " " and resid 67 and name HA ))
2.500 0.800 0.800 peak 850 spectrum 1 weight 0.10000E+01 volume 0.47483E-02 ppm1 1.454 ppm2 4.316 CV 1
ASSI { 852}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 90 and name HA ))
2.900 1.100 1.100 peak 852 spectrum 1 weight 0.10000E+01 volume 0.25649E-02 ppm1 1.422 ppm2 4.647 CV 1
ASSI { 853}
(( segid " " and resid 30 and name HG1 ))
(( segid " " and resid 69 and name HA1 ))
4.300 2.300 1.700 peak 853 spectrum 1 weight 0.10000E+01 volume 0.20605E-03 ppm1 1.421 ppm2 4.428 CV 1
ASSI { 855}
(( segid " " and resid 30 and name HG1 ))
(( segid " " and resid 28 and name HB1 ))
3.600 1.600 1.600 peak 855 spectrum 1 weight 0.10000E+01 volume 0.51722E-03 ppm1 1.415 ppm2 4.152 CV 1
ASSI { 856}
(( segid " " and resid 30 and name HG1 ))
(( segid " " and resid 28 and name HA ))
4.400 2.400 1.600 peak 856 spectrum 1 weight 0.10000E+01 volume 0.29804E-03 ppm1 1.404 ppm2 4.767 CV 1
ASSI { 858}
(( segid " " and resid 30 and name HG1 ))
(( segid " " and resid 30 and name HA ))
4.000 2.000 2.000 peak 858 spectrum 1 weight 0.10000E+01 volume 0.35316E-03 ppm1 1.403 ppm2 4.692 CV 1
ASSI { 859}
(( segid " " and resid 30 and name HG1 ))
(( segid " " and resid 69 and name HA2 ))
3.100 1.200 1.200 peak 859 spectrum 1 weight 0.10000E+01 volume 0.28617E-02 ppm1 1.399 ppm2 4.237 CV 1
ASSI { 865}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 52 and name HA ))
5.500 3.700 0.500 peak 865 spectrum 1 weight 0.10000E+01 volume 0.11362E-03 ppm1 1.372 ppm2 4.814 CV 1
ASSI { 866}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 44 and name HA ))
3.700 1.700 1.700 peak 866 spectrum 1 weight 0.10000E+01 volume 0.66985E-03 ppm1 1.358 ppm2 4.334 CV 1
ASSI { 869}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 75 and name HA ))
4.800 2.900 1.200 peak 869 spectrum 1 weight 0.10000E+01 volume 0.23232E-03 ppm1 1.340 ppm2 5.166 CV 1
ASSI { 870}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 109 and name HA ))
2.300 0.600 0.600 peak 870 spectrum 1 weight 0.10000E+01 volume 0.58930E-02 ppm1 1.325 ppm2 5.513 CV 1
ASSI { 875}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 35 and name HA ))
3.500 1.500 1.500 peak 875 spectrum 1 weight 0.10000E+01 volume 0.38114E-02 ppm1 1.319 ppm2 4.150 CV 1
ASSI { 879}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 32 and name HB ))
2.400 0.700 0.700 peak 879 spectrum 1 weight 0.10000E+01 volume 0.52570E-02 ppm1 1.299 ppm2 4.577 CV 1
ASSI { 880}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 32 and name HA ))
2.800 1.000 1.000 peak 880 spectrum 1 weight 0.10000E+01 volume 0.39894E-02 ppm1 1.299 ppm2 4.422 CV 1
ASSI { 883}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 15 and name HA ))
4.100 2.100 1.900 peak 883 spectrum 1 weight 0.10000E+01 volume 0.53842E-03 ppm1 1.270 ppm2 4.978 CV 1
ASSI { 884}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 29 and name HA ))
5.100 3.300 0.900 peak 884 spectrum 1 weight 0.10000E+01 volume 0.27091E-03 ppm1 1.262 ppm2 5.577 CV 1
ASSI { 885}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 89 and name HA ))
4.600 2.600 1.400 peak 885 spectrum 1 weight 0.10000E+01 volume 0.23106E-03 ppm1 1.263 ppm2 4.456 CV 1
ASSI { 886}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HA ))
2.300 0.600 0.600 peak 886 spectrum 1 weight 0.10000E+01 volume 0.39513E-02 ppm1 1.259 ppm2 4.774 CV 1
OR { 886}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 108 and name HA ))
ASSI { 888}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 59 and name HA ))
4.500 2.500 1.500 peak 888 spectrum 1 weight 0.10000E+01 volume 0.23275E-03 ppm1 1.245 ppm2 4.465 CV 1
ASSI { 895}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HA ))
2.700 0.900 0.900 peak 895 spectrum 1 weight 0.10000E+01 volume 0.26964E-02 ppm1 1.214 ppm2 4.649 CV 1
ASSI { 898}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HA ))
2.800 0.900 0.900 peak 898 spectrum 1 weight 0.10000E+01 volume 0.28320E-02 ppm1 1.161 ppm2 4.978 CV 1
ASSI { 900}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 16 and name HA ))
6.000 6.000 0.000 peak 900 spectrum 1 weight 0.10000E+01 volume 0.13651E-05 ppm1 1.160 ppm2 4.615 CV 1
ASSI { 902}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 6 and name HB ))
2.300 0.700 0.700 peak 902 spectrum 1 weight 0.10000E+01 volume 0.67408E-02 ppm1 1.100 ppm2 4.709 CV 1
ASSI { 903}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 5 and name HA ))
3.700 1.700 1.700 peak 903 spectrum 1 weight 0.10000E+01 volume 0.75464E-03 ppm1 1.100 ppm2 4.366 CV 1
ASSI { 904}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 6 and name HA ))
2.200 0.600 0.600 peak 904 spectrum 1 weight 0.10000E+01 volume 0.65289E-02 ppm1 1.098 ppm2 5.165 CV 1
ASSI { 905}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 90 and name HA ))
4.500 2.500 1.500 peak 905 spectrum 1 weight 0.10000E+01 volume 0.60201E-03 ppm1 1.093 ppm2 4.646 CV 1
ASSI { 906}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 100 and name HA ))
4.300 2.400 1.700 peak 906 spectrum 1 weight 0.10000E+01 volume 0.57234E-03 ppm1 1.092 ppm2 4.491 CV 1
ASSI { 909}
( segid " " and resid 8 and name HB% )
(( segid " " and resid 9 and name HA ))
3.600 1.600 1.600 peak 909 spectrum 1 weight 0.10000E+01 volume 0.99209E-03 ppm1 1.082 ppm2 4.435 CV 1
ASSI { 912}
(( segid " " and resid 56 and name HG1 ))
(( segid " " and resid 56 and name HA ))
4.000 2.000 2.000 peak 912 spectrum 1 weight 0.10000E+01 volume 0.48331E-03 ppm1 0.981 ppm2 4.316 CV 1
ASSI { 913}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 70 and name HA ))
2.400 0.700 0.700 peak 913 spectrum 1 weight 0.10000E+01 volume 0.49603E-02 ppm1 0.972 ppm2 5.079 CV 1
ASSI { 915}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 14 and name HA ))
3.800 1.800 1.800 peak 915 spectrum 1 weight 0.10000E+01 volume 0.50874E-03 ppm1 0.957 ppm2 4.649 CV 1
ASSI { 916}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 13 and name HA ))
2.500 0.800 0.800 peak 916 spectrum 1 weight 0.10000E+01 volume 0.41675E-02 ppm1 0.955 ppm2 5.330 CV 1
ASSI { 918}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 109 and name HA ))
5.400 3.700 0.600 peak 918 spectrum 1 weight 0.10000E+01 volume 0.15008E-03 ppm1 0.949 ppm2 5.516 CV 1
ASSI { 919}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 78 and name HA ))
5.100 3.200 0.900 peak 919 spectrum 1 weight 0.10000E+01 volume 0.85639E-04 ppm1 0.943 ppm2 4.455 CV 1
ASSI { 921}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 108 and name HA ))
3.000 1.100 1.100 peak 921 spectrum 1 weight 0.10000E+01 volume 0.16153E-02 ppm1 0.935 ppm2 4.782 CV 1
ASSI { 922}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 53 and name HA ))
3.400 1.400 1.400 peak 922 spectrum 1 weight 0.10000E+01 volume 0.13354E-02 ppm1 0.923 ppm2 5.384 CV 1
ASSI { 923}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 75 and name HA ))
2.900 1.000 1.000 peak 923 spectrum 1 weight 0.10000E+01 volume 0.18908E-02 ppm1 0.924 ppm2 5.130 CV 1
ASSI { 924}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HA ))
4.100 2.100 1.900 peak 924 spectrum 1 weight 0.10000E+01 volume 0.30313E-03 ppm1 0.916 ppm2 4.164 CV 1
OR { 924}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HA ))
ASSI { 926}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 76 and name HA ))
2.700 0.900 0.900 peak 926 spectrum 1 weight 0.10000E+01 volume 0.26964E-02 ppm1 0.901 ppm2 4.867 CV 1
ASSI { 929}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 6 and name HA ))
3.800 1.800 1.800 peak 929 spectrum 1 weight 0.10000E+01 volume 0.39979E-03 ppm1 0.835 ppm2 5.166 CV 1
ASSI { 931}
( segid " " and resid 64 and name HD2%)
(( segid " " and resid 64 and name HA ))
2.600 0.800 0.800 peak 931 spectrum 1 weight 0.10000E+01 volume 0.47059E-02 ppm1 0.835 ppm2 4.364 CV 1
ASSI { 934}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 109 and name HA ))
4.400 2.500 1.600 peak 934 spectrum 1 weight 0.10000E+01 volume 0.32602E-03 ppm1 0.826 ppm2 5.516 CV 1
ASSI { 936}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 106 and name HA ))
3.700 1.700 1.700 peak 936 spectrum 1 weight 0.10000E+01 volume 0.44940E-03 ppm1 0.827 ppm2 5.079 CV 1
ASSI { 937}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 23 and name HA ))
3.800 1.800 1.800 peak 937 spectrum 1 weight 0.10000E+01 volume 0.44515E-03 ppm1 0.825 ppm2 4.963 CV 1
ASSI { 941}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 13 and name HA ))
5.000 3.200 1.000 peak 941 spectrum 1 weight 0.10000E+01 volume 0.26497E-04 ppm1 0.787 ppm2 5.327 CV 1
ASSI { 946}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 30 and name HA ))
3.000 3.000 3.000 peak 946 spectrum 1 weight 0.10000E+01 volume 0.34891E-02 ppm1 0.750 ppm2 4.690 CV 1
ASSI { 949}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 13 and name HA ))
4.000 2.000 2.000 peak 949 spectrum 1 weight 0.10000E+01 volume 0.33916E-03 ppm1 0.730 ppm2 5.328 CV 1
ASSI { 951}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 90 and name HA ))
5.000 3.100 1.000 peak 951 spectrum 1 weight 0.10000E+01 volume 0.27133E-03 ppm1 0.730 ppm2 4.641 CV 1
ASSI { 952}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 106 and name HA ))
6.000 4.500 0.000 peak 952 spectrum 1 weight 0.10000E+01 volume 0.41124E-04 ppm1 0.672 ppm2 5.085 CV 1
ASSI { 957}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 12 and name HA ))
6.000 4.500 0.000 peak 957 spectrum 1 weight 0.10000E+01 volume 0.87762E-04 ppm1 0.667 ppm2 4.364 CV 1
ASSI { 958}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 86 and name HA ))
5.900 4.400 0.100 peak 958 spectrum 1 weight 0.10000E+01 volume 0.34765E-04 ppm1 0.659 ppm2 5.389 CV 1
ASSI { 960}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HA ))
3.000 1.100 1.100 peak 960 spectrum 1 weight 0.10000E+01 volume 0.15856E-02 ppm1 0.652 ppm2 4.888 CV 1
ASSI { 961}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 3 and name HA ))
6.000 6.000 0.000 peak 961 spectrum 1 weight 0.10000E+01 volume 0.37053E-04 ppm1 0.654 ppm2 4.640 CV 1
ASSI { 964}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 24 and name HA ))
2.700 0.900 0.900 peak 964 spectrum 1 weight 0.10000E+01 volume 0.16153E-02 ppm1 0.599 ppm2 4.447 CV 1
ASSI { 966}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 53 and name HA ))
4.100 2.100 1.900 peak 966 spectrum 1 weight 0.10000E+01 volume 0.52570E-03 ppm1 0.590 ppm2 5.388 CV 1
ASSI { 970}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 105 and name HA ))
4.300 2.300 1.700 peak 970 spectrum 1 weight 0.10000E+01 volume 0.48331E-03 ppm1 0.584 ppm2 4.304 CV 1
ASSI { 974}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 6 and name HA ))
4.800 2.900 1.200 peak 974 spectrum 1 weight 0.10000E+01 volume 0.23063E-03 ppm1 0.540 ppm2 5.166 CV 1
ASSI { 977}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 5 and name HA ))
2.400 0.700 0.700 peak 977 spectrum 1 weight 0.10000E+01 volume 0.37817E-02 ppm1 0.540 ppm2 4.367 CV 1
ASSI { 979}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 109 and name HA ))
3.700 1.700 1.700 peak 979 spectrum 1 weight 0.10000E+01 volume 0.24929E-02 ppm1 0.512 ppm2 5.513 CV 1
ASSI { 983}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 106 and name HA ))
3.300 1.400 1.400 peak 983 spectrum 1 weight 0.10000E+01 volume 0.10217E-02 ppm1 0.462 ppm2 5.082 CV 1
ASSI { 985}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 104 and name HA ))
2.600 0.800 0.800 peak 985 spectrum 1 weight 0.10000E+01 volume 0.35146E-02 ppm1 0.430 ppm2 5.321 CV 1
ASSI { 986}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 84 and name HA ))
4.400 2.500 1.600 peak 986 spectrum 1 weight 0.10000E+01 volume 0.24674E-03 ppm1 0.429 ppm2 4.501 CV 1
ASSI { 990}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 26 and name HA ))
3.000 1.100 1.100 peak 990 spectrum 1 weight 0.10000E+01 volume 0.28787E-02 ppm1 0.368 ppm2 4.721 CV 1
ASSI { 991}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 25 and name HA ))
5.200 3.400 0.800 peak 991 spectrum 1 weight 0.10000E+01 volume 0.21876E-03 ppm1 0.364 ppm2 4.882 CV 1
ASSI { 994}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 109 and name HA ))
3.400 1.500 1.500 peak 994 spectrum 1 weight 0.10000E+01 volume 0.41378E-03 ppm1 0.262 ppm2 5.512 CV 1
ASSI { 997}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 16 and name HA ))
2.900 1.000 1.000 peak 997 spectrum 1 weight 0.10000E+01 volume 0.44940E-02 ppm1 0.261 ppm2 4.612 CV 1
ASSI { 999}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 26 and name HA ))
4.400 2.400 1.600 peak 999 spectrum 1 weight 0.10000E+01 volume 0.27642E-03 ppm1 0.129 ppm2 4.715 CV 1
ASSI { 1000}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 6 and name HA ))
4.100 2.100 1.900 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.37732E-03 ppm1 0.123 ppm2 5.166 CV 1
ASSI { 1007}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 33 and name HA1 ))
2.800 0.900 0.900 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.86909E-03 ppm1 -0.141 ppm2 4.319 CV 1
ASSI { 1012}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 37 and name HA ))
4.200 2.200 1.800 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.52570E-03 ppm1 -0.812 ppm2 4.783 CV 1
ASSI { 1017}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 72 and name HA ))
2.100 0.500 0.500 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.46211E-02 ppm1 3.006 ppm2 5.704 CV 1
ASSI { 1018}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HA ))
2.700 0.900 0.900 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.31119E-02 ppm1 2.659 ppm2 5.703 CV 1
ASSI { 1020}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 72 and name HA ))
4.300 2.300 1.700 peak 1020 spectrum 1 weight 0.10000E+01 volume 0.56810E-03 ppm1 1.321 ppm2 5.698 CV 1
ASSI { 1022}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 72 and name HA ))
4.500 2.500 1.500 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.51299E-03 ppm1 0.973 ppm2 5.706 CV 1
ASSI { 1023}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 28 and name HB1 ))
4.000 2.000 2.000 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.54690E-03 ppm1 2.728 ppm2 4.125 CV 1
ASSI { 1027}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 45 and name HA ))
3.200 1.200 1.200 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.29592E-02 ppm1 2.666 ppm2 3.566 CV 1
ASSI { 1030}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 59 and name HD2 ))
6.000 4.500 0.000 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.14033E-03 ppm1 2.661 ppm2 3.498 CV 1
ASSI { 1033}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 59 and name HD1 ))
3.600 1.600 1.600 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.25903E-02 ppm1 2.628 ppm2 3.686 CV 1
ASSI { 1034}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 59 and name HD2 ))
4.000 2.000 2.000 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.11108E-02 ppm1 2.584 ppm2 3.505 CV 1
ASSI { 1036}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HB1 ))
1.800 0.400 0.400 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.65289E-02 ppm1 2.538 ppm2 3.446 CV 1
ASSI { 1037}
(( segid " " and resid 71 and name HG1 ))
(( segid " " and resid 28 and name HB1 ))
3.700 1.700 1.700 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.85639E-03 ppm1 2.535 ppm2 4.118 CV 1
ASSI { 1039}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 41 and name HA2 ))
5.300 3.500 0.700 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.22893E-03 ppm1 2.533 ppm2 3.149 CV 1
ASSI { 1040}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 40 and name HA2 ))
2.900 1.100 1.100 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.94114E-03 ppm1 2.511 ppm2 3.753 CV 1
ASSI { 1042}
(( segid " " and resid 90 and name HG1 ))
(( segid " " and resid 88 and name HB ))
3.300 1.400 1.400 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.64441E-03 ppm1 2.495 ppm2 3.835 CV 1
ASSI { 1045}
(( segid " " and resid 27 and name HB1 ))
(( segid " " and resid 27 and name HD1 ))
3.100 1.200 1.200 peak 1045 spectrum 1 weight 0.10000E+01 volume 0.78432E-03 ppm1 2.395 ppm2 4.037 CV 1
ASSI { 1046}
(( segid " " and resid 27 and name HB1 ))
(( segid " " and resid 27 and name HD2 ))
4.200 2.300 1.800 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.43667E-03 ppm1 2.400 ppm2 3.376 CV 1
ASSI { 1047}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 34 and name HA ))
2.700 0.900 0.900 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.16576E-02 ppm1 2.335 ppm2 3.833 CV 1
ASSI { 1048}
(( segid " " and resid 39 and name HG1 ))
(( segid " " and resid 39 and name HA ))
3.300 1.400 1.400 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.21748E-02 ppm1 2.330 ppm2 4.037 CV 1
ASSI { 1049}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 28 and name HB1 ))
4.100 2.100 1.900 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.81823E-03 ppm1 2.313 ppm2 4.119 CV 1
ASSI { 1051}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 57 and name HB1 ))
3.000 1.100 1.100 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.51299E-03 ppm1 2.316 ppm2 3.090 CV 1
ASSI { 1055}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 46 and name HD1 ))
4.200 2.200 1.800 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.52994E-03 ppm1 2.280 ppm2 3.203 CV 1
ASSI { 1056}
(( segid " " and resid 60 and name HB1 ))
(( segid " " and resid 66 and name HA2 ))
3.700 1.700 1.700 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.52570E-03 ppm1 2.227 ppm2 3.765 CV 1
ASSI { 1062}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 27 and name HD1 ))
2.200 0.600 0.600 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.36460E-02 ppm1 2.159 ppm2 4.037 CV 1
ASSI { 1064}
(( segid " " and resid 96 and name HB1 ))
(( segid " " and resid 96 and name HD1 ))
3.900 1.900 1.900 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.80975E-03 ppm1 2.149 ppm2 3.548 CV 1
ASSI { 1066}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 30 and name HD1 ))
5.100 3.200 0.900 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.26031E-03 ppm1 2.111 ppm2 3.894 CV 1
ASSI { 1067}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 28 and name HB2 ))
3.600 1.600 1.600 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.71224E-03 ppm1 2.058 ppm2 3.877 CV 1
ASSI { 1071}
(( segid " " and resid 85 and name HB ))
(( segid " " and resid 85 and name HA ))
3.100 1.200 1.200 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.97936E-03 ppm1 2.035 ppm2 3.995 CV 1
ASSI { 1072}
(( segid " " and resid 77 and name HB ))
(( segid " " and resid 77 and name HA ))
3.300 1.400 1.400 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.54690E-03 ppm1 2.037 ppm2 3.808 CV 1
ASSI { 1079}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HD2 ))
3.000 1.100 1.100 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.41208E-02 ppm1 1.968 ppm2 3.372 CV 1
ASSI { 1083}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 48 and name HA ))
2.600 0.800 0.800 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.54690E-02 ppm1 1.945 ppm2 4.073 CV 1
ASSI { 1087}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 28 and name HB1 ))
6.000 5.300 0.000 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.32009E-04 ppm1 1.890 ppm2 4.115 CV 1
ASSI { 1088}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 9 and name HB2 ))
4.500 2.500 1.500 peak 1088 spectrum 1 weight 0.10000E+01 volume 0.30736E-03 ppm1 1.881 ppm2 3.293 CV 1
ASSI { 1089}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 7 and name HA ))
3.300 1.400 1.400 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.95810E-03 ppm1 1.858 ppm2 3.914 CV 1
ASSI { 1091}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 27 and name HD1 ))
4.100 2.100 1.900 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.78432E-03 ppm1 1.827 ppm2 4.037 CV 1
ASSI { 1093}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 40 and name HA2 ))
3.700 1.700 1.700 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.62321E-03 ppm1 1.828 ppm2 3.780 CV 1
ASSI { 1097}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 8 and name HA ))
3.600 1.600 1.600 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.11192E-02 ppm1 1.823 ppm2 4.120 CV 1
ASSI { 1098}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 100 and name HB2 ))
3.900 1.900 1.900 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.15008E-03 ppm1 1.802 ppm2 3.724 CV 1
ASSI { 1099}
(( segid " " and resid 90 and name HB1 ))
(( segid " " and resid 100 and name HB1 ))
4.600 2.700 1.400 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.61474E-04 ppm1 1.717 ppm2 3.976 CV 1
ASSI { 1100}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 27 and name HD1 ))
1.800 0.400 0.400 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.46635E-02 ppm1 1.714 ppm2 4.004 CV 1
ASSI { 1102}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 27 and name HD2 ))
3.400 1.400 1.400 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.36672E-03 ppm1 1.707 ppm2 3.367 CV 1
ASSI { 1103}
(( segid " " and resid 102 and name HG1 ))
(( segid " " and resid 102 and name HD1 ))
2.500 0.800 0.800 peak 1103 spectrum 1 weight 0.10000E+01 volume 0.69528E-02 ppm1 1.698 ppm2 3.140 CV 1
OR { 1103}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HD1 ))
ASSI { 1104}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 27 and name HD1 ))
5.300 3.500 0.700 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.83095E-04 ppm1 1.691 ppm2 4.028 CV 1
ASSI { 1107}
(( segid " " and resid 92 and name HG2 ))
(( segid " " and resid 33 and name HA2 ))
5.700 4.100 0.300 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.73344E-04 ppm1 1.619 ppm2 3.680 CV 1
ASSI { 1110}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 28 and name HB1 ))
3.900 1.900 1.900 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.29804E-03 ppm1 1.567 ppm2 4.118 CV 1
ASSI { 1117}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 9 and name HB2 ))
5.000 3.100 1.000 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.31500E-03 ppm1 1.535 ppm2 3.300 CV 1
ASSI { 1120}
(( segid " " and resid 7 and name HG1 ))
(( segid " " and resid 7 and name HA ))
3.200 1.300 1.300 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.11234E-02 ppm1 1.498 ppm2 3.917 CV 1
ASSI { 1121}
(( segid " " and resid 7 and name HG1 ))
(( segid " " and resid 8 and name HA ))
4.000 2.000 2.000 peak 1121 spectrum 1 weight 0.10000E+01 volume 0.19841E-03 ppm1 1.476 ppm2 4.121 CV 1
ASSI { 1122}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 95 and name HA2 ))
4.800 2.900 1.200 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.18060E-03 ppm1 1.424 ppm2 3.791 CV 1
ASSI { 1124}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 100 and name HB2 ))
5.300 3.500 0.700 peak 1124 spectrum 1 weight 0.10000E+01 volume 0.16746E-03 ppm1 1.405 ppm2 3.677 CV 1
ASSI { 1128}
( segid " " and resid 80 and name HB% )
(( segid " " and resid 81 and name HA2 ))
4.700 2.700 1.300 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.18188E-03 ppm1 1.377 ppm2 3.693 CV 1
ASSI { 1131}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 92 and name HA ))
2.800 1.000 1.000 peak 1131 spectrum 1 weight 0.10000E+01 volume 0.44515E-02 ppm1 1.353 ppm2 3.573 CV 1
ASSI { 1134}
(( segid " " and resid 78 and name HG1 ))
(( segid " " and resid 77 and name HA ))
3.200 1.300 1.300 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.30949E-02 ppm1 1.324 ppm2 3.797 CV 1
OR { 1134}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 77 and name HA ))
ASSI { 1146}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 15 and name HB ))
4.100 2.100 1.900 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.44940E-03 ppm1 1.239 ppm2 4.072 CV 1
OR { 1146}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 15 and name HB ))
ASSI { 1152}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 70 and name HB ))
4.700 2.700 1.300 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.26031E-03 ppm1 1.159 ppm2 3.798 CV 1
ASSI { 1154}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 102 and name HD1 ))
4.400 2.400 1.600 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.51722E-03 ppm1 1.093 ppm2 3.142 CV 1
ASSI { 1155}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 100 and name HB1 ))
3.100 1.200 1.200 peak 1155 spectrum 1 weight 0.10000E+01 volume 0.29889E-02 ppm1 1.092 ppm2 3.982 CV 1
ASSI { 1158}
( segid " " and resid 8 and name HB% )
(( segid " " and resid 8 and name HA ))
2.000 0.500 0.500 peak 1158 spectrum 1 weight 0.10000E+01 volume 0.20605E-01 ppm1 1.078 ppm2 4.095 CV 1
ASSI { 1163}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 45 and name HB1 ))
4.300 2.300 1.700 peak 1163 spectrum 1 weight 0.10000E+01 volume 0.28702E-03 ppm1 0.946 ppm2 3.991 CV 1
ASSI { 1164}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 13 and name HB ))
2.100 0.500 0.500 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.13015E-01 ppm1 0.946 ppm2 3.861 CV 1
ASSI { 1165}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 46 and name HD1 ))
3.300 3.300 2.700 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.19502E-02 ppm1 0.947 ppm2 3.191 CV 1
ASSI { 1168}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 45 and name HA ))
2.600 0.900 0.900 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.46635E-02 ppm1 0.902 ppm2 3.584 CV 1
ASSI { 1170}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 30 and name HD1 ))
4.000 2.000 2.000 peak 1170 spectrum 1 weight 0.10000E+01 volume 0.28490E-03 ppm1 0.892 ppm2 3.936 CV 1
ASSI { 1177}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 94 and name HB ))
3.500 1.600 1.600 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.15517E-02 ppm1 0.756 ppm2 3.992 CV 1
ASSI { 1183}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 9 and name HB2 ))
4.500 2.500 1.500 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.39470E-03 ppm1 0.666 ppm2 3.286 CV 1
ASSI { 1187}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 85 and name HA ))
2.600 0.800 0.800 peak 1187 spectrum 1 weight 0.10000E+01 volume 0.32687E-02 ppm1 0.592 ppm2 3.995 CV 1
ASSI { 1188}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 77 and name HA ))
3.600 1.700 1.700 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.90301E-03 ppm1 0.589 ppm2 3.810 CV 1
ASSI { 1189}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 9 and name HB1 ))
3.900 1.900 1.900 peak 1189 spectrum 1 weight 0.10000E+01 volume 0.20053E-03 ppm1 0.572 ppm2 3.451 CV 1
ASSI { 1191}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 9 and name HB2 ))
3.500 1.500 1.500 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.69953E-03 ppm1 0.542 ppm2 3.280 CV 1
ASSI { 1193}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 27 and name HD2 ))
2.700 0.900 0.900 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.69528E-03 ppm1 0.521 ppm2 3.372 CV 1
ASSI { 1196}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 104 and name HB ))
2.400 0.700 0.700 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.61897E-02 ppm1 0.431 ppm2 3.273 CV 1
ASSI { 1199}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HD1 ))
5.300 3.500 0.700 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.21834E-03 ppm1 0.390 ppm2 4.027 CV 1
OR { 1199}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 27 and name HD1 ))
ASSI { 1201}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 27 and name HD2 ))
3.300 1.400 1.400 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.18569E-02 ppm1 0.377 ppm2 3.373 CV 1
ASSI { 1202}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 27 and name HD1 ))
5.200 3.400 0.800 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.28702E-03 ppm1 0.372 ppm2 4.007 CV 1
ASSI { 1203}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 34 and name HA ))
3.100 1.200 1.200 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.77160E-03 ppm1 0.320 ppm2 3.829 CV 1
ASSI { 1204}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 85 and name HA ))
2.600 0.900 0.900 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.32220E-02 ppm1 0.265 ppm2 3.995 CV 1
ASSI { 1206}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 34 and name HA ))
3.900 1.900 1.900 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.61474E-03 ppm1 -0.142 ppm2 3.830 CV 1
ASSI { 1213}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 96 and name HB2 ))
4.000 2.000 2.000 peak 1213 spectrum 1 weight 0.10000E+01 volume 0.61897E-03 ppm1 0.050 ppm2 1.896 CV 1
ASSI { 1214}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 55 and name HA ))
2.400 0.700 0.700 peak 1214 spectrum 1 weight 0.10000E+01 volume 0.35952E-02 ppm1 5.068 ppm2 5.578 CV 1
ASSI { 1215}
(( segid " " and resid 36 and name HA ))
( segid " " and resid 89 and name HD% )
3.500 3.500 2.500 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.37350E-03 ppm1 5.007 ppm2 5.581 CV 1
ASSI { 1217}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 72 and name HA ))
1.900 0.400 0.400 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.36757E-02 ppm1 4.886 ppm2 5.702 CV 1
ASSI { 1219}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 109 and name HA ))
4.500 2.500 1.500 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.36588E-03 ppm1 4.528 ppm2 5.511 CV 1
ASSI { 1220}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 89 and name HD% )
2.700 2.700 3.300 peak 1220 spectrum 1 weight 0.10000E+01 volume 0.22936E-02 ppm1 4.431 ppm2 5.579 CV 1
ASSI { 1221}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 55 and name HA ))
4.600 2.600 1.400 peak 1221 spectrum 1 weight 0.10000E+01 volume 0.37139E-03 ppm1 4.320 ppm2 5.579 CV 1
ASSI { 1222}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 89 and name HD% )
3.000 1.100 1.100 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.24590E-02 ppm1 4.121 ppm2 5.578 CV 1
ASSI { 1223}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 109 and name HA ))
4.800 2.800 1.200 peak 1223 spectrum 1 weight 0.10000E+01 volume 0.27048E-03 ppm1 3.995 ppm2 5.512 CV 1
ASSI { 1224}
(( segid " " and resid 100 and name HB1 ))
( segid " " and resid 89 and name HD% )
6.000 5.400 0.000 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.31924E-04 ppm1 3.993 ppm2 5.571 CV 1
ASSI { 1226}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 29 and name HA ))
2.400 0.700 0.700 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.36078E-02 ppm1 3.596 ppm2 5.573 CV 1
ASSI { 1227}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 53 and name HA ))
2.300 0.700 0.700 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.39470E-02 ppm1 5.130 ppm2 5.382 CV 1
ASSI { 1231}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 102 and name HA ))
4.500 2.500 1.500 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.26751E-03 ppm1 4.331 ppm2 5.381 CV 1
ASSI { 1233}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 13 and name HA ))
2.900 1.100 1.100 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.20561E-02 ppm1 3.866 ppm2 5.327 CV 1
ASSI { 1239}
(( segid " " and resid 76 and name HB ))
(( segid " " and resid 76 and name HA ))
2.700 0.900 0.900 peak 1239 spectrum 1 weight 0.10000E+01 volume 0.33789E-02 ppm1 4.035 ppm2 4.869 CV 1
ASSI { 1241}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 103 and name HA ))
4.900 3.000 1.100 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.15771E-03 ppm1 3.991 ppm2 4.691 CV 1
ASSI { 1242}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 110 and name HA ))
3.100 1.200 1.200 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.11913E-02 ppm1 3.992 ppm2 4.532 CV 1
ASSI { 1244}
(( segid " " and resid 100 and name HB1 ))
(( segid " " and resid 100 and name HA ))
2.600 0.800 0.800 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.32729E-02 ppm1 3.984 ppm2 4.489 CV 1
ASSI { 1245}
(( segid " " and resid 97 and name HB1 ))
(( segid " " and resid 97 and name HA ))
2.700 0.900 0.900 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.33026E-02 ppm1 3.960 ppm2 4.765 CV 1
ASSI { 1247}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 6 and name HA ))
4.400 2.400 1.600 peak 1247 spectrum 1 weight 0.10000E+01 volume 0.27684E-03 ppm1 3.913 ppm2 5.165 CV 1
ASSI { 1249}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 69 and name HA1 ))
4.300 2.300 1.700 peak 1249 spectrum 1 weight 0.10000E+01 volume 0.26836E-03 ppm1 3.869 ppm2 4.399 CV 1
ASSI { 1252}
(( segid " " and resid 88 and name HB ))
(( segid " " and resid 88 and name HA ))
3.300 1.400 1.400 peak 1252 spectrum 1 weight 0.10000E+01 volume 0.68681E-03 ppm1 3.833 ppm2 5.163 CV 1
ASSI { 1253}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 90 and name HA ))
5.000 3.100 1.000 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.81399E-04 ppm1 3.834 ppm2 4.644 CV 1
ASSI { 1254}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 70 and name HA ))
2.400 0.700 0.700 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.59778E-02 ppm1 3.801 ppm2 5.079 CV 1
ASSI { 1257}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 97 and name HA ))
2.800 1.000 1.000 peak 1257 spectrum 1 weight 0.10000E+01 volume 0.29380E-02 ppm1 3.796 ppm2 4.765 CV 1
ASSI { 1258}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 58 and name HA ))
4.800 2.900 1.200 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.16704E-03 ppm1 3.785 ppm2 4.579 CV 1
ASSI { 1263}
(( segid " " and resid 2 and name HB1 ))
(( segid " " and resid 2 and name HA ))
2.400 0.700 0.700 peak 1263 spectrum 1 weight 0.10000E+01 volume 0.63169E-02 ppm1 3.728 ppm2 4.639 CV 1
ASSI { 1264}
(( segid " " and resid 1 and name HB1 ))
(( segid " " and resid 1 and name HA ))
2.500 0.800 0.800 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.48331E-02 ppm1 3.725 ppm2 4.493 CV 1
ASSI { 1266}
(( segid " " and resid 59 and name HD1 ))
(( segid " " and resid 58 and name HA ))
2.200 0.600 0.600 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.37223E-02 ppm1 3.685 ppm2 4.579 CV 1
ASSI { 1268}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 28 and name HA ))
5.600 3.900 0.400 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.13058E-03 ppm1 3.597 ppm2 4.767 CV 1
ASSI { 1269}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 69 and name HA1 ))
4.000 2.000 2.000 peak 1269 spectrum 1 weight 0.10000E+01 volume 0.28235E-03 ppm1 3.513 ppm2 4.399 CV 1
ASSI { 1270}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 58 and name HA ))
2.900 1.000 1.000 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.41250E-02 ppm1 3.507 ppm2 4.581 CV 1
ASSI { 1271}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 59 and name HA ))
2.300 0.700 0.700 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.29932E-02 ppm1 3.505 ppm2 4.509 CV 1
ASSI { 1273}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 43 and name HA ))
2.500 0.800 0.800 peak 1273 spectrum 1 weight 0.10000E+01 volume 0.49603E-02 ppm1 3.466 ppm2 4.884 CV 1
ASSI { 1274}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 9 and name HA ))
2.300 0.700 0.700 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.42269E-02 ppm1 3.458 ppm2 4.441 CV 1
ASSI { 1275}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 37 and name HA ))
3.400 1.400 1.400 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.39682E-03 ppm1 3.440 ppm2 4.782 CV 1
ASSI { 1276}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 26 and name HA ))
2.600 0.800 0.800 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.15602E-02 ppm1 3.372 ppm2 4.720 CV 1
ASSI { 1278}
(( segid " " and resid 3 and name HA ))
(( segid " " and resid 4 and name HA ))
4.300 2.300 1.700 peak 1278 spectrum 1 weight 0.10000E+01 volume 0.36121E-03 ppm1 4.639 ppm2 4.896 CV 1
ASSI { 1279}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 15 and name HA ))
4.300 2.300 1.700 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.42819E-03 ppm1 4.617 ppm2 4.976 CV 1
ASSI { 1280}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HA ))
4.400 2.400 1.600 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.41039E-03 ppm1 4.614 ppm2 5.100 CV 1
ASSI { 1282}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 83 and name HA ))
4.000 2.000 2.000 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.70376E-03 ppm1 4.507 ppm2 4.908 CV 1
ASSI { 1283}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 88 and name HA ))
4.300 2.300 1.700 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.42819E-03 ppm1 4.442 ppm2 5.166 CV 1
ASSI { 1285}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 4 and name HA ))
3.700 1.700 1.700 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.88183E-03 ppm1 4.429 ppm2 4.893 CV 1
ASSI { 1286}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 42 and name HA ))
2.400 0.700 0.700 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.58930E-02 ppm1 4.401 ppm2 5.098 CV 1
ASSI { 1287}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HA ))
4.400 2.400 1.600 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.33916E-03 ppm1 4.365 ppm2 5.166 CV 1
ASSI { 1289}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 106 and name HA ))
4.000 2.000 2.000 peak 1289 spectrum 1 weight 0.10000E+01 volume 0.62321E-03 ppm1 4.309 ppm2 5.101 CV 1
ASSI { 1290}
(( segid " " and resid 44 and name HA ))
(( segid " " and resid 43 and name HA ))
4.400 2.400 1.600 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.34426E-03 ppm1 4.299 ppm2 4.889 CV 1
ASSI { 1292}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 70 and name HA ))
2.400 0.700 0.700 peak 1292 spectrum 1 weight 0.10000E+01 volume 0.42099E-02 ppm1 4.843 ppm2 5.079 CV 1
ASSI { 1293}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 15 and name HG2%)
4.700 2.700 1.300 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.31415E-03 ppm1 0.261 ppm2 1.163 CV 1
ASSI { 1295}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HA ))
2.600 0.900 0.900 peak 1295 spectrum 1 weight 0.10000E+01 volume 0.24844E-02 ppm1 4.117 ppm2 4.782 CV 1
ASSI { 1298}
(( segid " " and resid 69 and name HA2 ))
(( segid " " and resid 59 and name HA ))
2.100 2.100 3.900 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.69105E-02 ppm1 4.234 ppm2 4.507 CV 1
ASSI { 1299}
(( segid " " and resid 69 and name HA2 ))
(( segid " " and resid 69 and name HA1 ))
1.600 0.300 0.600 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.13354E-01 ppm1 4.237 ppm2 4.400 CV 1
ASSI { 1300}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 69 and name HA1 ))
3.300 1.300 1.300 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.37944E-03 ppm1 4.156 ppm2 4.426 CV 1
ASSI { 1301}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HB ))
2.600 0.800 0.800 peak 1301 spectrum 1 weight 0.10000E+01 volume 0.43243E-02 ppm1 4.421 ppm2 4.577 CV 1
ASSI { 1303}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 91 and name HA ))
2.700 0.900 0.900 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.14372E-02 ppm1 3.835 ppm2 4.317 CV 1
ASSI { 1305}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 40 and name HA1 ))
1.900 0.500 0.500 peak 1305 spectrum 1 weight 0.10000E+01 volume 0.66137E-02 ppm1 3.785 ppm2 4.272 CV 1
ASSI { 1306}
(( segid " " and resid 95 and name HA2 ))
(( segid " " and resid 95 and name HA1 ))
2.000 0.500 0.500 peak 1306 spectrum 1 weight 0.10000E+01 volume 0.34891E-02 ppm1 3.757 ppm2 4.198 CV 1
ASSI { 1308}
(( segid " " and resid 33 and name HA2 ))
(( segid " " and resid 33 and name HA1 ))
2.600 0.900 0.900 peak 1308 spectrum 1 weight 0.10000E+01 volume 0.10302E-02 ppm1 3.694 ppm2 4.315 CV 1
ASSI { 1311}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 28 and name HB1 ))
5.100 3.200 0.900 peak 1311 spectrum 1 weight 0.10000E+01 volume 0.20986E-03 ppm1 3.599 ppm2 4.153 CV 1
ASSI { 1314}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 69 and name HA2 ))
2.900 1.000 1.000 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.11023E-02 ppm1 3.568 ppm2 4.222 CV 1
ASSI { 1316}
(( segid " " and resid 96 and name HD1 ))
(( segid " " and resid 95 and name HA1 ))
4.900 3.000 1.100 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.23487E-03 ppm1 3.518 ppm2 4.198 CV 1
ASSI { 1318}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 105 and name HA ))
3.700 1.700 1.700 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.86062E-03 ppm1 3.485 ppm2 4.317 CV 1
ASSI { 1322}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 88 and name HB ))
6.000 6.000 0.000 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.79280E-05 ppm1 3.489 ppm2 3.843 CV 1
ASSI { 1324}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 41 and name HA1 ))
4.700 2.700 1.300 peak 1324 spectrum 1 weight 0.10000E+01 volume 0.49603E-03 ppm1 3.434 ppm2 3.913 CV 1
ASSI { 1325}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 27 and name HD1 ))
1.800 0.400 0.400 peak 1325 spectrum 1 weight 0.10000E+01 volume 0.33068E-02 ppm1 3.370 ppm2 4.023 CV 1
ASSI { 1326}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 45 and name HB1 ))
6.000 6.000 0.000 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.50874E-05 ppm1 3.189 ppm2 3.991 CV 1
ASSI { 1327}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 40 and name HA2 ))
4.900 3.000 1.100 peak 1327 spectrum 1 weight 0.10000E+01 volume 0.27303E-03 ppm1 3.191 ppm2 3.809 CV 1
ASSI { 1328}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 41 and name HA1 ))
1.800 0.400 0.400 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.13101E-01 ppm1 3.164 ppm2 3.916 CV 1
ASSI { 1330}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 10 and name HA ))
2.800 1.000 1.000 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.32305E-02 ppm1 3.107 ppm2 3.983 CV 1
ASSI { 1333}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 77 and name HA ))
2.300 0.600 0.600 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.31584E-02 ppm1 2.885 ppm2 3.808 CV 1
ASSI { 1337}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 28 and name HB2 ))
5.100 3.200 0.900 peak 1337 spectrum 1 weight 0.10000E+01 volume 0.50451E-03 ppm1 3.633 ppm2 3.855 CV 1
ASSI { 1338}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 30 and name HD1 ))
2.000 0.500 0.500 peak 1338 spectrum 1 weight 0.10000E+01 volume 0.51299E-02 ppm1 3.596 ppm2 3.893 CV 1
ASSI { 1342}
(( segid " " and resid 66 and name HA2 ))
(( segid " " and resid 66 and name HA1 ))
2.200 0.600 0.600 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.37436E-02 ppm1 3.763 ppm2 3.992 CV 1
ASSI { 1343}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 100 and name HB1 ))
1.900 0.500 0.500 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.56386E-02 ppm1 3.710 ppm2 3.985 CV 1
ASSI { 1344}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HB1 ))
1.600 0.300 0.600 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.80551E-02 ppm1 3.297 ppm2 3.462 CV 1
ASSI { 1345}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 45 and name HA ))
2.100 0.500 0.500 peak 1345 spectrum 1 weight 0.10000E+01 volume 0.35739E-02 ppm1 3.200 ppm2 3.566 CV 1
ASSI { 1348}
(( segid " " and resid 59 and name HD2 ))
(( segid " " and resid 59 and name HD1 ))
1.800 0.400 0.400 peak 1348 spectrum 1 weight 0.10000E+01 volume 0.94966E-02 ppm1 3.496 ppm2 3.693 CV 1
ASSI { 1349}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HB1 ))
1.800 0.400 0.400 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.93270E-02 ppm1 2.990 ppm2 3.210 CV 1
ASSI { 1350}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HB1 ))
1.500 0.300 0.700 peak 1350 spectrum 1 weight 0.10000E+01 volume 0.24250E-01 ppm1 2.930 ppm2 3.116 CV 1
ASSI { 1352}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HB1 ))
1.800 0.400 0.400 peak 1352 spectrum 1 weight 0.10000E+01 volume 0.64017E-02 ppm1 2.826 ppm2 2.992 CV 1
ASSI { 1354}
(( segid " " and resid 73 and name HB2 ))
(( segid " " and resid 73 and name HB1 ))
2.100 0.500 0.500 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.32942E-02 ppm1 2.585 ppm2 2.821 CV 1
ASSI { 1355}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 51 and name HB1 ))
2.100 0.600 0.600 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.27261E-02 ppm1 2.706 ppm2 2.888 CV 1
ASSI { 1357}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 71 and name HG1 ))
2.400 0.700 0.700 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.10895E-02 ppm1 2.314 ppm2 2.533 CV 1
ASSI { 1358}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 46 and name HD2 ))
4.600 2.700 1.400 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.34382E-03 ppm1 2.294 ppm2 2.629 CV 1
ASSI { 1361}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HG1 ))
1.900 0.400 0.400 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.79703E-02 ppm1 2.230 ppm2 2.768 CV 1
ASSI { 1362}
(( segid " " and resid 96 and name HB1 ))
(( segid " " and resid 99 and name HB1 ))
4.100 2.100 1.900 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.10217E-02 ppm1 2.173 ppm2 2.628 CV 1
ASSI { 1363}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 29 and name HB2 ))
5.100 3.200 0.900 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.31712E-03 ppm1 2.160 ppm2 2.735 CV 1
ASSI { 1366}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 71 and name HG1 ))
2.400 2.400 3.600 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.56810E-02 ppm1 2.047 ppm2 2.510 CV 1
ASSI { 1368}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 50 and name HG1 ))
3.500 1.600 1.600 peak 1368 spectrum 1 weight 0.10000E+01 volume 0.72920E-03 ppm1 2.012 ppm2 2.770 CV 1
ASSI { 1369}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 3 and name HB1 ))
4.300 2.300 1.700 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.71648E-03 ppm1 1.963 ppm2 3.000 CV 1
ASSI { 1373}
(( segid " " and resid 50 and name HB1 ))
(( segid " " and resid 50 and name HG1 ))
2.700 0.900 0.900 peak 1373 spectrum 1 weight 0.10000E+01 volume 0.45363E-02 ppm1 1.904 ppm2 2.771 CV 1
ASSI { 1374}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 71 and name HG1 ))
5.200 3.400 0.800 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.27642E-04 ppm1 1.899 ppm2 2.544 CV 1
ASSI { 1375}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 72 and name HB1 ))
4.400 2.400 1.600 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.23487E-03 ppm1 1.859 ppm2 3.014 CV 1
ASSI { 1378}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 78 and name HE1 ))
4.300 2.300 1.700 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.37986E-03 ppm1 1.819 ppm2 2.894 CV 1
ASSI { 1382}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 73 and name HB2 ))
2.700 0.900 0.900 peak 1382 spectrum 1 weight 0.10000E+01 volume 0.13948E-02 ppm1 1.766 ppm2 2.592 CV 1
ASSI { 1383}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 90 and name HG1 ))
1.900 0.500 0.500 peak 1383 spectrum 1 weight 0.10000E+01 volume 0.52570E-02 ppm1 1.739 ppm2 2.492 CV 1
ASSI { 1387}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 29 and name HB2 ))
3.900 1.900 1.900 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.89027E-03 ppm1 1.663 ppm2 2.741 CV 1
ASSI { 1391}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 72 and name HB1 ))
5.900 4.300 0.100 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.11065E-03 ppm1 1.589 ppm2 3.016 CV 1
ASSI { 1392}
(( segid " " and resid 78 and name HD1 ))
(( segid " " and resid 78 and name HE1 ))
2.000 0.500 0.500 peak 1392 spectrum 1 weight 0.10000E+01 volume 0.14160E-01 ppm1 1.567 ppm2 2.856 CV 1
ASSI { 1398}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 72 and name HB1 ))
3.300 1.400 1.400 peak 1398 spectrum 1 weight 0.10000E+01 volume 0.22767E-02 ppm1 1.479 ppm2 3.015 CV 1
ASSI { 1399}
(( segid " " and resid 7 and name HG1 ))
(( segid " " and resid 10 and name HB2 ))
4.000 2.000 2.000 peak 1399 spectrum 1 weight 0.10000E+01 volume 0.39385E-03 ppm1 1.470 ppm2 2.896 CV 1
ASSI { 1401}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 103 and name HB1 ))
4.400 2.400 1.600 peak 1401 spectrum 1 weight 0.10000E+01 volume 0.56810E-03 ppm1 1.458 ppm2 2.572 CV 1
ASSI { 1404}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 90 and name HG1 ))
2.900 1.000 1.000 peak 1404 spectrum 1 weight 0.10000E+01 volume 0.11320E-02 ppm1 1.422 ppm2 2.491 CV 1
ASSI { 1405}
(( segid " " and resid 63 and name HG1 ))
(( segid " " and resid 63 and name HE1 ))
4.000 2.000 2.000 peak 1405 spectrum 1 weight 0.10000E+01 volume 0.50874E-03 ppm1 1.408 ppm2 2.958 CV 1
ASSI { 1406}
( segid " " and resid 80 and name HB% )
(( segid " " and resid 110 and name HB1 ))
4.600 2.600 1.400 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.24208E-03 ppm1 1.405 ppm2 2.713 CV 1
ASSI { 1408}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 73 and name HB2 ))
6.000 4.800 0.000 peak 1408 spectrum 1 weight 0.10000E+01 volume 0.60201E-04 ppm1 1.380 ppm2 2.572 CV 1
ASSI { 1410}
(( segid " " and resid 78 and name HG1 ))
(( segid " " and resid 78 and name HE1 ))
3.400 1.500 1.500 peak 1410 spectrum 1 weight 0.10000E+01 volume 0.13779E-02 ppm1 1.352 ppm2 2.892 CV 1
ASSI { 1412}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 72 and name HB1 ))
3.100 1.200 1.200 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.20689E-03 ppm1 1.309 ppm2 2.995 CV 1
ASSI { 1413}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 29 and name HB2 ))
3.200 1.300 1.300 peak 1413 spectrum 1 weight 0.10000E+01 volume 0.83519E-03 ppm1 1.299 ppm2 2.744 CV 1
ASSI { 1421}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 90 and name HG1 ))
3.600 1.600 1.600 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.61049E-03 ppm1 1.094 ppm2 2.500 CV 1
ASSI { 1423}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 83 and name HB1 ))
3.700 1.700 1.700 peak 1423 spectrum 1 weight 0.10000E+01 volume 0.28405E-03 ppm1 1.011 ppm2 2.900 CV 1
ASSI { 1424}
(( segid " " and resid 56 and name HG1 ))
(( segid " " and resid 56 and name HE1 ))
3.100 1.200 1.200 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.24674E-02 ppm1 0.978 ppm2 2.582 CV 1
ASSI { 1427}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 83 and name HB2 ))
3.900 1.900 1.900 peak 1427 spectrum 1 weight 0.10000E+01 volume 0.79280E-03 ppm1 0.950 ppm2 2.806 CV 1
ASSI { 1429}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 51 and name HB2 ))
6.000 5.800 0.000 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.34129E-04 ppm1 0.945 ppm2 2.710 CV 1
ASSI { 1430}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 47 and name HB1 ))
4.000 2.000 2.000 peak 1430 spectrum 1 weight 0.10000E+01 volume 0.63594E-03 ppm1 0.923 ppm2 2.583 CV 1
ASSI { 1433}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 3 and name HB1 ))
3.200 1.300 1.300 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.15771E-02 ppm1 0.829 ppm2 2.993 CV 1
ASSI { 1434}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 3 and name HB2 ))
3.500 1.500 1.500 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.38114E-02 ppm1 0.829 ppm2 2.832 CV 1
ASSI { 1435}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
3.800 1.800 1.800 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.77160E-03 ppm1 0.825 ppm2 2.889 CV 1
ASSI { 1436}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 51 and name HB2 ))
4.700 2.800 1.300 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.17679E-03 ppm1 0.826 ppm2 2.708 CV 1
ASSI { 1437}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 91 and name HD1 ))
5.500 3.800 0.500 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.47906E-04 ppm1 0.825 ppm2 2.602 CV 1
ASSI { 1438}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 47 and name HB1 ))
4.100 4.100 1.900 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.40191E-03 ppm1 0.823 ppm2 2.563 CV 1
ASSI { 1442}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 3 and name HB1 ))
3.900 1.900 1.900 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.21070E-02 ppm1 0.730 ppm2 2.975 CV 1
ASSI { 1443}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 3 and name HB1 ))
2.900 2.900 3.100 peak 1443 spectrum 1 weight 0.10000E+01 volume 0.71648E-03 ppm1 0.659 ppm2 2.994 CV 1
ASSI { 1444}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 3 and name HB2 ))
5.100 3.200 0.900 peak 1444 spectrum 1 weight 0.10000E+01 volume 0.27939E-03 ppm1 0.664 ppm2 2.815 CV 1
ASSI { 1446}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 83 and name HB1 ))
4.400 2.400 1.600 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.30313E-03 ppm1 0.588 ppm2 2.887 CV 1
ASSI { 1455}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 83 and name HB1 ))
3.900 1.900 1.900 peak 1455 spectrum 1 weight 0.10000E+01 volume 0.36757E-03 ppm1 0.264 ppm2 2.901 CV 1
ASSI { 1460}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 103 and name HB1 ))
4.800 2.900 1.200 peak 1460 spectrum 1 weight 0.10000E+01 volume 0.19587E-03 ppm1 0.018 ppm2 2.563 CV 1
ASSI { 1463}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 106 and name HB2 ))
2.400 0.700 0.700 peak 1463 spectrum 1 weight 0.10000E+01 volume 0.58081E-02 ppm1 0.941 ppm2 2.399 CV 1
ASSI { 1464}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 106 and name HB2 ))
5.900 4.400 0.100 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.73768E-04 ppm1 0.829 ppm2 2.357 CV 1
ASSI { 1467}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 106 and name HB2 ))
4.800 2.900 1.200 peak 1467 spectrum 1 weight 0.10000E+01 volume 0.19121E-03 ppm1 0.263 ppm2 2.356 CV 1
ASSI { 1469}
(( segid " " and resid 43 and name HD1 ))
(( segid " " and resid 43 and name HB1 ))
3.100 1.200 1.200 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.15305E-02 ppm1 1.665 ppm2 2.174 CV 1
ASSI { 1470}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 60 and name HB1 ))
3.800 1.800 1.800 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.41463E-03 ppm1 1.571 ppm2 2.228 CV 1
OR { 1470}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 60 and name HB1 ))
ASSI { 1474}
( segid " " and resid 67 and name HB% )
(( segid " " and resid 60 and name HB1 ))
4.700 2.800 1.300 peak 1474 spectrum 1 weight 0.10000E+01 volume 0.19968E-03 ppm1 1.433 ppm2 2.173 CV 1
ASSI { 1478}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 34 and name HB1 ))
1.400 1.400 4.600 peak 1478 spectrum 1 weight 0.10000E+01 volume 0.49179E+00 ppm1 1.317 ppm2 2.360 CV 1
ASSI { 1481}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 103 and name HB2 ))
4.100 2.100 1.900 peak 1481 spectrum 1 weight 0.10000E+01 volume 0.58081E-03 ppm1 1.243 ppm2 2.288 CV 1
ASSI { 1482}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 60 and name HB1 ))
4.100 2.100 1.900 peak 1482 spectrum 1 weight 0.10000E+01 volume 0.33153E-03 ppm1 1.239 ppm2 2.212 CV 1
ASSI { 1483}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 34 and name HB1 ))
5.000 3.100 1.000 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.12718E-03 ppm1 1.225 ppm2 2.325 CV 1
ASSI { 1484}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 20 and name HG1 ))
2.000 0.500 0.500 peak 1484 spectrum 1 weight 0.10000E+01 volume 0.68681E-02 ppm1 2.256 ppm2 2.412 CV 1
ASSI { 1485}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HB1 ))
2.000 0.500 0.500 peak 1485 spectrum 1 weight 0.10000E+01 volume 0.54267E-02 ppm1 1.953 ppm2 2.401 CV 1
ASSI { 1486}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HB1 ))
1.800 0.400 0.400 peak 1486 spectrum 1 weight 0.10000E+01 volume 0.91575E-02 ppm1 1.841 ppm2 2.097 CV 1
ASSI { 1487}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 30 and name HB1 ))
1.200 0.200 1.000 peak 1487 spectrum 1 weight 0.10000E+01 volume 0.14499E+00 ppm1 1.787 ppm2 2.108 CV 1
ASSI { 1488}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 27 and name HG1 ))
1.700 0.400 0.500 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.61474E-02 ppm1 2.032 ppm2 2.164 CV 1
ASSI { 1489}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HB1 ))
1.700 0.400 0.500 peak 1489 spectrum 1 weight 0.10000E+01 volume 0.18103E-01 ppm1 1.967 ppm2 2.156 CV 1
ASSI { 1491}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HB1 ))
2.100 0.500 0.500 peak 1491 spectrum 1 weight 0.10000E+01 volume 0.48755E-02 ppm1 1.952 ppm2 2.220 CV 1
ASSI { 1493}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 96 and name HB1 ))
3.400 3.400 2.600 peak 1493 spectrum 1 weight 0.10000E+01 volume 0.17340E-03 ppm1 1.881 ppm2 2.171 CV 1
ASSI { 1494}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HG1 ))
2.700 0.900 0.900 peak 1494 spectrum 1 weight 0.10000E+01 volume 0.22936E-02 ppm1 1.846 ppm2 2.327 CV 1
ASSI { 1495}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HB1 ))
2.100 0.500 0.500 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.50874E-02 ppm1 1.843 ppm2 2.276 CV 1
ASSI { 1496}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 107 and name HB1 ))
1.900 0.500 0.500 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.51722E-02 ppm1 1.008 ppm2 1.914 CV 1
ASSI { 1498}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 25 and name HG1 ))
3.100 1.200 1.200 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.10302E-02 ppm1 0.972 ppm2 1.830 CV 1
ASSI { 1499}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 25 and name HG2 ))
3.000 1.100 1.100 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.14202E-02 ppm1 0.975 ppm2 1.163 CV 1
ASSI { 1500}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 108 and name HB1 ))
4.000 2.000 2.000 peak 1500 spectrum 1 weight 0.10000E+01 volume 0.44092E-03 ppm1 0.952 ppm2 1.794 CV 1
ASSI { 1501}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 108 and name HD1 ))
5.200 3.400 0.800 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.15771E-03 ppm1 0.955 ppm2 1.483 CV 1
ASSI { 1502}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 108 and name HB2 ))
2.800 0.900 0.900 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.18230E-02 ppm1 0.956 ppm2 1.269 CV 1
OR { 1502}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 108 and name HG1 ))
ASSI { 1503}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 77 and name HB ))
2.300 0.600 0.600 peak 1503 spectrum 1 weight 0.10000E+01 volume 0.67833E-02 ppm1 0.944 ppm2 2.037 CV 1
ASSI { 1506}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 63 and name HD1 ))
3.800 1.800 1.800 peak 1506 spectrum 1 weight 0.10000E+01 volume 0.50874E-03 ppm1 0.917 ppm2 1.658 CV 1
ASSI { 1509}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 21 and name HB2 ))
4.000 2.000 2.000 peak 1509 spectrum 1 weight 0.10000E+01 volume 0.20858E-03 ppm1 0.893 ppm2 1.502 CV 1
ASSI { 1510}
( segid " " and resid 65 and name HD1%)
( segid " " and resid 67 and name HB% )
3.600 1.600 1.600 peak 1510 spectrum 1 weight 0.10000E+01 volume 0.60201E-03 ppm1 0.891 ppm2 1.422 CV 1
ASSI { 1511}
( segid " " and resid 64 and name HD2%)
(( segid " " and resid 63 and name HD1 ))
4.500 2.500 1.500 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.20647E-03 ppm1 0.860 ppm2 1.655 CV 1
OR { 1511}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 63 and name HD1 ))
ASSI { 1513}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 5 and name HB ))
2.300 0.600 0.600 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.35655E-02 ppm1 0.835 ppm2 1.880 CV 1
ASSI { 1514}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 22 and name HB ))
2.500 0.800 0.800 peak 1514 spectrum 1 weight 0.10000E+01 volume 0.35485E-02 ppm1 0.829 ppm2 1.965 CV 1
ASSI { 1515}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 77 and name HB ))
2.500 0.800 0.800 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.40446E-02 ppm1 0.826 ppm2 2.038 CV 1
ASSI { 1518}
( segid " " and resid 64 and name HD2%)
(( segid " " and resid 64 and name HG ))
3.300 1.400 1.400 peak 1518 spectrum 1 weight 0.10000E+01 volume 0.10047E-02 ppm1 0.820 ppm2 1.554 CV 1
ASSI { 1519}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 90 and name HB2 ))
5.600 4.000 0.400 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.12592E-03 ppm1 0.814 ppm2 1.422 CV 1
ASSI { 1520}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 105 and name HB ))
2.400 0.700 0.700 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.32390E-02 ppm1 0.787 ppm2 1.779 CV 1
ASSI { 1521}
( segid " " and resid 105 and name HG1%)
( segid " " and resid 12 and name HB% )
5.000 3.100 1.000 peak 1521 spectrum 1 weight 0.10000E+01 volume 0.19121E-03 ppm1 0.789 ppm2 1.537 CV 1
ASSI { 1522}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 90 and name HB2 ))
3.600 1.600 1.600 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.20986E-02 ppm1 0.756 ppm2 1.405 CV 1
ASSI { 1523}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 18 and name HB ))
2.000 0.500 0.500 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.11871E-01 ppm1 0.749 ppm2 1.852 CV 1
ASSI { 1525}
( segid " " and resid 18 and name HG1%)
( segid " " and resid 109 and name HB% )
2.800 1.000 1.000 peak 1525 spectrum 1 weight 0.10000E+01 volume 0.29423E-02 ppm1 0.752 ppm2 1.324 CV 1
ASSI { 1526}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 16 and name HB ))
2.700 0.900 0.900 peak 1526 spectrum 1 weight 0.10000E+01 volume 0.34086E-02 ppm1 0.728 ppm2 2.018 CV 1
ASSI { 1527}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 92 and name HG2 ))
3.500 1.600 1.600 peak 1527 spectrum 1 weight 0.10000E+01 volume 0.98779E-03 ppm1 0.729 ppm2 1.614 CV 1
ASSI { 1529}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 16 and name HB ))
2.900 1.000 1.000 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.17509E-02 ppm1 0.674 ppm2 2.035 CV 1
ASSI { 1530}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 105 and name HB ))
2.500 0.800 0.800 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.25183E-02 ppm1 0.676 ppm2 1.779 CV 1
ASSI { 1532}
( segid " " and resid 105 and name HG2%)
( segid " " and resid 12 and name HB% )
2.400 0.700 0.700 peak 1532 spectrum 1 weight 0.10000E+01 volume 0.33832E-02 ppm1 0.666 ppm2 1.543 CV 1
ASSI { 1534}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 87 and name HB2 ))
3.200 1.300 1.300 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.44940E-03 ppm1 0.662 ppm2 1.225 CV 1
ASSI { 1540}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 5 and name HB ))
2.300 0.600 0.600 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.32348E-02 ppm1 0.596 ppm2 1.884 CV 1
ASSI { 1547}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 5 and name HB ))
2.300 0.700 0.700 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.40911E-02 ppm1 0.541 ppm2 1.883 CV 1
ASSI { 1548}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 71 and name HB1 ))
4.000 2.000 2.000 peak 1548 spectrum 1 weight 0.10000E+01 volume 0.12295E-02 ppm1 0.521 ppm2 1.966 CV 1
ASSI { 1551}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 15 and name HG2%)
4.800 2.900 1.200 peak 1551 spectrum 1 weight 0.10000E+01 volume 0.19757E-03 ppm1 0.514 ppm2 1.162 CV 1
ASSI { 1553}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 105 and name HB ))
5.500 3.800 0.500 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.10091E-03 ppm1 0.437 ppm2 1.776 CV 1
ASSI { 1554}
( segid " " and resid 104 and name HG2%)
( segid " " and resid 84 and name HB% )
3.400 1.500 1.500 peak 1554 spectrum 1 weight 0.10000E+01 volume 0.12507E-02 ppm1 0.431 ppm2 1.349 CV 1
ASSI { 1555}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HG2 ))
5.000 3.100 1.000 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.31669E-03 ppm1 0.392 ppm2 2.051 CV 1
OR { 1555}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 27 and name HG2 ))
ASSI { 1556}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 27 and name HG2 ))
4.900 3.000 1.100 peak 1556 spectrum 1 weight 0.10000E+01 volume 0.39089E-03 ppm1 0.362 ppm2 2.030 CV 1
ASSI { 1559}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 107 and name HB1 ))
4.500 2.600 1.500 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.26751E-03 ppm1 0.259 ppm2 1.915 CV 1
ASSI { 1564}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 106 and name HN ))
2.900 1.100 1.100 peak 1564 spectrum 1 weight 0.11000E+01 volume 0.18908E-02 ppm1 5.329 ppm2 8.653 CV 1
ASSI { 1565}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HN ))
3.200 1.300 1.300 peak 1565 spectrum 1 weight 0.11000E+01 volume 0.94544E-03 ppm1 4.649 ppm2 9.243 CV 1
ASSI { 1566}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 108 and name HN ))
4.000 2.000 2.000 peak 1566 spectrum 1 weight 0.11000E+01 volume 0.53842E-03 ppm1 9.242 ppm2 9.156 CV 1
ASSI { 1568}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 109 and name HA ))
4.400 2.400 1.600 peak 1568 spectrum 1 weight 0.11000E+01 volume 0.58930E-03 ppm1 4.976 ppm2 5.514 CV 1
ASSI { 1570}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 109 and name HA ))
4.900 3.000 1.100 peak 1570 spectrum 1 weight 0.11000E+01 volume 0.28065E-03 ppm1 4.614 ppm2 5.511 CV 1
ASSI { 1571}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 3 and name HD2 ))
3.300 1.300 1.300 peak 1571 spectrum 1 weight 0.11000E+01 volume 0.15559E-02 ppm1 0.262 ppm2 6.893 CV 1
ASSI { 1573}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 109 and name HA ))
3.900 1.900 1.900 peak 1573 spectrum 1 weight 0.11000E+01 volume 0.64017E-03 ppm1 5.097 ppm2 5.513 CV 1
ASSI { 1574}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 22 and name HN ))
3.200 1.300 1.300 peak 1574 spectrum 1 weight 0.11000E+01 volume 0.80975E-03 ppm1 4.414 ppm2 9.386 CV 1
ASSI { 1575}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 3 and name HD2 ))
2.900 1.000 1.000 peak 1575 spectrum 1 weight 0.11000E+01 volume 0.15178E-02 ppm1 0.829 ppm2 6.893 CV 1
ASSI { 1578}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HN ))
2.800 2.800 3.200 peak 1578 spectrum 1 weight 0.11000E+01 volume 0.10556E-02 ppm1 4.438 ppm2 9.091 CV 1
ASSI { 1586}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HN ))
5.300 3.500 0.700 peak 1586 spectrum 1 weight 0.11000E+01 volume 0.33492E-04 ppm1 4.780 ppm2 9.090 CV 1
ASSI { 1589}
( segid " " and resid 38 and name HE% )
(( segid " " and resid 38 and name HZ ))
2.200 0.600 0.600 peak 1589 spectrum 1 weight 0.11000E+01 volume 0.78855E-02 ppm1 6.885 ppm2 7.274 CV 1
ASSI { 1590}
(( segid " " and resid 38 and name HZ ))
( segid " " and resid 38 and name HD% )
2.600 2.600 3.400 peak 1590 spectrum 1 weight 0.11000E+01 volume 0.92849E-02 ppm1 7.275 ppm2 7.497 CV 1
ASSI { 1593}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 52 and name HA ))
2.300 0.700 0.700 peak 1593 spectrum 1 weight 0.11000E+01 volume 0.60201E-02 ppm1 4.342 ppm2 4.814 CV 1
ASSI { 1595}
( segid " " and resid 57 and name HE% )
( segid " " and resid 57 and name HD% )
2.300 0.700 0.700 peak 1595 spectrum 1 weight 0.11000E+01 volume 0.57658E-02 ppm1 6.890 ppm2 7.206 CV 1
ASSI { 1599}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 22 and name HN ))
2.200 0.600 0.600 peak 1599 spectrum 1 weight 0.11000E+01 volume 0.87762E-02 ppm1 4.884 ppm2 9.389 CV 1
ASSI { 1600}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 76 and name HN ))
3.400 1.400 1.400 peak 1600 spectrum 1 weight 0.11000E+01 volume 0.55962E-03 ppm1 4.870 ppm2 8.742 CV 1
ASSI { 1602}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 109 and name HN ))
2.500 0.800 0.800 peak 1602 spectrum 1 weight 0.11000E+01 volume 0.34171E-02 ppm1 4.899 ppm2 9.082 CV 1
ASSI { 1603}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 85 and name HN ))
2.300 0.600 0.600 peak 1603 spectrum 1 weight 0.11000E+01 volume 0.47906E-02 ppm1 4.504 ppm2 8.594 CV 1
ASSI { 1605}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 107 and name HN ))
3.700 1.700 1.700 peak 1605 spectrum 1 weight 0.11000E+01 volume 0.58081E-03 ppm1 4.503 ppm2 9.202 CV 1
ASSI { 1606}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HN ))
2.900 1.000 1.000 peak 1606 spectrum 1 weight 0.11000E+01 volume 0.13354E-02 ppm1 3.995 ppm2 8.592 CV 1
ASSI { 1607}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 107 and name HN ))
6.000 5.900 0.000 peak 1607 spectrum 1 weight 0.11000E+01 volume 0.20180E-04 ppm1 8.594 ppm2 9.200 CV 1
ASSI { 1610}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HN ))
3.200 1.300 1.300 peak 1610 spectrum 1 weight 0.11000E+01 volume 0.45363E-03 ppm1 4.880 ppm2 9.339 CV 1
ASSI { 1612}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 36 and name HA ))
2.500 0.800 0.800 peak 1612 spectrum 1 weight 0.11000E+01 volume 0.21028E-02 ppm1 4.431 ppm2 5.005 CV 1
ASSI { 1613}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 89 and name HN ))
3.400 1.400 1.400 peak 1613 spectrum 1 weight 0.11000E+01 volume 0.45363E-03 ppm1 4.430 ppm2 8.552 CV 1
ASSI { 1615}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 36 and name HD1 ))
3.400 3.400 2.600 peak 1615 spectrum 1 weight 0.11000E+01 volume 0.47059E-03 ppm1 5.579 ppm2 7.415 CV 1
ASSI { 1617}
( segid " " and resid 89 and name HE% )
(( segid " " and resid 36 and name HD1 ))
3.100 3.100 2.900 peak 1617 spectrum 1 weight 0.11000E+01 volume 0.81823E-03 ppm1 6.473 ppm2 7.415 CV 1
ASSI { 1618}
(( segid " " and resid 98 and name HD2 ))
(( segid " " and resid 98 and name HE1 ))
5.600 3.900 0.400 peak 1618 spectrum 1 weight 0.11000E+01 volume 0.12804E-03 ppm1 7.139 ppm2 7.975 CV 1
ASSI { 1619}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 103 and name HN ))
3.400 1.400 1.400 peak 1619 spectrum 1 weight 0.11000E+01 volume 0.45787E-03 ppm1 4.688 ppm2 9.211 CV 1
ASSI { 1620}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 87 and name HN ))
3.200 1.200 1.200 peak 1620 spectrum 1 weight 0.11000E+01 volume 0.49179E-03 ppm1 9.203 ppm2 9.338 CV 1
ASSI { 1621}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 86 and name HA ))
6.000 6.000 0.000 peak 1621 spectrum 1 weight 0.11000E+01 volume 0.21495E-05 ppm1 5.321 ppm2 5.393 CV 1
ASSI { 1623}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 105 and name HN ))
2.300 0.600 0.600 peak 1623 spectrum 1 weight 0.11000E+01 volume 0.48331E-02 ppm1 5.320 ppm2 7.826 CV 1
ASSI { 1624}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 105 and name HN ))
2.900 1.000 1.000 peak 1624 spectrum 1 weight 0.11000E+01 volume 0.12888E-02 ppm1 4.306 ppm2 7.825 CV 1
ASSI { 1625}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 106 and name HN ))
2.200 0.600 0.600 peak 1625 spectrum 1 weight 0.11000E+01 volume 0.50874E-02 ppm1 4.305 ppm2 8.654 CV 1
ASSI { 1626}
(( segid " " and resid 105 and name HN ))
(( segid " " and resid 85 and name HN ))
3.500 1.600 1.600 peak 1626 spectrum 1 weight 0.11000E+01 volume 0.42819E-03 ppm1 7.823 ppm2 8.592 CV 1
ASSI { 1629}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 107 and name HN ))
2.400 0.700 0.700 peak 1629 spectrum 1 weight 0.11000E+01 volume 0.36842E-02 ppm1 5.093 ppm2 9.204 CV 1
ASSI { 1630}
(( segid " " and resid 106 and name HN ))
(( segid " " and resid 14 and name HN ))
4.200 2.200 1.800 peak 1630 spectrum 1 weight 0.11000E+01 volume 0.44940E-03 ppm1 8.655 ppm2 9.251 CV 1
ASSI { 1631}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 107 and name HN ))
3.500 1.500 1.500 peak 1631 spectrum 1 weight 0.11000E+01 volume 0.50874E-03 ppm1 4.953 ppm2 9.203 CV 1
ASSI { 1632}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 82 and name HA ))
2.000 0.500 0.500 peak 1632 spectrum 1 weight 0.11000E+01 volume 0.68681E-02 ppm1 4.782 ppm2 4.907 CV 1
ASSI { 1634}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 16 and name HN ))
3.000 1.100 1.100 peak 1634 spectrum 1 weight 0.11000E+01 volume 0.24929E-02 ppm1 5.512 ppm2 8.659 CV 1
ASSI { 1635}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 109 and name HN ))
3.600 1.600 1.600 peak 1635 spectrum 1 weight 0.11000E+01 volume 0.33577E-03 ppm1 5.511 ppm2 9.083 CV 1
ASSI { 1}
(( segid " " and resid 90 and name HB2 ))
(( segid " " and resid 91 and name HN ))
0.800 0.800 5.200 peak 1 spectrum 1 weight 0.10000E+01 volume 0.13707E+01 ppm1 1.439 ppm2 7.631 CV 1
ASSI { 7}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 11 and name HN ))
1.700 1.700 4.300 peak 7 spectrum 1 weight 0.10000E+01 volume 0.10510E+00 ppm1 4.299 ppm2 9.673 CV 1
ASSI { 9}
( segid " " and resid 17 and name HB% )
(( segid " " and resid 17 and name HN ))
1.700 0.400 0.500 peak 9 spectrum 1 weight 0.10000E+01 volume 0.47564E-01 ppm1 1.328 ppm2 8.382 CV 1
ASSI { 11}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HB2 ))
1.900 0.400 0.400 peak 11 spectrum 1 weight 0.10000E+01 volume 0.40148E-01 ppm1 4.314 ppm2 1.914 CV 1
ASSI { 13}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 19 and name HN ))
1.500 0.300 0.700 peak 13 spectrum 1 weight 0.10000E+01 volume 0.33499E-01 ppm1 1.822 ppm2 8.649 CV 1
ASSI { 18}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 26 and name HN ))
1.500 0.300 0.700 peak 18 spectrum 1 weight 0.10000E+01 volume 0.26595E-01 ppm1 1.160 ppm2 8.548 CV 1
ASSI { 19}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 65 and name HN ))
1.700 0.300 0.500 peak 19 spectrum 1 weight 0.10000E+01 volume 0.25061E-01 ppm1 1.569 ppm2 8.117 CV 1
ASSI { 21}
(( segid " " and resid 4 and name HD1 ))
(( segid " " and resid 4 and name HE1 ))
2.000 0.500 0.500 peak 21 spectrum 1 weight 0.10000E+01 volume 0.23373E-01 ppm1 1.482 ppm2 2.806 CV 1
ASSI { 22}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 55 and name HN ))
1.800 0.400 0.400 peak 22 spectrum 1 weight 0.11000E+01 volume 0.20688E-01 ppm1 4.864 ppm2 9.056 CV 1
ASSI { 25}
(( segid " " and resid 81 and name HA2 ))
(( segid " " and resid 82 and name HN ))
1.900 0.500 0.500 peak 25 spectrum 1 weight 0.10000E+01 volume 0.18233E-01 ppm1 3.672 ppm2 8.116 CV 1
ASSI { 27}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 66 and name HA1 ))
2.300 2.300 3.700 peak 27 spectrum 1 weight 0.10000E+01 volume 0.16085E-01 ppm1 4.145 ppm2 4.018 CV 1
ASSI { 28}
( segid " " and resid 80 and name HB% )
(( segid " " and resid 110 and name HD21))
2.500 2.500 3.500 peak 28 spectrum 1 weight 0.10000E+01 volume 0.15982E-01 ppm1 1.433 ppm2 7.507 CV 1
ASSI { 32}
(( segid " " and resid 19 and name HA1 ))
(( segid " " and resid 19 and name HA2 ))
1.800 0.400 0.400 peak 32 spectrum 1 weight 0.10000E+01 volume 0.14704E-01 ppm1 4.333 ppm2 3.575 CV 1
ASSI { 33}
(( segid " " and resid 87 and name HB1 ))
( segid " " and resid 103 and name HD% )
2.200 2.200 3.800 peak 33 spectrum 1 weight 0.10000E+01 volume 0.14115E-01 ppm1 1.484 ppm2 6.685 CV 1
ASSI { 37}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HN ))
2.000 2.000 4.000 peak 37 spectrum 1 weight 0.10000E+01 volume 0.12582E-01 ppm1 4.168 ppm2 8.116 CV 1
ASSI { 38}
( segid " " and resid 37 and name HE% )
( segid " " and resid 37 and name HD% )
2.000 0.500 0.500 peak 38 spectrum 1 weight 0.10000E+01 volume 0.12428E-01 ppm1 6.721 ppm2 6.838 CV 1
ASSI { 39}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 26 and name HG ))
1.900 0.500 0.500 peak 39 spectrum 1 weight 0.10000E+01 volume 0.12274E-01 ppm1 -1.283 ppm2 0.371 CV 1
ASSI { 40}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 14 and name HN ))
1.900 0.400 0.400 peak 40 spectrum 1 weight 0.10000E+01 volume 0.12147E-01 ppm1 5.329 ppm2 9.234 CV 1
ASSI { 41}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HD1 ))
1.900 0.500 0.500 peak 41 spectrum 1 weight 0.10000E+01 volume 0.11763E-01 ppm1 3.912 ppm2 1.710 CV 1
ASSI { 42}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 56 and name HE1 ))
1.800 0.400 0.400 peak 42 spectrum 1 weight 0.10000E+01 volume 0.11559E-01 ppm1 1.451 ppm2 2.648 CV 1
ASSI { 46}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 104 and name HN ))
1.900 0.500 0.500 peak 46 spectrum 1 weight 0.10000E+01 volume 0.11149E-01 ppm1 4.692 ppm2 7.559 CV 1
ASSI { 49}
(( segid " " and resid 99 and name HB1 ))
(( segid " " and resid 99 and name HN ))
2.300 0.600 0.600 peak 49 spectrum 1 weight 0.10000E+01 volume 0.10664E-01 ppm1 2.626 ppm2 8.125 CV 1
ASSI { 51}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 109 and name HN ))
2.400 0.700 0.700 peak 51 spectrum 1 weight 0.10000E+01 volume 0.10433E-01 ppm1 1.254 ppm2 9.070 CV 1
OR { 51}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 109 and name HN ))
ASSI { 54}
(( segid " " and resid 86 and name HD22))
(( segid " " and resid 86 and name HD21))
1.800 0.400 0.400 peak 54 spectrum 1 weight 0.10000E+01 volume 0.95896E-02 ppm1 6.631 ppm2 7.562 CV 1
ASSI { 56}
( segid " " and resid 17 and name HB% )
(( segid " " and resid 18 and name HN ))
2.500 0.800 0.800 peak 56 spectrum 1 weight 0.10000E+01 volume 0.95130E-02 ppm1 1.327 ppm2 8.412 CV 1
ASSI { 58}
( segid " " and resid 51 and name HD% )
( segid " " and resid 51 and name HE% )
2.100 0.500 0.500 peak 58 spectrum 1 weight 0.10000E+01 volume 0.93847E-02 ppm1 6.654 ppm2 7.114 CV 1
ASSI { 60}
(( segid " " and resid 25 and name HE22))
(( segid " " and resid 25 and name HE21))
1.700 0.300 0.500 peak 60 spectrum 1 weight 0.10000E+01 volume 0.93081E-02 ppm1 6.643 ppm2 7.239 CV 1
ASSI { 64}
( segid " " and resid 103 and name HD% )
( segid " " and resid 103 and name HE% )
2.000 0.500 0.500 peak 64 spectrum 1 weight 0.10000E+01 volume 0.91549E-02 ppm1 6.691 ppm2 6.914 CV 1
ASSI { 65}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 16 and name HB ))
2.000 0.500 0.500 peak 65 spectrum 1 weight 0.10000E+01 volume 0.91291E-02 ppm1 0.267 ppm2 2.028 CV 1
ASSI { 66}
(( segid " " and resid 86 and name HD22))
( segid " " and resid 38 and name HE% )
2.800 2.800 3.200 peak 66 spectrum 1 weight 0.10000E+01 volume 0.90266E-02 ppm1 6.640 ppm2 6.914 CV 1
ASSI { 68}
( segid " " and resid 89 and name HD% )
( segid " " and resid 89 and name HE% )
2.100 0.500 0.500 peak 68 spectrum 1 weight 0.10000E+01 volume 0.87968E-02 ppm1 5.578 ppm2 6.469 CV 1
ASSI { 69}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 103 and name HB1 ))
1.600 0.300 0.600 peak 69 spectrum 1 weight 0.10000E+01 volume 0.87710E-02 ppm1 2.255 ppm2 2.591 CV 1
ASSI { 70}
(( segid " " and resid 47 and name HD22))
(( segid " " and resid 47 and name HD21))
1.900 0.400 0.400 peak 70 spectrum 1 weight 0.10000E+01 volume 0.87460E-02 ppm1 7.018 ppm2 7.633 CV 1
ASSI { 72}
( segid " " and resid 51 and name HE% )
(( segid " " and resid 51 and name HZ ))
2.200 0.600 0.600 peak 72 spectrum 1 weight 0.10000E+01 volume 0.85411E-02 ppm1 7.115 ppm2 7.313 CV 1
ASSI { 73}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 37 and name HD% )
2.100 0.500 0.500 peak 73 spectrum 1 weight 0.10000E+01 volume 0.81319E-02 ppm1 2.521 ppm2 6.833 CV 1
ASSI { 75}
(( segid " " and resid 92 and name HD1 ))
(( segid " " and resid 95 and name HA2 ))
2.400 2.400 3.600 peak 75 spectrum 1 weight 0.10000E+01 volume 0.79529E-02 ppm1 3.510 ppm2 3.754 CV 1
ASSI { 77}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 71 and name HN ))
2.800 1.000 1.000 peak 77 spectrum 1 weight 0.10000E+01 volume 0.78762E-02 ppm1 0.969 ppm2 9.589 CV 1
ASSI { 78}
(( segid " " and resid 86 and name HB1 ))
(( segid " " and resid 87 and name HN ))
2.200 0.600 2.000 peak 78 spectrum 1 weight 0.10000E+01 volume 0.78762E-02 ppm1 2.696 ppm2 9.331 CV 1
ASSI { 79}
( segid " " and resid 34 and name HD% )
( segid " " and resid 34 and name HE% )
2.100 0.500 0.500 peak 79 spectrum 1 weight 0.10000E+01 volume 0.77228E-02 ppm1 6.502 ppm2 7.120 CV 1
ASSI { 81}
(( segid " " and resid 14 and name HA ))
( segid " " and resid 14 and name HD1%)
2.600 0.800 0.800 peak 81 spectrum 1 weight 0.10000E+01 volume 0.74159E-02 ppm1 4.660 ppm2 0.578 CV 1
ASSI { 82}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 110 and name HN ))
2.500 0.800 0.800 peak 82 spectrum 1 weight 0.10000E+01 volume 0.73648E-02 ppm1 1.322 ppm2 8.120 CV 1
ASSI { 87}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 110 and name HN ))
2.100 0.500 0.500 peak 87 spectrum 1 weight 0.10000E+01 volume 0.71602E-02 ppm1 5.510 ppm2 8.123 CV 1
ASSI { 90}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 23 and name HN ))
2.700 0.900 0.900 peak 90 spectrum 1 weight 0.10000E+01 volume 0.66487E-02 ppm1 0.669 ppm2 8.718 CV 1
ASSI { 92}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 87 and name HN ))
2.000 0.500 0.500 peak 92 spectrum 1 weight 0.10000E+01 volume 0.64953E-02 ppm1 5.394 ppm2 9.334 CV 1
ASSI { 93}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HB1 ))
1.800 0.400 0.400 peak 93 spectrum 1 weight 0.10000E+01 volume 0.64697E-02 ppm1 3.873 ppm2 4.120 CV 1
ASSI { 95}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 97 and name HN ))
2.300 0.700 0.700 peak 95 spectrum 1 weight 0.10000E+01 volume 0.63674E-02 ppm1 4.308 ppm2 8.804 CV 1
ASSI { 97}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 106 and name HB1 ))
1.900 0.400 0.400 peak 97 spectrum 1 weight 0.10000E+01 volume 0.63163E-02 ppm1 2.399 ppm2 3.143 CV 1
ASSI { 100}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 14 and name HN ))
2.600 0.900 0.900 peak 100 spectrum 1 weight 0.10000E+01 volume 0.61884E-02 ppm1 0.958 ppm2 9.238 CV 1
ASSI { 102}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HG1 ))
1.700 0.300 0.500 peak 102 spectrum 1 weight 0.10000E+01 volume 0.61117E-02 ppm1 -0.115 ppm2 0.344 CV 1
ASSI { 103}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HB1 ))
1.900 0.400 0.400 peak 103 spectrum 1 weight 0.10000E+01 volume 0.60606E-02 ppm1 0.755 ppm2 2.339 CV 1
ASSI { 105}
(( segid " " and resid 36 and name HH2 ))
(( segid " " and resid 36 and name HZ2 ))
2.300 0.700 0.700 peak 105 spectrum 1 weight 0.10000E+01 volume 0.60350E-02 ppm1 6.771 ppm2 6.980 CV 1
ASSI { 107}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 26 and name HG ))
2.100 0.600 0.600 peak 107 spectrum 1 weight 0.10000E+01 volume 0.59583E-02 ppm1 -0.655 ppm2 0.371 CV 1
ASSI { 112}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 6 and name HN ))
2.100 0.600 0.600 peak 112 spectrum 1 weight 0.11000E+01 volume 0.57026E-02 ppm1 4.375 ppm2 10.247 CV 1
ASSI { 113}
(( segid " " and resid 33 and name HA1 ))
(( segid " " and resid 33 and name HN ))
2.200 0.600 0.600 peak 113 spectrum 1 weight 0.10000E+01 volume 0.56514E-02 ppm1 4.292 ppm2 7.858 CV 1
ASSI { 114}
(( segid " " and resid 110 and name HB2 ))
(( segid " " and resid 110 and name HD22))
2.900 1.000 1.000 peak 114 spectrum 1 weight 0.10000E+01 volume 0.56514E-02 ppm1 2.629 ppm2 6.676 CV 1
ASSI { 117}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 36 and name HZ3 ))
2.300 0.600 0.600 peak 117 spectrum 1 weight 0.10000E+01 volume 0.55747E-02 ppm1 2.269 ppm2 6.752 CV 1
ASSI { 121}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 65 and name HD2%)
2.500 0.800 0.800 peak 121 spectrum 1 weight 0.10000E+01 volume 0.55236E-02 ppm1 4.167 ppm2 0.864 CV 1
ASSI { 123}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 29 and name HD21))
1.800 0.400 0.400 peak 123 spectrum 1 weight 0.10000E+01 volume 0.54980E-02 ppm1 6.978 ppm2 7.747 CV 1
ASSI { 126}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HN ))
2.200 0.600 0.600 peak 126 spectrum 1 weight 0.11000E+01 volume 0.54724E-02 ppm1 5.558 ppm2 8.333 CV 1
ASSI { 129}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 36 and name HZ2 ))
2.400 0.700 0.700 peak 129 spectrum 1 weight 0.11000E+01 volume 0.53957E-02 ppm1 -0.653 ppm2 6.938 CV 1
ASSI { 130}
(( segid " " and resid 57 and name HA ))
( segid " " and resid 58 and name HD% )
2.400 2.400 3.600 peak 130 spectrum 1 weight 0.10000E+01 volume 0.53957E-02 ppm1 5.045 ppm2 6.834 CV 1
ASSI { 132}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HB1 ))
1.900 0.400 0.400 peak 132 spectrum 1 weight 0.10000E+01 volume 0.53190E-02 ppm1 2.591 ppm2 3.104 CV 1
ASSI { 133}
(( segid " " and resid 81 and name HA1 ))
(( segid " " and resid 81 and name HA2 ))
2.000 0.500 0.500 peak 133 spectrum 1 weight 0.10000E+01 volume 0.53190E-02 ppm1 4.239 ppm2 3.655 CV 1
ASSI { 134}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HN ))
2.200 0.600 0.600 peak 134 spectrum 1 weight 0.10000E+01 volume 0.52934E-02 ppm1 5.340 ppm2 8.493 CV 1
ASSI { 135}
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(( segid " " and resid 15 and name HN ))
2.400 0.700 0.700 peak 135 spectrum 1 weight 0.10000E+01 volume 0.52934E-02 ppm1 4.660 ppm2 8.472 CV 1
ASSI { 136}
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(( segid " " and resid 19 and name HN ))
2.500 0.800 0.800 peak 136 spectrum 1 weight 0.10000E+01 volume 0.52934E-02 ppm1 3.203 ppm2 8.617 CV 1
ASSI { 137}
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(( segid " " and resid 23 and name HN ))
2.200 0.600 0.600 peak 137 spectrum 1 weight 0.10000E+01 volume 0.52423E-02 ppm1 4.404 ppm2 8.722 CV 1
ASSI { 138}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 99 and name HB2 ))
2.300 0.600 0.600 peak 138 spectrum 1 weight 0.10000E+01 volume 0.51912E-02 ppm1 1.943 ppm2 2.514 CV 1
ASSI { 139}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 13 and name HN ))
2.400 0.700 0.700 peak 139 spectrum 1 weight 0.11000E+01 volume 0.51912E-02 ppm1 3.878 ppm2 8.267 CV 1
ASSI { 141}
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(( segid " " and resid 12 and name HN ))
2.300 0.700 0.700 peak 141 spectrum 1 weight 0.10000E+01 volume 0.51399E-02 ppm1 4.325 ppm2 8.493 CV 1
ASSI { 144}
(( segid " " and resid 38 and name HB1 ))
( segid " " and resid 38 and name HD% )
2.400 0.700 0.700 peak 144 spectrum 1 weight 0.10000E+01 volume 0.50888E-02 ppm1 3.469 ppm2 7.497 CV 1
ASSI { 145}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HB1 ))
1.800 0.400 0.400 peak 145 spectrum 1 weight 0.10000E+01 volume 0.50888E-02 ppm1 0.044 ppm2 2.268 CV 1
ASSI { 147}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 51 and name HD% )
2.500 0.800 0.800 peak 147 spectrum 1 weight 0.10000E+01 volume 0.50632E-02 ppm1 0.925 ppm2 6.657 CV 1
ASSI { 149}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 73 and name HN ))
2.100 0.500 0.500 peak 149 spectrum 1 weight 0.10000E+01 volume 0.50121E-02 ppm1 5.682 ppm2 9.608 CV 1
ASSI { 150}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HN ))
2.300 0.600 0.600 peak 150 spectrum 1 weight 0.10000E+01 volume 0.50121E-02 ppm1 5.370 ppm2 8.608 CV 1
ASSI { 152}
(( segid " " and resid 69 and name HA1 ))
(( segid " " and resid 70 and name HN ))
2.500 0.800 0.800 peak 152 spectrum 1 weight 0.10000E+01 volume 0.49866E-02 ppm1 4.422 ppm2 8.387 CV 1
ASSI { 156}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 80 and name HN ))
2.400 0.700 0.700 peak 156 spectrum 1 weight 0.10000E+01 volume 0.49099E-02 ppm1 4.695 ppm2 8.654 CV 1
ASSI { 157}
(( segid " " and resid 82 and name HB ))
(( segid " " and resid 82 and name HN ))
2.500 0.800 0.800 peak 157 spectrum 1 weight 0.10000E+01 volume 0.49099E-02 ppm1 3.861 ppm2 8.118 CV 1
ASSI { 159}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 11 and name HN ))
2.400 2.400 3.600 peak 159 spectrum 1 weight 0.10000E+01 volume 0.48331E-02 ppm1 3.987 ppm2 9.672 CV 1
ASSI { 160}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 38 and name HB2 ))
1.900 0.400 0.400 peak 160 spectrum 1 weight 0.10000E+01 volume 0.48331E-02 ppm1 3.468 ppm2 3.143 CV 1
ASSI { 162}
(( segid " " and resid 55 and name HD22))
(( segid " " and resid 55 and name HD21))
2.100 0.500 0.500 peak 162 spectrum 1 weight 0.10000E+01 volume 0.47564E-02 ppm1 5.753 ppm2 7.511 CV 1
ASSI { 164}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HB1 ))
2.200 0.600 0.600 peak 164 spectrum 1 weight 0.10000E+01 volume 0.47053E-02 ppm1 5.573 ppm2 2.264 CV 1
ASSI { 165}
(( segid " " and resid 51 and name HB1 ))
( segid " " and resid 51 and name HD% )
2.200 0.600 0.600 peak 165 spectrum 1 weight 0.10000E+01 volume 0.47053E-02 ppm1 2.893 ppm2 6.652 CV 1
ASSI { 170}
(( segid " " and resid 21 and name HB1 ))
(( segid " " and resid 21 and name HN ))
2.300 0.700 0.700 peak 170 spectrum 1 weight 0.10000E+01 volume 0.44751E-02 ppm1 1.609 ppm2 8.211 CV 1
ASSI { 173}
(( segid " " and resid 93 and name HZ2 ))
(( segid " " and resid 93 and name HE1 ))
2.400 0.700 0.700 peak 173 spectrum 1 weight 0.10000E+01 volume 0.43473E-02 ppm1 7.401 ppm2 10.262 CV 1
ASSI { 175}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HN ))
2.400 0.700 0.700 peak 175 spectrum 1 weight 0.11000E+01 volume 0.42961E-02 ppm1 5.557 ppm2 9.057 CV 1
ASSI { 176}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 21 and name HN ))
2.800 1.000 1.000 peak 176 spectrum 1 weight 0.10000E+01 volume 0.42961E-02 ppm1 4.288 ppm2 8.211 CV 1
ASSI { 178}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 65 and name HN ))
2.700 0.900 0.900 peak 178 spectrum 1 weight 0.10000E+01 volume 0.42705E-02 ppm1 4.347 ppm2 8.116 CV 1
ASSI { 179}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 72 and name HN ))
2.200 0.600 0.600 peak 179 spectrum 1 weight 0.10000E+01 volume 0.42194E-02 ppm1 5.067 ppm2 9.301 CV 1
ASSI { 180}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 102 and name HG1 ))
2.200 0.600 0.600 peak 180 spectrum 1 weight 0.10000E+01 volume 0.42194E-02 ppm1 5.341 ppm2 1.694 CV 1
ASSI { 183}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 18 and name HN ))
2.400 0.700 0.700 peak 183 spectrum 1 weight 0.10000E+01 volume 0.41171E-02 ppm1 5.086 ppm2 8.412 CV 1
ASSI { 185}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name HN ))
2.500 0.800 0.800 peak 185 spectrum 1 weight 0.11000E+01 volume 0.40916E-02 ppm1 5.078 ppm2 8.826 CV 1
ASSI { 186}
(( segid " " and resid 27 and name HD1 ))
(( segid " " and resid 7 and name HN ))
2.200 0.600 0.600 peak 186 spectrum 1 weight 0.10000E+01 volume 0.40916E-02 ppm1 4.041 ppm2 8.915 CV 1
ASSI { 191}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 17 and name HN ))
2.400 0.700 0.700 peak 191 spectrum 1 weight 0.10000E+01 volume 0.40404E-02 ppm1 4.603 ppm2 8.378 CV 1
ASSI { 192}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 65 and name HN ))
3.000 1.100 1.100 peak 192 spectrum 1 weight 0.10000E+01 volume 0.40148E-02 ppm1 0.871 ppm2 8.116 CV 1
OR { 192}
( segid " " and resid 64 and name HD2%)
(( segid " " and resid 65 and name HN ))
ASSI { 196}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HN ))
2.500 0.800 0.800 peak 196 spectrum 1 weight 0.11000E+01 volume 0.39381E-02 ppm1 4.813 ppm2 8.889 CV 1
ASSI { 199}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 84 and name HB% )
2.500 0.800 0.800 peak 199 spectrum 1 weight 0.10000E+01 volume 0.39125E-02 ppm1 4.500 ppm2 1.346 CV 1
ASSI { 202}
(( segid " " and resid 51 and name HB2 ))
( segid " " and resid 51 and name HD% )
2.700 0.900 0.900 peak 202 spectrum 1 weight 0.10000E+01 volume 0.38614E-02 ppm1 2.698 ppm2 6.652 CV 1
ASSI { 203}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 86 and name HN ))
2.300 0.600 0.600 peak 203 spectrum 1 weight 0.10000E+01 volume 0.38614E-02 ppm1 3.994 ppm2 8.768 CV 1
ASSI { 207}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 18 and name HG1%)
2.700 0.900 0.900 peak 207 spectrum 1 weight 0.10000E+01 volume 0.38358E-02 ppm1 4.460 ppm2 0.743 CV 1
ASSI { 208}
( segid " " and resid 80 and name HB% )
(( segid " " and resid 80 and name HN ))
2.600 0.800 0.800 peak 208 spectrum 1 weight 0.10000E+01 volume 0.37847E-02 ppm1 1.409 ppm2 8.654 CV 1
ASSI { 209}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 66 and name HN ))
2.500 0.800 0.800 peak 209 spectrum 1 weight 0.10000E+01 volume 0.37847E-02 ppm1 4.167 ppm2 8.663 CV 1
ASSI { 210}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HA ))
2.700 0.900 0.900 peak 210 spectrum 1 weight 0.10000E+01 volume 0.37591E-02 ppm1 2.138 ppm2 5.561 CV 1
ASSI { 212}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HN ))
2.400 0.700 0.700 peak 212 spectrum 1 weight 0.11000E+01 volume 0.37079E-02 ppm1 5.095 ppm2 9.141 CV 1
ASSI { 216}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 93 and name HN ))
2.500 0.800 0.800 peak 216 spectrum 1 weight 0.10000E+01 volume 0.37079E-02 ppm1 1.373 ppm2 6.881 CV 1
ASSI { 219}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 68 and name HN ))
2.700 0.900 0.900 peak 219 spectrum 1 weight 0.10000E+01 volume 0.36568E-02 ppm1 4.353 ppm2 8.340 CV 1
ASSI { 220}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 53 and name HG1%)
2.700 0.900 0.900 peak 220 spectrum 1 weight 0.10000E+01 volume 0.36568E-02 ppm1 5.370 ppm2 1.374 CV 1
ASSI { 221}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 60 and name HG1 ))
2.400 0.700 0.700 peak 221 spectrum 1 weight 0.10000E+01 volume 0.36312E-02 ppm1 3.570 ppm2 2.014 CV 1
ASSI { 223}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HN ))
2.500 0.800 0.800 peak 223 spectrum 1 weight 0.10000E+01 volume 0.36057E-02 ppm1 4.399 ppm2 8.263 CV 1
ASSI { 224}
(( segid " " and resid 4 and name HB1 ))
(( segid " " and resid 4 and name HN ))
2.600 0.900 0.900 peak 224 spectrum 1 weight 0.10000E+01 volume 0.36057E-02 ppm1 1.660 ppm2 8.545 CV 1
ASSI { 226}
(( segid " " and resid 19 and name HA2 ))
(( segid " " and resid 19 and name HN ))
2.400 0.700 0.700 peak 226 spectrum 1 weight 0.10000E+01 volume 0.35545E-02 ppm1 3.564 ppm2 8.616 CV 1
ASSI { 227}
(( segid " " and resid 11 and name HA2 ))
(( segid " " and resid 11 and name HN ))
2.800 1.000 1.000 peak 227 spectrum 1 weight 0.10000E+01 volume 0.35290E-02 ppm1 3.359 ppm2 9.671 CV 1
ASSI { 234}
(( segid " " and resid 46 and name HG1 ))
(( segid " " and resid 46 and name HD1 ))
2.300 0.600 0.600 peak 234 spectrum 1 weight 0.10000E+01 volume 0.34522E-02 ppm1 2.015 ppm2 3.197 CV 1
ASSI { 235}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 29 and name HN ))
2.500 0.800 0.800 peak 235 spectrum 1 weight 0.10000E+01 volume 0.34266E-02 ppm1 4.142 ppm2 8.219 CV 1
ASSI { 240}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 18 and name HN ))
2.600 0.800 0.800 peak 240 spectrum 1 weight 0.10000E+01 volume 0.34011E-02 ppm1 0.750 ppm2 8.413 CV 1
ASSI { 241}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 72 and name HB1 ))
1.800 0.400 0.400 peak 241 spectrum 1 weight 0.10000E+01 volume 0.34011E-02 ppm1 2.677 ppm2 3.047 CV 1
ASSI { 242}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 78 and name HN ))
2.400 0.700 0.700 peak 242 spectrum 1 weight 0.10000E+01 volume 0.33755E-02 ppm1 3.815 ppm2 8.559 CV 1
ASSI { 243}
(( segid " " and resid 103 and name HB2 ))
( segid " " and resid 103 and name HD% )
2.400 0.700 0.700 peak 243 spectrum 1 weight 0.10000E+01 volume 0.33755E-02 ppm1 2.255 ppm2 6.689 CV 1
ASSI { 247}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HB1 ))
2.400 0.700 0.700 peak 247 spectrum 1 weight 0.10000E+01 volume 0.33244E-02 ppm1 4.309 ppm2 2.141 CV 1
ASSI { 251}
(( segid " " and resid 38 and name HB1 ))
( segid " " and resid 37 and name HD% )
2.500 2.500 3.500 peak 251 spectrum 1 weight 0.10000E+01 volume 0.32732E-02 ppm1 3.491 ppm2 6.833 CV 1
ASSI { 252}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 13 and name HN ))
3.200 1.300 1.300 peak 252 spectrum 1 weight 0.10000E+01 volume 0.32732E-02 ppm1 0.959 ppm2 8.272 CV 1
ASSI { 253}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 91 and name HD1 ))
2.500 0.800 0.800 peak 253 spectrum 1 weight 0.10000E+01 volume 0.32477E-02 ppm1 0.342 ppm2 2.603 CV 1
ASSI { 254}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 38 and name HD% )
2.500 0.800 0.800 peak 254 spectrum 1 weight 0.11000E+01 volume 0.32477E-02 ppm1 -0.807 ppm2 7.499 CV 1
ASSI { 255}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 89 and name HN ))
2.200 0.600 0.600 peak 255 spectrum 1 weight 0.10000E+01 volume 0.32477E-02 ppm1 5.163 ppm2 8.539 CV 1
ASSI { 256}
(( segid " " and resid 86 and name HB1 ))
(( segid " " and resid 86 and name HN ))
2.900 1.000 1.000 peak 256 spectrum 1 weight 0.10000E+01 volume 0.32221E-02 ppm1 2.704 ppm2 8.767 CV 1
ASSI { 260}
(( segid " " and resid 71 and name HG2 ))
( segid " " and resid 58 and name HD% )
3.000 3.000 3.000 peak 260 spectrum 1 weight 0.10000E+01 volume 0.31965E-02 ppm1 2.311 ppm2 6.834 CV 1
ASSI { 262}
(( segid " " and resid 108 and name HB1 ))
(( segid " " and resid 108 and name HN ))
2.400 0.700 0.700 peak 262 spectrum 1 weight 0.10000E+01 volume 0.31709E-02 ppm1 1.785 ppm2 9.147 CV 1
ASSI { 263}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 53 and name HB ))
2.600 0.800 0.800 peak 263 spectrum 1 weight 0.10000E+01 volume 0.31453E-02 ppm1 1.374 ppm2 2.173 CV 1
ASSI { 264}
(( segid " " and resid 33 and name HA2 ))
(( segid " " and resid 33 and name HN ))
2.700 0.900 0.900 peak 264 spectrum 1 weight 0.10000E+01 volume 0.31453E-02 ppm1 3.695 ppm2 7.831 CV 1
ASSI { 265}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 79 and name HN ))
2.800 2.800 3.200 peak 265 spectrum 1 weight 0.10000E+01 volume 0.31453E-02 ppm1 0.943 ppm2 7.322 CV 1
ASSI { 267}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 87 and name HN ))
2.800 1.000 1.000 peak 267 spectrum 1 weight 0.10000E+01 volume 0.31198E-02 ppm1 1.484 ppm2 9.332 CV 1
ASSI { 268}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 73 and name HN ))
3.100 1.200 1.200 peak 268 spectrum 1 weight 0.10000E+01 volume 0.30942E-02 ppm1 1.372 ppm2 9.601 CV 1
ASSI { 270}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 73 and name HB2 ))
2.400 0.700 0.700 peak 270 spectrum 1 weight 0.10000E+01 volume 0.30942E-02 ppm1 -0.465 ppm2 2.593 CV 1
ASSI { 271}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HB2 ))
2.700 0.900 0.900 peak 271 spectrum 1 weight 0.10000E+01 volume 0.30942E-02 ppm1 5.080 ppm2 1.876 CV 1
ASSI { 275}
( segid " " and resid 85 and name HG2%)
( segid " " and resid 105 and name HG1%)
2.600 0.900 0.900 peak 275 spectrum 1 weight 0.10000E+01 volume 0.30175E-02 ppm1 0.271 ppm2 0.820 CV 1
ASSI { 276}
(( segid " " and resid 88 and name HB ))
( segid " " and resid 88 and name HG2%)
2.500 0.800 0.800 peak 276 spectrum 1 weight 0.10000E+01 volume 0.29920E-02 ppm1 3.842 ppm2 1.092 CV 1
ASSI { 277}
(( segid " " and resid 43 and name HG1 ))
( segid " " and resid 38 and name HD% )
3.000 1.100 1.100 peak 277 spectrum 1 weight 0.10000E+01 volume 0.29920E-02 ppm1 1.166 ppm2 7.509 CV 1
ASSI { 280}
(( segid " " and resid 49 and name HB1 ))
(( segid " " and resid 49 and name HN ))
2.800 0.900 0.900 peak 280 spectrum 1 weight 0.11000E+01 volume 0.29408E-02 ppm1 3.792 ppm2 7.988 CV 1
ASSI { 281}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 16 and name HN ))
2.700 0.900 0.900 peak 281 spectrum 1 weight 0.10000E+01 volume 0.29408E-02 ppm1 0.509 ppm2 8.647 CV 1
ASSI { 282}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 28 and name HN ))
2.600 0.800 0.800 peak 282 spectrum 1 weight 0.10000E+01 volume 0.29152E-02 ppm1 4.832 ppm2 8.340 CV 1
ASSI { 285}
( segid " " and resid 79 and name HB% )
(( segid " " and resid 79 and name HN ))
2.700 0.900 0.900 peak 285 spectrum 1 weight 0.10000E+01 volume 0.29152E-02 ppm1 1.566 ppm2 7.324 CV 1
ASSI { 288}
( segid " " and resid 77 and name HG2%)
( segid " " and resid 51 and name HD% )
3.400 1.400 1.400 peak 288 spectrum 1 weight 0.10000E+01 volume 0.29152E-02 ppm1 0.844 ppm2 6.638 CV 1
ASSI { 289}
(( segid " " and resid 37 and name HB1 ))
( segid " " and resid 37 and name HD% )
2.500 0.800 0.800 peak 289 spectrum 1 weight 0.10000E+01 volume 0.29152E-02 ppm1 3.431 ppm2 6.831 CV 1
ASSI { 291}
(( segid " " and resid 23 and name HA ))
( segid " " and resid 21 and name HD1%)
2.800 1.000 1.000 peak 291 spectrum 1 weight 0.10000E+01 volume 0.28896E-02 ppm1 4.946 ppm2 0.657 CV 1
ASSI { 294}
(( segid " " and resid 68 and name HA1 ))
(( segid " " and resid 68 and name HN ))
2.700 0.900 0.900 peak 294 spectrum 1 weight 0.10000E+01 volume 0.28896E-02 ppm1 4.012 ppm2 8.340 CV 1
ASSI { 295}
(( segid " " and resid 110 and name HA ))
( segid " " and resid 80 and name HB% )
3.000 1.100 1.100 peak 295 spectrum 1 weight 0.10000E+01 volume 0.28896E-02 ppm1 4.533 ppm2 1.409 CV 1
ASSI { 299}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HB1 ))
2.400 0.700 0.700 peak 299 spectrum 1 weight 0.10000E+01 volume 0.28385E-02 ppm1 4.832 ppm2 2.406 CV 1
ASSI { 301}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 14 and name HN ))
3.000 1.100 1.100 peak 301 spectrum 1 weight 0.10000E+01 volume 0.27874E-02 ppm1 0.581 ppm2 9.241 CV 1
ASSI { 302}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 109 and name HB% )
3.000 1.100 1.100 peak 302 spectrum 1 weight 0.10000E+01 volume 0.27874E-02 ppm1 0.271 ppm2 1.316 CV 1
ASSI { 304}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 86 and name HD22))
3.300 1.300 1.300 peak 304 spectrum 1 weight 0.10000E+01 volume 0.27874E-02 ppm1 0.587 ppm2 6.648 CV 1
ASSI { 308}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 107 and name HB2 ))
2.700 0.900 0.900 peak 308 spectrum 1 weight 0.10000E+01 volume 0.27618E-02 ppm1 4.949 ppm2 1.006 CV 1
ASSI { 309}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 53 and name HN ))
3.200 1.300 1.300 peak 309 spectrum 1 weight 0.10000E+01 volume 0.27618E-02 ppm1 4.341 ppm2 8.889 CV 1
ASSI { 310}
(( segid " " and resid 19 and name HA2 ))
(( segid " " and resid 78 and name HD1 ))
3.000 3.000 3.000 peak 310 spectrum 1 weight 0.10000E+01 volume 0.27107E-02 ppm1 3.583 ppm2 1.540 CV 1
ASSI { 312}
(( segid " " and resid 66 and name HA1 ))
(( segid " " and resid 66 and name HN ))
2.700 0.900 0.900 peak 312 spectrum 1 weight 0.10000E+01 volume 0.26851E-02 ppm1 3.995 ppm2 8.658 CV 1
ASSI { 313}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HN ))
2.700 0.900 0.900 peak 313 spectrum 1 weight 0.10000E+01 volume 0.26851E-02 ppm1 4.445 ppm2 9.016 CV 1
ASSI { 314}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 22 and name HN ))
2.500 0.800 0.800 peak 314 spectrum 1 weight 0.10000E+01 volume 0.26851E-02 ppm1 1.969 ppm2 9.384 CV 1
ASSI { 315}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 106 and name HD% )
2.800 1.000 1.000 peak 315 spectrum 1 weight 0.10000E+01 volume 0.26851E-02 ppm1 4.502 ppm2 6.700 CV 1
ASSI { 317}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HN ))
2.900 1.000 1.000 peak 317 spectrum 1 weight 0.10000E+01 volume 0.26595E-02 ppm1 4.136 ppm2 8.340 CV 1
ASSI { 320}
(( segid " " and resid 79 and name HA ))
(( segid " " and resid 79 and name HN ))
2.600 0.900 0.900 peak 320 spectrum 1 weight 0.10000E+01 volume 0.26595E-02 ppm1 4.696 ppm2 7.325 CV 1
ASSI { 321}
(( segid " " and resid 46 and name HG1 ))
(( segid " " and resid 46 and name HD2 ))
2.700 0.900 0.900 peak 321 spectrum 1 weight 0.10000E+01 volume 0.26595E-02 ppm1 2.009 ppm2 2.658 CV 1
ASSI { 323}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HN ))
2.500 0.800 0.800 peak 323 spectrum 1 weight 0.10000E+01 volume 0.26339E-02 ppm1 4.938 ppm2 8.720 CV 1
ASSI { 324}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 42 and name HN ))
3.100 1.200 1.200 peak 324 spectrum 1 weight 0.10000E+01 volume 0.26339E-02 ppm1 1.224 ppm2 7.294 CV 1
ASSI { 325}
(( segid " " and resid 89 and name HB1 ))
(( segid " " and resid 89 and name HN ))
2.500 0.800 0.800 peak 325 spectrum 1 weight 0.10000E+01 volume 0.26339E-02 ppm1 2.270 ppm2 8.538 CV 1
ASSI { 328}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 73 and name HB1 ))
2.800 1.000 1.000 peak 328 spectrum 1 weight 0.10000E+01 volume 0.26339E-02 ppm1 1.753 ppm2 2.817 CV 1
ASSI { 329}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HD1 ))
2.400 0.700 0.700 peak 329 spectrum 1 weight 0.10000E+01 volume 0.26083E-02 ppm1 -0.117 ppm2 2.602 CV 1
ASSI { 330}
(( segid " " and resid 74 and name HB1 ))
(( segid " " and resid 74 and name HN ))
3.300 1.400 1.400 peak 330 spectrum 1 weight 0.10000E+01 volume 0.26083E-02 ppm1 3.234 ppm2 9.597 CV 1
ASSI { 333}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 25 and name HE22))
3.200 1.300 1.300 peak 333 spectrum 1 weight 0.10000E+01 volume 0.25828E-02 ppm1 1.851 ppm2 6.647 CV 1
ASSI { 334}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HN ))
2.400 0.700 0.700 peak 334 spectrum 1 weight 0.10000E+01 volume 0.25828E-02 ppm1 7.335 ppm2 7.987 CV 1
ASSI { 335}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HB1 ))
2.600 0.800 0.800 peak 335 spectrum 1 weight 0.10000E+01 volume 0.25572E-02 ppm1 -0.464 ppm2 1.485 CV 1
ASSI { 336}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 105 and name HN ))
3.000 1.100 1.100 peak 336 spectrum 1 weight 0.10000E+01 volume 0.25521E-02 ppm1 0.432 ppm2 7.822 CV 1
ASSI { 339}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 85 and name HN ))
2.600 0.800 0.800 peak 339 spectrum 1 weight 0.10000E+01 volume 0.25469E-02 ppm1 0.262 ppm2 8.593 CV 1
ASSI { 342}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HE3 ))
2.700 0.900 0.900 peak 342 spectrum 1 weight 0.10000E+01 volume 0.25189E-02 ppm1 6.887 ppm2 7.556 CV 1
ASSI { 343}
(( segid " " and resid 68 and name HA1 ))
(( segid " " and resid 69 and name HN ))
2.900 1.100 1.100 peak 343 spectrum 1 weight 0.10000E+01 volume 0.25137E-02 ppm1 4.013 ppm2 8.220 CV 1
ASSI { 345}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HB1 ))
2.300 0.700 0.700 peak 345 spectrum 1 weight 0.10000E+01 volume 0.25061E-02 ppm1 3.788 ppm2 3.942 CV 1
ASSI { 350}
(( segid " " and resid 63 and name HD1 ))
(( segid " " and resid 61 and name HB1 ))
2.900 1.100 1.100 peak 350 spectrum 1 weight 0.10000E+01 volume 0.24932E-02 ppm1 1.654 ppm2 2.631 CV 1
ASSI { 351}
( segid " " and resid 32 and name HG2%)
( segid " " and resid 34 and name HE% )
2.700 0.900 0.900 peak 351 spectrum 1 weight 0.10000E+01 volume 0.24932E-02 ppm1 1.299 ppm2 7.114 CV 1
ASSI { 352}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 40 and name HN ))
2.300 0.700 0.700 peak 352 spectrum 1 weight 0.10000E+01 volume 0.24882E-02 ppm1 3.787 ppm2 8.915 CV 1
ASSI { 356}
(( segid " " and resid 103 and name HA ))
( segid " " and resid 103 and name HD% )
2.900 1.000 1.000 peak 356 spectrum 1 weight 0.10000E+01 volume 0.24600E-02 ppm1 4.692 ppm2 6.689 CV 1
ASSI { 359}
(( segid " " and resid 1 and name HA ))
(( segid " " and resid 2 and name HN ))
2.700 0.900 0.900 peak 359 spectrum 1 weight 0.10000E+01 volume 0.24549E-02 ppm1 4.501 ppm2 8.330 CV 1
ASSI { 360}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HN ))
3.000 1.100 1.100 peak 360 spectrum 1 weight 0.10000E+01 volume 0.24294E-02 ppm1 4.470 ppm2 8.054 CV 1
ASSI { 364}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 51 and name HB2 ))
2.900 1.000 1.000 peak 364 spectrum 1 weight 0.10000E+01 volume 0.24063E-02 ppm1 3.814 ppm2 2.701 CV 1
ASSI { 365}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 24 and name HG11))
2.400 0.700 0.700 peak 365 spectrum 1 weight 0.10000E+01 volume 0.24038E-02 ppm1 0.263 ppm2 1.544 CV 1
ASSI { 366}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 25 and name HN ))
3.000 1.100 1.100 peak 366 spectrum 1 weight 0.10000E+01 volume 0.23961E-02 ppm1 1.094 ppm2 8.419 CV 1
ASSI { 368}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 46 and name HD1 ))
3.100 1.200 1.200 peak 368 spectrum 1 weight 0.10000E+01 volume 0.23936E-02 ppm1 0.943 ppm2 3.197 CV 1
ASSI { 372}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
3.100 1.200 1.200 peak 372 spectrum 1 weight 0.11000E+01 volume 0.23757E-02 ppm1 7.957 ppm2 9.140 CV 1
ASSI { 382}
(( segid " " and resid 95 and name HA1 ))
(( segid " " and resid 95 and name HN ))
2.600 0.900 0.900 peak 382 spectrum 1 weight 0.10000E+01 volume 0.23424E-02 ppm1 4.208 ppm2 7.585 CV 1
ASSI { 386}
(( segid " " and resid 50 and name HG1 ))
( segid " " and resid 51 and name HD% )
2.600 2.600 3.400 peak 386 spectrum 1 weight 0.10000E+01 volume 0.23245E-02 ppm1 2.770 ppm2 6.654 CV 1
ASSI { 389}
(( segid " " and resid 11 and name HA1 ))
(( segid " " and resid 11 and name HN ))
2.700 0.900 0.900 peak 389 spectrum 1 weight 0.10000E+01 volume 0.23066E-02 ppm1 4.228 ppm2 9.673 CV 1
ASSI { 391}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HN ))
2.700 0.900 0.900 peak 391 spectrum 1 weight 0.10000E+01 volume 0.23040E-02 ppm1 4.349 ppm2 7.778 CV 1
ASSI { 392}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 43 and name HN ))
2.800 1.000 1.000 peak 392 spectrum 1 weight 0.10000E+01 volume 0.23040E-02 ppm1 4.407 ppm2 9.141 CV 1
ASSI { 395}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 102 and name HN ))
2.800 1.000 1.000 peak 395 spectrum 1 weight 0.10000E+01 volume 0.22938E-02 ppm1 1.993 ppm2 8.490 CV 1
ASSI { 396}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HN ))
2.700 0.900 0.900 peak 396 spectrum 1 weight 0.10000E+01 volume 0.22887E-02 ppm1 3.990 ppm2 7.260 CV 1
ASSI { 397}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 26 and name HN ))
3.100 1.200 1.200 peak 397 spectrum 1 weight 0.10000E+01 volume 0.22836E-02 ppm1 0.514 ppm2 8.552 CV 1
ASSI { 398}
( segid " " and resid 79 and name HB% )
(( segid " " and resid 47 and name HB1 ))
2.800 0.900 0.900 peak 398 spectrum 1 weight 0.10000E+01 volume 0.22811E-02 ppm1 1.564 ppm2 2.631 CV 1
ASSI { 401}
(( segid " " and resid 45 and name HB1 ))
( segid " " and resid 53 and name HG1%)
3.000 1.100 1.100 peak 401 spectrum 1 weight 0.10000E+01 volume 0.22759E-02 ppm1 3.988 ppm2 1.319 CV 1
ASSI { 402}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 85 and name HN ))
3.000 1.100 1.100 peak 402 spectrum 1 weight 0.10000E+01 volume 0.22733E-02 ppm1 5.078 ppm2 8.559 CV 1
ASSI { 403}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 9 and name HB1 ))
2.500 0.800 0.800 peak 403 spectrum 1 weight 0.10000E+01 volume 0.22733E-02 ppm1 1.536 ppm2 3.466 CV 1
ASSI { 406}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 59 and name HD1 ))
2.500 0.800 0.800 peak 406 spectrum 1 weight 0.10000E+01 volume 0.22580E-02 ppm1 2.048 ppm2 3.668 CV 1
ASSI { 408}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 50 and name HN ))
2.700 0.900 0.900 peak 408 spectrum 1 weight 0.11000E+01 volume 0.22529E-02 ppm1 4.456 ppm2 7.328 CV 1
ASSI { 409}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 30 and name HG2 ))
2.500 0.800 0.800 peak 409 spectrum 1 weight 0.10000E+01 volume 0.22503E-02 ppm1 3.583 ppm2 1.235 CV 1
ASSI { 410}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 27 and name HG1 ))
2.700 0.900 0.900 peak 410 spectrum 1 weight 0.10000E+01 volume 0.22453E-02 ppm1 3.368 ppm2 2.182 CV 1
ASSI { 413}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 83 and name HN ))
2.800 1.000 1.000 peak 413 spectrum 1 weight 0.10000E+01 volume 0.22274E-02 ppm1 2.792 ppm2 9.029 CV 1
ASSI { 416}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 106 and name HD% )
3.100 1.200 1.200 peak 416 spectrum 1 weight 0.10000E+01 volume 0.22197E-02 ppm1 5.323 ppm2 6.688 CV 1
ASSI { 417}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 61 and name HN ))
2.900 1.000 1.000 peak 417 spectrum 1 weight 0.10000E+01 volume 0.22069E-02 ppm1 2.631 ppm2 8.386 CV 1
ASSI { 418}
(( segid " " and resid 95 and name HA2 ))
(( segid " " and resid 95 and name HN ))
2.200 0.600 0.600 peak 418 spectrum 1 weight 0.10000E+01 volume 0.22018E-02 ppm1 3.776 ppm2 7.585 CV 1
ASSI { 419}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 5 and name HN ))
3.000 1.100 1.100 peak 419 spectrum 1 weight 0.10000E+01 volume 0.22018E-02 ppm1 0.541 ppm2 8.941 CV 1
ASSI { 420}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 26 and name HB1 ))
2.500 0.800 0.800 peak 420 spectrum 1 weight 0.10000E+01 volume 0.21966E-02 ppm1 -0.653 ppm2 0.513 CV 1
ASSI { 422}
(( segid " " and resid 66 and name HA1 ))
(( segid " " and resid 67 and name HN ))
2.700 0.900 0.900 peak 422 spectrum 1 weight 0.10000E+01 volume 0.21940E-02 ppm1 4.013 ppm2 7.675 CV 1
ASSI { 423}
(( segid " " and resid 30 and name HD1 ))
(( segid " " and resid 30 and name HG2 ))
3.000 1.100 1.100 peak 423 spectrum 1 weight 0.10000E+01 volume 0.21813E-02 ppm1 3.885 ppm2 1.232 CV 1
ASSI { 424}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 91 and name HD1 ))
2.600 0.800 0.800 peak 424 spectrum 1 weight 0.10000E+01 volume 0.21787E-02 ppm1 0.746 ppm2 2.599 CV 1
ASSI { 430}
(( segid " " and resid 81 and name HA2 ))
(( segid " " and resid 81 and name HN ))
2.900 1.000 1.000 peak 430 spectrum 1 weight 0.10000E+01 volume 0.21506E-02 ppm1 3.673 ppm2 8.450 CV 1
ASSI { 432}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 38 and name HN ))
3.100 1.200 1.200 peak 432 spectrum 1 weight 0.10000E+01 volume 0.21455E-02 ppm1 7.497 ppm2 8.962 CV 1
ASSI { 434}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 10 and name HN ))
2.600 0.900 0.900 peak 434 spectrum 1 weight 0.10000E+01 volume 0.21302E-02 ppm1 3.108 ppm2 7.259 CV 1
ASSI { 435}
(( segid " " and resid 103 and name HB1 ))
( segid " " and resid 103 and name HD% )
2.600 0.900 0.900 peak 435 spectrum 1 weight 0.10000E+01 volume 0.21302E-02 ppm1 2.590 ppm2 6.686 CV 1
ASSI { 436}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 92 and name HB1 ))
2.600 0.800 0.800 peak 436 spectrum 1 weight 0.10000E+01 volume 0.21225E-02 ppm1 3.577 ppm2 1.680 CV 1
ASSI { 437}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 91 and name HN ))
2.400 0.700 0.700 peak 437 spectrum 1 weight 0.10000E+01 volume 0.21199E-02 ppm1 4.651 ppm2 7.630 CV 1
ASSI { 438}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 75 and name HN ))
2.700 0.900 0.900 peak 438 spectrum 1 weight 0.10000E+01 volume 0.21199E-02 ppm1 0.917 ppm2 9.789 CV 1
ASSI { 440}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 71 and name HN ))
2.400 0.700 0.700 peak 440 spectrum 1 weight 0.10000E+01 volume 0.21173E-02 ppm1 1.874 ppm2 9.593 CV 1
ASSI { 444}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 9 and name HB2 ))
2.300 0.700 0.700 peak 444 spectrum 1 weight 0.10000E+01 volume 0.20944E-02 ppm1 0.844 ppm2 3.287 CV 1
ASSI { 446}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 90 and name HG1 ))
3.000 1.200 1.200 peak 446 spectrum 1 weight 0.10000E+01 volume 0.20867E-02 ppm1 4.503 ppm2 2.511 CV 1
ASSI { 452}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HN ))
2.600 0.800 0.800 peak 452 spectrum 1 weight 0.10000E+01 volume 0.20713E-02 ppm1 3.015 ppm2 9.599 CV 1
ASSI { 455}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 57 and name HN ))
3.100 1.200 1.200 peak 455 spectrum 1 weight 0.10000E+01 volume 0.20611E-02 ppm1 3.101 ppm2 8.426 CV 1
ASSI { 456}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 25 and name HE22))
3.400 3.400 2.600 peak 456 spectrum 1 weight 0.10000E+01 volume 0.20534E-02 ppm1 3.912 ppm2 6.636 CV 1
ASSI { 457}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HB2 ))
2.600 0.800 0.800 peak 457 spectrum 1 weight 0.10000E+01 volume 0.20509E-02 ppm1 -0.463 ppm2 1.243 CV 1
ASSI { 458}
(( segid " " and resid 41 and name HA1 ))
( segid " " and resid 37 and name HD% )
3.600 1.600 1.600 peak 458 spectrum 1 weight 0.10000E+01 volume 0.20483E-02 ppm1 3.878 ppm2 6.835 CV 1
ASSI { 459}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 43 and name HN ))
3.300 1.400 1.400 peak 459 spectrum 1 weight 0.10000E+01 volume 0.20407E-02 ppm1 1.230 ppm2 9.144 CV 1
ASSI { 460}
(( segid " " and resid 73 and name HB2 ))
(( segid " " and resid 73 and name HN ))
2.600 0.800 0.800 peak 460 spectrum 1 weight 0.10000E+01 volume 0.20381E-02 ppm1 2.590 ppm2 9.601 CV 1
ASSI { 461}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB1 ))
2.900 1.000 1.000 peak 461 spectrum 1 weight 0.10000E+01 volume 0.20356E-02 ppm1 4.658 ppm2 1.302 CV 1
ASSI { 462}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 83 and name HD2 ))
3.500 1.500 1.500 peak 462 spectrum 1 weight 0.11000E+01 volume 0.20330E-02 ppm1 3.585 ppm2 6.717 CV 1
ASSI { 463}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HN ))
2.300 0.700 0.700 peak 463 spectrum 1 weight 0.10000E+01 volume 0.20304E-02 ppm1 3.144 ppm2 8.965 CV 1
ASSI { 464}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 22 and name HN ))
3.100 1.200 1.200 peak 464 spectrum 1 weight 0.10000E+01 volume 0.20278E-02 ppm1 0.820 ppm2 9.381 CV 1
ASSI { 465}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HN ))
2.600 0.900 0.900 peak 465 spectrum 1 weight 0.10000E+01 volume 0.20177E-02 ppm1 4.117 ppm2 8.914 CV 1
ASSI { 467}
(( segid " " and resid 51 and name HB1 ))
( segid " " and resid 51 and name HE% )
3.300 1.400 1.400 peak 467 spectrum 1 weight 0.10000E+01 volume 0.20125E-02 ppm1 2.908 ppm2 7.113 CV 1
ASSI { 469}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 102 and name HB1 ))
3.700 1.700 1.700 peak 469 spectrum 1 weight 0.10000E+01 volume 0.20125E-02 ppm1 1.095 ppm2 2.009 CV 1
ASSI { 473}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 16 and name HN ))
2.800 1.000 1.000 peak 473 spectrum 1 weight 0.10000E+01 volume 0.19946E-02 ppm1 4.605 ppm2 8.642 CV 1
ASSI { 476}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HN ))
3.300 1.300 1.300 peak 476 spectrum 1 weight 0.10000E+01 volume 0.19869E-02 ppm1 3.221 ppm2 6.883 CV 1
ASSI { 477}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 89 and name HN ))
2.600 0.800 0.800 peak 477 spectrum 1 weight 0.11000E+01 volume 0.19819E-02 ppm1 0.043 ppm2 8.536 CV 1
ASSI { 479}
(( segid " " and resid 76 and name HB ))
(( segid " " and resid 52 and name HN ))
2.800 1.000 1.000 peak 479 spectrum 1 weight 0.10000E+01 volume 0.19716E-02 ppm1 4.040 ppm2 8.825 CV 1
ASSI { 480}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 108 and name HG1 ))
3.300 1.300 1.300 peak 480 spectrum 1 weight 0.10000E+01 volume 0.19614E-02 ppm1 0.271 ppm2 1.217 CV 1
ASSI { 481}
( segid " " and resid 104 and name HG2%)
( segid " " and resid 106 and name HE% )
2.900 1.000 1.000 peak 481 spectrum 1 weight 0.10000E+01 volume 0.19588E-02 ppm1 0.431 ppm2 6.576 CV 1
ASSI { 482}
(( segid " " and resid 73 and name HB1 ))
(( segid " " and resid 73 and name HN ))
3.200 1.300 1.300 peak 482 spectrum 1 weight 0.10000E+01 volume 0.19563E-02 ppm1 2.820 ppm2 9.604 CV 1
ASSI { 484}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HN ))
3.300 1.300 1.300 peak 484 spectrum 1 weight 0.10000E+01 volume 0.19461E-02 ppm1 1.761 ppm2 8.493 CV 1
ASSI { 486}
(( segid " " and resid 108 and name HA ))
(( segid " " and resid 108 and name HN ))
2.700 0.900 0.900 peak 486 spectrum 1 weight 0.10000E+01 volume 0.19384E-02 ppm1 4.780 ppm2 9.141 CV 1
ASSI { 487}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 30 and name HB1 ))
2.900 1.100 1.100 peak 487 spectrum 1 weight 0.10000E+01 volume 0.19384E-02 ppm1 1.239 ppm2 2.112 CV 1
ASSI { 489}
( segid " " and resid 34 and name HD% )
(( segid " " and resid 34 and name HN ))
2.800 1.000 1.000 peak 489 spectrum 1 weight 0.10000E+01 volume 0.19358E-02 ppm1 6.501 ppm2 7.551 CV 1
ASSI { 491}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 72 and name HN ))
2.900 1.100 1.100 peak 491 spectrum 1 weight 0.10000E+01 volume 0.19282E-02 ppm1 3.049 ppm2 9.301 CV 1
ASSI { 493}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 105 and name HN ))
3.100 1.200 1.200 peak 493 spectrum 1 weight 0.10000E+01 volume 0.19179E-02 ppm1 0.673 ppm2 7.819 CV 1
ASSI { 494}
(( segid " " and resid 101 and name HB1 ))
(( segid " " and resid 101 and name HN ))
2.800 0.900 0.900 peak 494 spectrum 1 weight 0.10000E+01 volume 0.19153E-02 ppm1 1.944 ppm2 8.720 CV 1
ASSI { 495}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HN ))
2.900 1.100 1.100 peak 495 spectrum 1 weight 0.10000E+01 volume 0.19103E-02 ppm1 4.354 ppm2 7.673 CV 1
ASSI { 496}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 110 and name HN ))
3.100 1.200 1.200 peak 496 spectrum 1 weight 0.10000E+01 volume 0.19051E-02 ppm1 5.086 ppm2 8.122 CV 1
ASSI { 497}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HG1 ))
3.500 1.500 1.500 peak 497 spectrum 1 weight 0.10000E+01 volume 0.19026E-02 ppm1 4.290 ppm2 2.412 CV 1
ASSI { 498}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 24 and name HG11))
2.700 0.900 0.900 peak 498 spectrum 1 weight 0.10000E+01 volume 0.18949E-02 ppm1 0.127 ppm2 1.550 CV 1
ASSI { 501}
(( segid " " and resid 30 and name HD1 ))
(( segid " " and resid 30 and name HG1 ))
2.500 0.800 0.800 peak 501 spectrum 1 weight 0.10000E+01 volume 0.18898E-02 ppm1 3.885 ppm2 1.401 CV 1
ASSI { 503}
(( segid " " and resid 3 and name HB1 ))
(( segid " " and resid 3 and name HN ))
2.600 0.900 0.900 peak 503 spectrum 1 weight 0.10000E+01 volume 0.18872E-02 ppm1 3.035 ppm2 8.600 CV 1
ASSI { 504}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 110 and name HN ))
2.700 0.900 0.900 peak 504 spectrum 1 weight 0.10000E+01 volume 0.18847E-02 ppm1 4.533 ppm2 8.126 CV 1
ASSI { 505}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HD% )
2.800 1.000 1.000 peak 505 spectrum 1 weight 0.10000E+01 volume 0.18795E-02 ppm1 5.079 ppm2 6.683 CV 1
ASSI { 507}
(( segid " " and resid 57 and name HB1 ))
( segid " " and resid 58 and name HD% )
3.400 3.400 2.600 peak 507 spectrum 1 weight 0.10000E+01 volume 0.18770E-02 ppm1 3.101 ppm2 6.835 CV 1
ASSI { 510}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 26 and name HN ))
3.300 1.400 1.400 peak 510 spectrum 1 weight 0.10000E+01 volume 0.18719E-02 ppm1 0.369 ppm2 8.548 CV 1
ASSI { 511}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HN ))
2.800 1.000 1.000 peak 511 spectrum 1 weight 0.11000E+01 volume 0.18668E-02 ppm1 4.813 ppm2 8.826 CV 1
ASSI { 512}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 16 and name HN ))
2.700 0.900 0.900 peak 512 spectrum 1 weight 0.10000E+01 volume 0.18540E-02 ppm1 0.270 ppm2 8.643 CV 1
ASSI { 514}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HN ))
3.000 1.100 1.100 peak 514 spectrum 1 weight 0.10000E+01 volume 0.18463E-02 ppm1 2.938 ppm2 7.259 CV 1
ASSI { 515}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 9 and name HN ))
2.700 0.900 0.900 peak 515 spectrum 1 weight 0.10000E+01 volume 0.18463E-02 ppm1 7.259 ppm2 8.172 CV 1
ASSI { 516}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 16 and name HN ))
3.200 1.300 1.300 peak 516 spectrum 1 weight 0.10000E+01 volume 0.18463E-02 ppm1 1.900 ppm2 8.671 CV 1
ASSI { 520}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 39 and name HN ))
2.800 1.000 1.000 peak 520 spectrum 1 weight 0.10000E+01 volume 0.18386E-02 ppm1 3.145 ppm2 9.168 CV 1
ASSI { 522}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 9 and name HN ))
3.200 1.300 1.300 peak 522 spectrum 1 weight 0.10000E+01 volume 0.18361E-02 ppm1 3.454 ppm2 8.171 CV 1
ASSI { 523}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 36 and name HE1 ))
3.300 1.300 1.300 peak 523 spectrum 1 weight 0.10000E+01 volume 0.18335E-02 ppm1 0.399 ppm2 10.271 CV 1
ASSI { 526}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 6 and name HN ))
2.500 0.800 0.800 peak 526 spectrum 1 weight 0.10000E+01 volume 0.18284E-02 ppm1 0.841 ppm2 10.255 CV 1
ASSI { 527}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 6 and name HN ))
3.000 1.200 1.200 peak 527 spectrum 1 weight 0.10000E+01 volume 0.18258E-02 ppm1 1.096 ppm2 10.248 CV 1
ASSI { 528}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 51 and name HZ ))
3.300 1.400 1.400 peak 528 spectrum 1 weight 0.10000E+01 volume 0.18233E-02 ppm1 6.652 ppm2 7.313 CV 1
ASSI { 530}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 52 and name HN ))
3.600 1.600 1.600 peak 530 spectrum 1 weight 0.10000E+01 volume 0.18157E-02 ppm1 2.703 ppm2 8.823 CV 1
ASSI { 532}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 106 and name HN ))
2.900 1.100 1.100 peak 532 spectrum 1 weight 0.10000E+01 volume 0.18028E-02 ppm1 0.669 ppm2 8.650 CV 1
ASSI { 535}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 104 and name HN ))
2.600 0.800 0.800 peak 535 spectrum 1 weight 0.10000E+01 volume 0.18002E-02 ppm1 3.990 ppm2 7.545 CV 1
ASSI { 538}
(( segid " " and resid 100 and name HB2 ))
(( segid " " and resid 100 and name HN ))
3.000 1.100 1.100 peak 538 spectrum 1 weight 0.10000E+01 volume 0.17849E-02 ppm1 3.713 ppm2 7.542 CV 1
ASSI { 543}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 47 and name HD22))
3.700 1.700 1.700 peak 543 spectrum 1 weight 0.10000E+01 volume 0.17568E-02 ppm1 2.603 ppm2 7.017 CV 1
ASSI { 544}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 34 and name HN ))
3.200 1.300 1.300 peak 544 spectrum 1 weight 0.10000E+01 volume 0.17543E-02 ppm1 2.343 ppm2 7.547 CV 1
ASSI { 546}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 26 and name HN ))
3.300 1.300 1.300 peak 546 spectrum 1 weight 0.10000E+01 volume 0.17517E-02 ppm1 1.819 ppm2 8.558 CV 1
ASSI { 547}
( segid " " and resid 80 and name HB% )
(( segid " " and resid 81 and name HN ))
3.700 1.700 1.700 peak 547 spectrum 1 weight 0.10000E+01 volume 0.17491E-02 ppm1 1.409 ppm2 8.449 CV 1
ASSI { 548}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 87 and name HN ))
3.300 1.400 1.400 peak 548 spectrum 1 weight 0.10000E+01 volume 0.17338E-02 ppm1 5.322 ppm2 9.333 CV 1
ASSI { 551}
(( segid " " and resid 44 and name HB1 ))
(( segid " " and resid 44 and name HN ))
3.000 1.100 1.100 peak 551 spectrum 1 weight 0.10000E+01 volume 0.17286E-02 ppm1 2.102 ppm2 7.953 CV 1
ASSI { 552}
( segid " " and resid 73 and name HD% )
(( segid " " and resid 73 and name HN ))
3.000 1.100 1.100 peak 552 spectrum 1 weight 0.10000E+01 volume 0.17236E-02 ppm1 6.882 ppm2 9.604 CV 1
ASSI { 553}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 102 and name HD1 ))
2.900 1.000 1.000 peak 553 spectrum 1 weight 0.10000E+01 volume 0.17236E-02 ppm1 1.989 ppm2 3.144 CV 1
ASSI { 557}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 101 and name HN ))
2.800 1.000 1.000 peak 557 spectrum 1 weight 0.10000E+01 volume 0.17082E-02 ppm1 4.497 ppm2 8.672 CV 1
ASSI { 560}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 44 and name HN ))
3.300 1.400 1.400 peak 560 spectrum 1 weight 0.10000E+01 volume 0.17006E-02 ppm1 2.338 ppm2 7.954 CV 1
ASSI { 561}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 89 and name HN ))
2.600 0.900 0.900 peak 561 spectrum 1 weight 0.10000E+01 volume 0.16903E-02 ppm1 5.345 ppm2 8.541 CV 1
ASSI { 562}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 3 and name HN ))
3.200 1.200 1.200 peak 562 spectrum 1 weight 0.10000E+01 volume 0.16801E-02 ppm1 0.671 ppm2 8.598 CV 1
ASSI { 563}
(( segid " " and resid 104 and name HA ))
(( segid " " and resid 104 and name HN ))
2.800 0.900 0.900 peak 563 spectrum 1 weight 0.10000E+01 volume 0.16801E-02 ppm1 5.318 ppm2 7.557 CV 1
ASSI { 564}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 22 and name HN ))
3.100 1.200 1.200 peak 564 spectrum 1 weight 0.10000E+01 volume 0.16750E-02 ppm1 0.664 ppm2 9.382 CV 1
ASSI { 565}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 77 and name HG2%)
2.900 1.000 1.000 peak 565 spectrum 1 weight 0.10000E+01 volume 0.16698E-02 ppm1 3.817 ppm2 0.820 CV 1
ASSI { 570}
( segid " " and resid 37 and name HD% )
(( segid " " and resid 38 and name HN ))
3.000 1.100 1.100 peak 570 spectrum 1 weight 0.10000E+01 volume 0.16392E-02 ppm1 6.832 ppm2 8.966 CV 1
ASSI { 571}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 103 and name HD% )
2.600 0.800 0.800 peak 571 spectrum 1 weight 0.10000E+01 volume 0.16392E-02 ppm1 2.936 ppm2 6.691 CV 1
ASSI { 572}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 52 and name HN ))
3.000 1.100 1.100 peak 572 spectrum 1 weight 0.10000E+01 volume 0.16392E-02 ppm1 1.240 ppm2 8.827 CV 1
ASSI { 573}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 42 and name HN ))
3.000 1.100 1.100 peak 573 spectrum 1 weight 0.10000E+01 volume 0.16340E-02 ppm1 5.095 ppm2 7.290 CV 1
ASSI { 574}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 77 and name HN ))
3.000 1.200 1.200 peak 574 spectrum 1 weight 0.10000E+01 volume 0.16340E-02 ppm1 0.585 ppm2 8.651 CV 1
ASSI { 575}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 9 and name HN ))
2.600 0.800 0.800 peak 575 spectrum 1 weight 0.10000E+01 volume 0.16315E-02 ppm1 3.285 ppm2 8.173 CV 1
ASSI { 576}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 86 and name HN ))
3.300 1.300 1.300 peak 576 spectrum 1 weight 0.10000E+01 volume 0.16264E-02 ppm1 0.586 ppm2 8.764 CV 1
ASSI { 577}
(( segid " " and resid 33 and name HA2 ))
( segid " " and resid 32 and name HG2%)
3.500 1.500 1.500 peak 577 spectrum 1 weight 0.10000E+01 volume 0.16213E-02 ppm1 3.701 ppm2 1.300 CV 1
ASSI { 578}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HB1 ))
3.000 1.100 1.100 peak 578 spectrum 1 weight 0.10000E+01 volume 0.16187E-02 ppm1 4.405 ppm2 3.254 CV 1
ASSI { 581}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 9 and name HN ))
2.900 1.000 1.000 peak 581 spectrum 1 weight 0.10000E+01 volume 0.16136E-02 ppm1 4.456 ppm2 8.171 CV 1
ASSI { 588}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 56 and name HN ))
3.100 1.200 1.200 peak 588 spectrum 1 weight 0.10000E+01 volume 0.15932E-02 ppm1 2.140 ppm2 8.332 CV 1
ASSI { 589}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 21 and name HN ))
2.400 0.700 0.700 peak 589 spectrum 1 weight 0.10000E+01 volume 0.15906E-02 ppm1 2.064 ppm2 8.212 CV 1
ASSI { 590}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 36 and name HZ3 ))
3.600 1.600 1.600 peak 590 spectrum 1 weight 0.10000E+01 volume 0.15880E-02 ppm1 5.164 ppm2 6.752 CV 1
ASSI { 593}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 87 and name HN ))
2.700 0.900 0.900 peak 593 spectrum 1 weight 0.10000E+01 volume 0.15803E-02 ppm1 0.658 ppm2 9.333 CV 1
ASSI { 594}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 14 and name HN ))
3.000 1.100 1.100 peak 594 spectrum 1 weight 0.10000E+01 volume 0.15778E-02 ppm1 1.305 ppm2 9.243 CV 1
ASSI { 598}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 85 and name HN ))
3.500 1.500 1.500 peak 598 spectrum 1 weight 0.10000E+01 volume 0.15701E-02 ppm1 0.585 ppm2 8.595 CV 1
ASSI { 604}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 38 and name HE% )
2.900 1.100 1.100 peak 604 spectrum 1 weight 0.11000E+01 volume 0.15344E-02 ppm1 -0.808 ppm2 6.881 CV 1
ASSI { 608}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HN ))
2.800 1.000 1.000 peak 608 spectrum 1 weight 0.10000E+01 volume 0.15241E-02 ppm1 4.852 ppm2 8.212 CV 1
ASSI { 610}
( segid " " and resid 35 and name HB% )
( segid " " and resid 37 and name HE% )
2.800 1.000 1.000 peak 610 spectrum 1 weight 0.10000E+01 volume 0.15165E-02 ppm1 1.237 ppm2 6.720 CV 1
ASSI { 611}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HN ))
3.500 1.500 1.500 peak 611 spectrum 1 weight 0.10000E+01 volume 0.15113E-02 ppm1 0.749 ppm2 7.855 CV 1
ASSI { 614}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 25 and name HE21))
3.500 1.500 1.500 peak 614 spectrum 1 weight 0.10000E+01 volume 0.14986E-02 ppm1 1.833 ppm2 7.240 CV 1
ASSI { 616}
(( segid " " and resid 43 and name HB1 ))
(( segid " " and resid 43 and name HN ))
2.900 1.100 1.100 peak 616 spectrum 1 weight 0.10000E+01 volume 0.14960E-02 ppm1 2.158 ppm2 9.167 CV 1
ASSI { 618}
(( segid " " and resid 63 and name HD1 ))
(( segid " " and resid 63 and name HN ))
3.000 1.100 1.100 peak 618 spectrum 1 weight 0.10000E+01 volume 0.14934E-02 ppm1 1.692 ppm2 8.492 CV 1
ASSI { 619}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 46 and name HD2 ))
3.200 1.300 1.300 peak 619 spectrum 1 weight 0.10000E+01 volume 0.14908E-02 ppm1 0.584 ppm2 2.696 CV 1
ASSI { 624}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HN ))
2.900 1.000 1.000 peak 624 spectrum 1 weight 0.10000E+01 volume 0.14807E-02 ppm1 2.226 ppm2 7.335 CV 1
ASSI { 625}
( segid " " and resid 8 and name HB% )
(( segid " " and resid 9 and name HN ))
3.000 1.100 1.100 peak 625 spectrum 1 weight 0.10000E+01 volume 0.14807E-02 ppm1 1.078 ppm2 8.170 CV 1
ASSI { 626}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HD21))
2.600 0.800 0.800 peak 626 spectrum 1 weight 0.10000E+01 volume 0.14755E-02 ppm1 2.936 ppm2 7.809 CV 1
ASSI { 627}
(( segid " " and resid 100 and name HB2 ))
( segid " " and resid 88 and name HG2%)
3.100 1.200 1.200 peak 627 spectrum 1 weight 0.10000E+01 volume 0.14755E-02 ppm1 3.714 ppm2 1.092 CV 1
ASSI { 628}
(( segid " " and resid 106 and name HB1 ))
( segid " " and resid 106 and name HE% )
3.800 1.800 1.800 peak 628 spectrum 1 weight 0.10000E+01 volume 0.14730E-02 ppm1 3.147 ppm2 6.570 CV 1
ASSI { 633}
(( segid " " and resid 27 and name HD2 ))
( segid " " and resid 26 and name HD1%)
2.600 0.800 0.800 peak 633 spectrum 1 weight 0.10000E+01 volume 0.14602E-02 ppm1 3.368 ppm2 -0.653 CV 1
ASSI { 639}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 91 and name HN ))
3.400 1.400 1.400 peak 639 spectrum 1 weight 0.10000E+01 volume 0.14473E-02 ppm1 0.742 ppm2 7.634 CV 1
ASSI { 640}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HE3 ))
3.700 1.700 1.700 peak 640 spectrum 1 weight 0.10000E+01 volume 0.14346E-02 ppm1 2.642 ppm2 7.068 CV 1
ASSI { 641}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 36 and name HD1 ))
3.000 1.100 1.100 peak 641 spectrum 1 weight 0.10000E+01 volume 0.14320E-02 ppm1 0.402 ppm2 7.404 CV 1
ASSI { 643}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 88 and name HN ))
2.800 1.000 1.000 peak 643 spectrum 1 weight 0.10000E+01 volume 0.14320E-02 ppm1 9.104 ppm2 9.394 CV 1
ASSI { 644}
(( segid " " and resid 93 and name HB1 ))
(( segid " " and resid 93 and name HN ))
2.800 1.000 1.000 peak 644 spectrum 1 weight 0.10000E+01 volume 0.14269E-02 ppm1 3.311 ppm2 6.885 CV 1
ASSI { 648}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 95 and name HN ))
2.400 0.700 0.700 peak 648 spectrum 1 weight 0.10000E+01 volume 0.14218E-02 ppm1 0.760 ppm2 7.550 CV 1
ASSI { 649}
(( segid " " and resid 66 and name HA2 ))
(( segid " " and resid 67 and name HN ))
3.500 1.500 1.500 peak 649 spectrum 1 weight 0.10000E+01 volume 0.14218E-02 ppm1 3.784 ppm2 7.674 CV 1
ASSI { 652}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name HB2 ))
3.200 1.300 1.300 peak 652 spectrum 1 weight 0.10000E+01 volume 0.14141E-02 ppm1 5.074 ppm2 2.404 CV 1
ASSI { 654}
(( segid " " and resid 27 and name HD1 ))
( segid " " and resid 26 and name HD1%)
3.200 1.300 1.300 peak 654 spectrum 1 weight 0.10000E+01 volume 0.14115E-02 ppm1 4.021 ppm2 -0.655 CV 1
ASSI { 657}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 108 and name HN ))
3.400 1.400 1.400 peak 657 spectrum 1 weight 0.10000E+01 volume 0.14039E-02 ppm1 0.959 ppm2 9.148 CV 1
ASSI { 658}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 27 and name HG1 ))
3.700 1.700 1.700 peak 658 spectrum 1 weight 0.10000E+01 volume 0.14039E-02 ppm1 1.092 ppm2 2.146 CV 1
ASSI { 660}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 94 and name HN ))
3.200 1.300 1.300 peak 660 spectrum 1 weight 0.10000E+01 volume 0.13937E-02 ppm1 0.826 ppm2 6.739 CV 1
ASSI { 661}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HD21))
2.700 0.900 0.900 peak 661 spectrum 1 weight 0.10000E+01 volume 0.13937E-02 ppm1 2.738 ppm2 7.747 CV 1
ASSI { 666}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 73 and name HN ))
2.900 1.000 1.000 peak 666 spectrum 1 weight 0.10000E+01 volume 0.13783E-02 ppm1 4.921 ppm2 9.599 CV 1
ASSI { 668}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 90 and name HN ))
2.800 1.000 1.000 peak 668 spectrum 1 weight 0.10000E+01 volume 0.13732E-02 ppm1 7.856 ppm2 8.966 CV 1
ASSI { 669}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 110 and name HD22))
3.700 1.700 1.700 peak 669 spectrum 1 weight 0.10000E+01 volume 0.13732E-02 ppm1 1.299 ppm2 6.653 CV 1
ASSI { 670}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HD1 ))
3.300 1.400 1.400 peak 670 spectrum 1 weight 0.10000E+01 volume 0.13732E-02 ppm1 6.879 ppm2 7.113 CV 1
ASSI { 671}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 108 and name HN ))
3.700 1.700 1.700 peak 671 spectrum 1 weight 0.10000E+01 volume 0.13604E-02 ppm1 2.041 ppm2 9.167 CV 1
ASSI { 672}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 89 and name HN ))
3.200 1.200 1.200 peak 672 spectrum 1 weight 0.10000E+01 volume 0.13579E-02 ppm1 1.093 ppm2 8.540 CV 1
ASSI { 676}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 7 and name HN ))
3.000 1.100 1.100 peak 676 spectrum 1 weight 0.10000E+01 volume 0.13527E-02 ppm1 1.859 ppm2 8.865 CV 1
ASSI { 677}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 15 and name HN ))
3.000 1.100 1.100 peak 677 spectrum 1 weight 0.10000E+01 volume 0.13527E-02 ppm1 4.056 ppm2 8.472 CV 1
ASSI { 678}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 6 and name HN ))
2.700 0.900 0.900 peak 678 spectrum 1 weight 0.10000E+01 volume 0.13477E-02 ppm1 3.287 ppm2 10.246 CV 1
ASSI { 680}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 7 and name HN ))
2.800 1.000 1.000 peak 680 spectrum 1 weight 0.10000E+01 volume 0.13400E-02 ppm1 5.159 ppm2 8.866 CV 1
ASSI { 684}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HN ))
3.000 1.200 1.200 peak 684 spectrum 1 weight 0.11000E+01 volume 0.13221E-02 ppm1 4.121 ppm2 7.987 CV 1
ASSI { 689}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HE21))
2.400 2.400 3.600 peak 689 spectrum 1 weight 0.10000E+01 volume 0.13144E-02 ppm1 1.181 ppm2 7.240 CV 1
ASSI { 694}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HN ))
2.900 1.000 1.000 peak 694 spectrum 1 weight 0.10000E+01 volume 0.13093E-02 ppm1 5.358 ppm2 9.598 CV 1
ASSI { 696}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 59 and name HD1 ))
3.700 1.700 1.700 peak 696 spectrum 1 weight 0.10000E+01 volume 0.13016E-02 ppm1 1.938 ppm2 3.670 CV 1
ASSI { 698}
(( segid " " and resid 109 and name HA ))
( segid " " and resid 18 and name HG1%)
3.100 1.200 1.200 peak 698 spectrum 1 weight 0.10000E+01 volume 0.12965E-02 ppm1 5.509 ppm2 0.745 CV 1
ASSI { 700}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 9 and name HN ))
3.000 1.100 1.100 peak 700 spectrum 1 weight 0.10000E+01 volume 0.12940E-02 ppm1 7.887 ppm2 8.171 CV 1
ASSI { 702}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 82 and name HN ))
2.900 1.000 1.000 peak 702 spectrum 1 weight 0.10000E+01 volume 0.12940E-02 ppm1 4.908 ppm2 8.116 CV 1
ASSI { 704}
( segid " " and resid 26 and name HD2%)
( segid " " and resid 103 and name HD% )
3.000 1.100 1.100 peak 704 spectrum 1 weight 0.11000E+01 volume 0.12914E-02 ppm1 -1.281 ppm2 6.690 CV 1
ASSI { 706}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 31 and name HN ))
3.600 3.600 2.400 peak 706 spectrum 1 weight 0.10000E+01 volume 0.12888E-02 ppm1 4.149 ppm2 7.917 CV 1
ASSI { 708}
(( segid " " and resid 90 and name HG2 ))
(( segid " " and resid 90 and name HN ))
3.600 1.600 1.600 peak 708 spectrum 1 weight 0.10000E+01 volume 0.12811E-02 ppm1 1.752 ppm2 8.972 CV 1
ASSI { 709}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HN ))
2.700 0.900 0.900 peak 709 spectrum 1 weight 0.10000E+01 volume 0.12786E-02 ppm1 5.159 ppm2 10.247 CV 1
ASSI { 710}
( segid " " and resid 13 and name HG2%)
( segid " " and resid 106 and name HD% )
3.400 1.500 1.500 peak 710 spectrum 1 weight 0.10000E+01 volume 0.12786E-02 ppm1 0.968 ppm2 6.675 CV 1
ASSI { 711}
(( segid " " and resid 39 and name HG1 ))
( segid " " and resid 38 and name HD% )
3.400 1.500 1.500 peak 711 spectrum 1 weight 0.10000E+01 volume 0.12786E-02 ppm1 2.333 ppm2 7.503 CV 1
ASSI { 716}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 55 and name HD22))
3.600 1.600 1.600 peak 716 spectrum 1 weight 0.10000E+01 volume 0.12709E-02 ppm1 2.145 ppm2 5.752 CV 1
ASSI { 717}
(( segid " " and resid 94 and name HB ))
(( segid " " and resid 94 and name HN ))
3.400 1.400 1.400 peak 717 spectrum 1 weight 0.10000E+01 volume 0.12684E-02 ppm1 3.986 ppm2 6.741 CV 1
ASSI { 718}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HN ))
3.100 1.200 1.200 peak 718 spectrum 1 weight 0.10000E+01 volume 0.12684E-02 ppm1 4.072 ppm2 9.016 CV 1
ASSI { 722}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 37 and name HN ))
3.400 1.500 1.500 peak 722 spectrum 1 weight 0.10000E+01 volume 0.12658E-02 ppm1 3.430 ppm2 9.100 CV 1
ASSI { 725}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HN ))
3.500 1.500 1.500 peak 725 spectrum 1 weight 0.10000E+01 volume 0.12607E-02 ppm1 3.211 ppm2 8.210 CV 1
ASSI { 726}
(( segid " " and resid 78 and name HD1 ))
(( segid " " and resid 50 and name HG1 ))
3.000 1.100 1.100 peak 726 spectrum 1 weight 0.10000E+01 volume 0.12607E-02 ppm1 1.567 ppm2 2.757 CV 1
ASSI { 729}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 60 and name HB1 ))
3.500 1.600 1.600 peak 729 spectrum 1 weight 0.10000E+01 volume 0.12531E-02 ppm1 3.508 ppm2 2.222 CV 1
ASSI { 732}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 103 and name HN ))
3.400 1.500 1.500 peak 732 spectrum 1 weight 0.10000E+01 volume 0.12479E-02 ppm1 2.256 ppm2 9.219 CV 1
ASSI { 733}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 17 and name HN ))
3.800 1.800 1.800 peak 733 spectrum 1 weight 0.10000E+01 volume 0.12479E-02 ppm1 0.509 ppm2 8.381 CV 1
ASSI { 736}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 106 and name HN ))
2.700 0.900 0.900 peak 736 spectrum 1 weight 0.10000E+01 volume 0.12453E-02 ppm1 2.395 ppm2 8.654 CV 1
ASSI { 740}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 90 and name HN ))
3.700 1.700 1.700 peak 740 spectrum 1 weight 0.10000E+01 volume 0.12402E-02 ppm1 5.006 ppm2 8.968 CV 1
ASSI { 741}
(( segid " " and resid 81 and name HA1 ))
(( segid " " and resid 82 and name HN ))
3.200 1.300 1.300 peak 741 spectrum 1 weight 0.10000E+01 volume 0.12402E-02 ppm1 4.238 ppm2 8.117 CV 1
ASSI { 743}
(( segid " " and resid 30 and name HG1 ))
(( segid " " and resid 29 and name HB2 ))
3.700 3.700 2.300 peak 743 spectrum 1 weight 0.10000E+01 volume 0.12377E-02 ppm1 1.442 ppm2 2.752 CV 1
ASSI { 744}
( segid " " and resid 58 and name HD% )
(( segid " " and resid 57 and name HN ))
3.300 1.400 1.400 peak 744 spectrum 1 weight 0.10000E+01 volume 0.12326E-02 ppm1 6.839 ppm2 8.424 CV 1
ASSI { 746}
(( segid " " and resid 92 and name HA ))
( segid " " and resid 37 and name HD% )
3.400 1.500 1.500 peak 746 spectrum 1 weight 0.10000E+01 volume 0.12274E-02 ppm1 3.585 ppm2 6.834 CV 1
ASSI { 747}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HN ))
3.400 1.500 1.500 peak 747 spectrum 1 weight 0.10000E+01 volume 0.12274E-02 ppm1 2.882 ppm2 8.595 CV 1
ASSI { 749}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 103 and name HD% )
2.800 1.000 1.000 peak 749 spectrum 1 weight 0.10000E+01 volume 0.12249E-02 ppm1 3.989 ppm2 6.689 CV 1
ASSI { 750}
(( segid " " and resid 43 and name HB1 ))
( segid " " and resid 38 and name HD% )
3.000 1.100 1.100 peak 750 spectrum 1 weight 0.10000E+01 volume 0.12249E-02 ppm1 2.153 ppm2 7.504 CV 1
ASSI { 751}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 7 and name HG1 ))
3.900 1.900 1.900 peak 751 spectrum 1 weight 0.10000E+01 volume 0.12223E-02 ppm1 -0.655 ppm2 1.484 CV 1
ASSI { 754}
(( segid " " and resid 43 and name HB2 ))
( segid " " and resid 38 and name HD% )
2.800 1.000 1.000 peak 754 spectrum 1 weight 0.10000E+01 volume 0.12198E-02 ppm1 1.865 ppm2 7.503 CV 1
ASSI { 755}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 37 and name HE% )
4.000 2.000 2.000 peak 755 spectrum 1 weight 0.10000E+01 volume 0.12198E-02 ppm1 4.118 ppm2 6.723 CV 1
ASSI { 756}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 79 and name HN ))
3.400 1.400 1.400 peak 756 spectrum 1 weight 0.10000E+01 volume 0.12198E-02 ppm1 0.748 ppm2 7.322 CV 1
ASSI { 757}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 79 and name HN ))
3.500 1.500 1.500 peak 757 spectrum 1 weight 0.10000E+01 volume 0.12147E-02 ppm1 1.344 ppm2 7.320 CV 1
ASSI { 758}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HN ))
3.200 1.200 1.200 peak 758 spectrum 1 weight 0.10000E+01 volume 0.12121E-02 ppm1 8.647 ppm2 8.914 CV 1
ASSI { 760}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HN ))
3.000 1.200 1.200 peak 760 spectrum 1 weight 0.10000E+01 volume 0.12044E-02 ppm1 3.874 ppm2 8.342 CV 1
ASSI { 762}
(( segid " " and resid 102 and name HG1 ))
(( segid " " and resid 103 and name HN ))
3.000 1.100 1.100 peak 762 spectrum 1 weight 0.10000E+01 volume 0.12019E-02 ppm1 1.695 ppm2 9.214 CV 1
ASSI { 764}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 21 and name HN ))
3.300 1.400 1.400 peak 764 spectrum 1 weight 0.10000E+01 volume 0.11942E-02 ppm1 1.320 ppm2 8.206 CV 1
ASSI { 765}
( segid " " and resid 26 and name HD1%)
( segid " " and resid 103 and name HD% )
2.900 1.000 1.000 peak 765 spectrum 1 weight 0.11000E+01 volume 0.11916E-02 ppm1 -0.654 ppm2 6.687 CV 1
ASSI { 766}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 18 and name HN ))
3.000 1.100 1.100 peak 766 spectrum 1 weight 0.10000E+01 volume 0.11916E-02 ppm1 3.202 ppm2 8.413 CV 1
ASSI { 767}
(( segid " " and resid 36 and name HZ3 ))
(( segid " " and resid 89 and name HN ))
3.200 1.300 1.300 peak 767 spectrum 1 weight 0.10000E+01 volume 0.11891E-02 ppm1 6.755 ppm2 8.539 CV 1
ASSI { 770}
(( segid " " and resid 90 and name HA ))
(( segid " " and resid 90 and name HN ))
2.900 1.100 1.100 peak 770 spectrum 1 weight 0.10000E+01 volume 0.11865E-02 ppm1 4.652 ppm2 8.969 CV 1
ASSI { 772}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 15 and name HN ))
3.500 1.500 1.500 peak 772 spectrum 1 weight 0.10000E+01 volume 0.11815E-02 ppm1 0.580 ppm2 8.474 CV 1
ASSI { 773}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HD2 ))
3.600 1.600 1.600 peak 773 spectrum 1 weight 0.10000E+01 volume 0.11738E-02 ppm1 0.425 ppm2 3.368 CV 1
ASSI { 774}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HN ))
2.800 1.000 1.000 peak 774 spectrum 1 weight 0.10000E+01 volume 0.11738E-02 ppm1 3.845 ppm2 7.547 CV 1
ASSI { 775}
( segid " " and resid 75 and name HG1%)
( segid " " and resid 38 and name HE% )
3.100 1.200 1.200 peak 775 spectrum 1 weight 0.10000E+01 volume 0.11686E-02 ppm1 0.916 ppm2 6.880 CV 1
ASSI { 777}
(( segid " " and resid 63 and name HD1 ))
(( segid " " and resid 65 and name HN ))
3.600 1.700 1.700 peak 777 spectrum 1 weight 0.10000E+01 volume 0.11661E-02 ppm1 1.654 ppm2 8.116 CV 1
ASSI { 778}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 6 and name HN ))
3.000 1.100 1.100 peak 778 spectrum 1 weight 0.10000E+01 volume 0.11636E-02 ppm1 0.518 ppm2 10.268 CV 1
ASSI { 780}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 26 and name HN ))
3.600 1.600 1.600 peak 780 spectrum 1 weight 0.10000E+01 volume 0.11610E-02 ppm1 0.957 ppm2 8.556 CV 1
ASSI { 781}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HN ))
2.700 0.900 0.900 peak 781 spectrum 1 weight 0.10000E+01 volume 0.11533E-02 ppm1 2.640 ppm2 8.913 CV 1
ASSI { 783}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 38 and name HE% )
3.700 1.700 1.700 peak 783 spectrum 1 weight 0.11000E+01 volume 0.11481E-02 ppm1 -0.465 ppm2 6.881 CV 1
ASSI { 784}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 25 and name HN ))
2.900 1.000 1.000 peak 784 spectrum 1 weight 0.11000E+01 volume 0.11457E-02 ppm1 0.127 ppm2 8.418 CV 1
ASSI { 786}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 7 and name HN ))
3.500 1.600 1.600 peak 786 spectrum 1 weight 0.10000E+01 volume 0.11431E-02 ppm1 1.101 ppm2 8.865 CV 1
ASSI { 788}
( segid " " and resid 103 and name HD% )
(( segid " " and resid 105 and name HN ))
3.100 1.200 1.200 peak 788 spectrum 1 weight 0.10000E+01 volume 0.11431E-02 ppm1 6.680 ppm2 7.853 CV 1
ASSI { 789}
(( segid " " and resid 91 and name HD1 ))
(( segid " " and resid 91 and name HE ))
3.000 1.100 1.100 peak 789 spectrum 1 weight 0.11000E+01 volume 0.11405E-02 ppm1 2.601 ppm2 6.431 CV 1
ASSI { 792}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 42 and name HN ))
3.300 1.400 1.400 peak 792 spectrum 1 weight 0.10000E+01 volume 0.11328E-02 ppm1 3.432 ppm2 7.287 CV 1
ASSI { 794}
( segid " " and resid 105 and name HG1%)
( segid " " and resid 103 and name HE% )
3.000 1.100 1.100 peak 794 spectrum 1 weight 0.10000E+01 volume 0.11302E-02 ppm1 0.782 ppm2 6.914 CV 1
ASSI { 798}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 63 and name HN ))
3.000 1.100 1.100 peak 798 spectrum 1 weight 0.10000E+01 volume 0.11226E-02 ppm1 1.903 ppm2 8.491 CV 1
ASSI { 799}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 70 and name HN ))
3.600 1.700 1.700 peak 799 spectrum 1 weight 0.10000E+01 volume 0.11226E-02 ppm1 0.960 ppm2 8.420 CV 1
ASSI { 803}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 39 and name HN ))
2.700 0.900 0.900 peak 803 spectrum 1 weight 0.10000E+01 volume 0.11201E-02 ppm1 3.472 ppm2 9.168 CV 1
ASSI { 804}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 5 and name HG2%)
3.700 1.800 1.800 peak 804 spectrum 1 weight 0.10000E+01 volume 0.11175E-02 ppm1 4.468 ppm2 0.539 CV 1
ASSI { 807}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 83 and name HD2 ))
3.400 1.400 1.400 peak 807 spectrum 1 weight 0.10000E+01 volume 0.11175E-02 ppm1 2.909 ppm2 6.738 CV 1
ASSI { 810}
(( segid " " and resid 27 and name HB1 ))
(( segid " " and resid 28 and name HN ))
3.500 1.600 1.600 peak 810 spectrum 1 weight 0.10000E+01 volume 0.11098E-02 ppm1 2.404 ppm2 8.340 CV 1
ASSI { 811}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HN ))
3.000 1.200 1.200 peak 811 spectrum 1 weight 0.10000E+01 volume 0.11098E-02 ppm1 4.281 ppm2 8.054 CV 1
ASSI { 812}
(( segid " " and resid 90 and name HB1 ))
(( segid " " and resid 91 and name HN ))
2.800 1.000 1.000 peak 812 spectrum 1 weight 0.10000E+01 volume 0.11098E-02 ppm1 1.728 ppm2 7.636 CV 1
ASSI { 815}
(( segid " " and resid 36 and name HB2 ))
( segid " " and resid 87 and name HD2%)
3.900 1.900 1.900 peak 815 spectrum 1 weight 0.10000E+01 volume 0.11073E-02 ppm1 2.646 ppm2 -0.810 CV 1
ASSI { 818}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HN ))
3.800 1.800 1.800 peak 818 spectrum 1 weight 0.10000E+01 volume 0.11022E-02 ppm1 -0.117 ppm2 7.634 CV 1
ASSI { 819}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 89 and name HB2 ))
2.800 1.000 1.000 peak 819 spectrum 1 weight 0.10000E+01 volume 0.11022E-02 ppm1 4.425 ppm2 0.044 CV 1
ASSI { 822}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 84 and name HN ))
3.600 1.600 1.600 peak 822 spectrum 1 weight 0.10000E+01 volume 0.10945E-02 ppm1 2.808 ppm2 9.064 CV 1
ASSI { 826}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 18 and name HG1%)
3.900 1.900 1.900 peak 826 spectrum 1 weight 0.10000E+01 volume 0.10894E-02 ppm1 5.086 ppm2 0.750 CV 1
ASSI { 827}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HN ))
3.200 1.200 1.200 peak 827 spectrum 1 weight 0.10000E+01 volume 0.10894E-02 ppm1 4.550 ppm2 6.884 CV 1
ASSI { 828}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 99 and name HN ))
3.200 1.300 1.300 peak 828 spectrum 1 weight 0.10000E+01 volume 0.10894E-02 ppm1 4.593 ppm2 8.121 CV 1
ASSI { 829}
(( segid " " and resid 2 and name HB1 ))
(( segid " " and resid 2 and name HN ))
3.400 1.500 1.500 peak 829 spectrum 1 weight 0.10000E+01 volume 0.10894E-02 ppm1 3.745 ppm2 8.332 CV 1
ASSI { 830}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 70 and name HG2%)
3.200 1.300 1.300 peak 830 spectrum 1 weight 0.10000E+01 volume 0.10894E-02 ppm1 4.833 ppm2 0.968 CV 1
ASSI { 831}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 105 and name HG2%)
2.900 1.000 1.000 peak 831 spectrum 1 weight 0.10000E+01 volume 0.10894E-02 ppm1 4.302 ppm2 0.669 CV 1
ASSI { 833}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 36 and name HE1 ))
3.100 1.200 1.200 peak 833 spectrum 1 weight 0.10000E+01 volume 0.10868E-02 ppm1 6.944 ppm2 10.271 CV 1
ASSI { 834}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 34 and name HD% )
2.800 1.000 1.000 peak 834 spectrum 1 weight 0.11000E+01 volume 0.10843E-02 ppm1 3.849 ppm2 6.502 CV 1
ASSI { 835}
(( segid " " and resid 16 and name HA ))
( segid " " and resid 16 and name HG1%)
3.100 1.200 1.200 peak 835 spectrum 1 weight 0.10000E+01 volume 0.10817E-02 ppm1 4.605 ppm2 0.511 CV 1
ASSI { 837}
(( segid " " and resid 97 and name HA ))
(( segid " " and resid 97 and name HN ))
3.100 1.200 1.200 peak 837 spectrum 1 weight 0.10000E+01 volume 0.10817E-02 ppm1 4.751 ppm2 8.805 CV 1
ASSI { 839}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 13 and name HN ))
3.000 1.100 1.100 peak 839 spectrum 1 weight 0.10000E+01 volume 0.10791E-02 ppm1 5.325 ppm2 8.261 CV 1
ASSI { 840}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 84 and name HN ))
3.600 1.600 1.600 peak 840 spectrum 1 weight 0.10000E+01 volume 0.10740E-02 ppm1 2.914 ppm2 9.063 CV 1
ASSI { 841}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 38 and name HZ ))
3.500 1.500 1.500 peak 841 spectrum 1 weight 0.10000E+01 volume 0.10740E-02 ppm1 0.263 ppm2 7.313 CV 1
ASSI { 843}
( segid " " and resid 21 and name HD1%)
( segid " " and resid 51 and name HD% )
3.700 1.700 1.700 peak 843 spectrum 1 weight 0.10000E+01 volume 0.10715E-02 ppm1 0.672 ppm2 6.639 CV 1
ASSI { 846}
(( segid " " and resid 36 and name HD1 ))
(( segid " " and resid 36 and name HN ))
2.800 1.000 1.000 peak 846 spectrum 1 weight 0.10000E+01 volume 0.10664E-02 ppm1 7.403 ppm2 8.914 CV 1
ASSI { 848}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 64 and name HD1%)
3.400 1.400 1.400 peak 848 spectrum 1 weight 0.10000E+01 volume 0.10638E-02 ppm1 4.346 ppm2 0.897 CV 1
ASSI { 851}
( segid " " and resid 104 and name HG2%)
( segid " " and resid 106 and name HD% )
3.400 1.400 1.400 peak 851 spectrum 1 weight 0.10000E+01 volume 0.10561E-02 ppm1 0.432 ppm2 6.691 CV 1
ASSI { 852}
(( segid " " and resid 107 and name HA ))
( segid " " and resid 16 and name HG1%)
3.500 1.500 1.500 peak 852 spectrum 1 weight 0.10000E+01 volume 0.10536E-02 ppm1 4.971 ppm2 0.509 CV 1
ASSI { 854}
(( segid " " and resid 86 and name HB1 ))
(( segid " " and resid 86 and name HD21))
3.100 1.200 1.200 peak 854 spectrum 1 weight 0.10000E+01 volume 0.10536E-02 ppm1 2.705 ppm2 7.562 CV 1
ASSI { 855}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HB1 ))
2.900 1.000 1.000 peak 855 spectrum 1 weight 0.10000E+01 volume 0.10510E-02 ppm1 -0.808 ppm2 1.483 CV 1
ASSI { 856}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 99 and name HN ))
3.100 1.200 1.200 peak 856 spectrum 1 weight 0.10000E+01 volume 0.10459E-02 ppm1 7.542 ppm2 8.119 CV 1
ASSI { 859}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 14 and name HN ))
3.000 1.200 1.200 peak 859 spectrum 1 weight 0.10000E+01 volume 0.10459E-02 ppm1 4.945 ppm2 9.245 CV 1
ASSI { 860}
( segid " " and resid 24 and name HG2%)
( segid " " and resid 5 and name HG1%)
3.000 1.100 1.100 peak 860 spectrum 1 weight 0.10000E+01 volume 0.10408E-02 ppm1 0.125 ppm2 0.842 CV 1
ASSI { 865}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HD21))
3.100 1.200 1.200 peak 865 spectrum 1 weight 0.10000E+01 volume 0.10254E-02 ppm1 3.207 ppm2 7.748 CV 1
ASSI { 867}
(( segid " " and resid 29 and name HD21))
(( segid " " and resid 36 and name HE1 ))
3.000 3.000 3.000 peak 867 spectrum 1 weight 0.10000E+01 volume 0.10229E-02 ppm1 7.735 ppm2 10.246 CV 1
ASSI { 873}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 47 and name HN ))
3.100 1.200 1.200 peak 873 spectrum 1 weight 0.11000E+01 volume 0.10050E-02 ppm1 4.445 ppm2 7.562 CV 1
ASSI { 877}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HD1 ))
3.700 1.700 1.700 peak 877 spectrum 1 weight 0.10000E+01 volume 0.99984E-03 ppm1 3.112 ppm2 7.401 CV 1
ASSI { 879}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 62 and name HN ))
3.200 1.300 1.300 peak 879 spectrum 1 weight 0.10000E+01 volume 0.99735E-03 ppm1 3.939 ppm2 8.054 CV 1
ASSI { 881}
(( segid " " and resid 89 and name HB1 ))
(( segid " " and resid 101 and name HN ))
2.800 1.000 1.000 peak 881 spectrum 1 weight 0.10000E+01 volume 0.99218E-03 ppm1 2.276 ppm2 8.669 CV 1
ASSI { 882}
(( segid " " and resid 85 and name HA ))
( segid " " and resid 38 and name HE% )
3.200 1.300 1.300 peak 882 spectrum 1 weight 0.10000E+01 volume 0.98960E-03 ppm1 3.988 ppm2 6.911 CV 1
ASSI { 884}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HN ))
3.000 1.100 1.100 peak 884 spectrum 1 weight 0.10000E+01 volume 0.98710E-03 ppm1 5.571 ppm2 8.221 CV 1
ASSI { 887}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 83 and name HD2 ))
3.200 1.300 1.300 peak 887 spectrum 1 weight 0.10000E+01 volume 0.97944E-03 ppm1 0.633 ppm2 6.769 CV 1
ASSI { 890}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 103 and name HN ))
3.600 1.600 1.600 peak 890 spectrum 1 weight 0.10000E+01 volume 0.97686E-03 ppm1 0.658 ppm2 9.235 CV 1
ASSI { 893}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 55 and name HD22))
3.800 1.800 1.800 peak 893 spectrum 1 weight 0.10000E+01 volume 0.97428E-03 ppm1 2.249 ppm2 5.747 CV 1
ASSI { 895}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 51 and name HN ))
3.600 1.600 1.600 peak 895 spectrum 1 weight 0.10000E+01 volume 0.97170E-03 ppm1 4.074 ppm2 7.417 CV 1
ASSI { 900}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 3 and name HD2 ))
3.700 1.700 1.700 peak 900 spectrum 1 weight 0.10000E+01 volume 0.95896E-03 ppm1 2.883 ppm2 6.988 CV 1
ASSI { 901}
(( segid " " and resid 3 and name HB1 ))
(( segid " " and resid 3 and name HD2 ))
2.800 1.000 1.000 peak 901 spectrum 1 weight 0.10000E+01 volume 0.95896E-03 ppm1 3.042 ppm2 6.989 CV 1
ASSI { 903}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 23 and name HN ))
3.300 1.400 1.400 peak 903 spectrum 1 weight 0.10000E+01 volume 0.95637E-03 ppm1 0.822 ppm2 8.718 CV 1
ASSI { 905}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 74 and name HN ))
3.100 1.200 1.200 peak 905 spectrum 1 weight 0.11000E+01 volume 0.95637E-03 ppm1 8.613 ppm2 9.597 CV 1
ASSI { 907}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HN ))
3.100 1.200 1.200 peak 907 spectrum 1 weight 0.10000E+01 volume 0.95388E-03 ppm1 5.078 ppm2 7.419 CV 1
ASSI { 908}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 51 and name HN ))
3.500 1.500 1.500 peak 908 spectrum 1 weight 0.11000E+01 volume 0.95130E-03 ppm1 4.452 ppm2 7.419 CV 1
ASSI { 913}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HN ))
3.100 1.200 1.200 peak 913 spectrum 1 weight 0.10000E+01 volume 0.94105E-03 ppm1 2.059 ppm2 7.859 CV 1
ASSI { 916}
(( segid " " and resid 40 and name HA1 ))
(( segid " " and resid 40 and name HN ))
3.200 1.300 1.300 peak 916 spectrum 1 weight 0.10000E+01 volume 0.93339E-03 ppm1 4.264 ppm2 8.915 CV 1
ASSI { 917}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 35 and name HN ))
3.100 1.200 1.200 peak 917 spectrum 1 weight 0.10000E+01 volume 0.92823E-03 ppm1 2.331 ppm2 7.859 CV 1
ASSI { 919}
(( segid " " and resid 56 and name HG1 ))
(( segid " " and resid 56 and name HN ))
3.300 1.400 1.400 peak 919 spectrum 1 weight 0.10000E+01 volume 0.92573E-03 ppm1 0.968 ppm2 8.338 CV 1
ASSI { 925}
(( segid " " and resid 53 and name HB ))
(( segid " " and resid 45 and name HN ))
3.500 1.500 1.500 peak 925 spectrum 1 weight 0.10000E+01 volume 0.91549E-03 ppm1 2.174 ppm2 8.272 CV 1
ASSI { 926}
(( segid " " and resid 4 and name HB1 ))
(( segid " " and resid 5 and name HN ))
4.000 2.000 2.000 peak 926 spectrum 1 weight 0.10000E+01 volume 0.91549E-03 ppm1 1.621 ppm2 8.944 CV 1
ASSI { 931}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 17 and name HN ))
3.600 1.700 1.700 peak 931 spectrum 1 weight 0.10000E+01 volume 0.90783E-03 ppm1 0.271 ppm2 8.382 CV 1
ASSI { 933}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 71 and name HN ))
3.600 1.600 1.600 peak 933 spectrum 1 weight 0.10000E+01 volume 0.90266E-03 ppm1 3.783 ppm2 9.588 CV 1
ASSI { 934}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 75 and name HN ))
3.200 1.300 1.300 peak 934 spectrum 1 weight 0.11000E+01 volume 0.90266E-03 ppm1 9.383 ppm2 9.790 CV 1
ASSI { 935}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 72 and name HN ))
3.100 1.200 1.200 peak 935 spectrum 1 weight 0.10000E+01 volume 0.90266E-03 ppm1 8.335 ppm2 9.303 CV 1
ASSI { 937}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 106 and name HE% )
3.800 1.800 1.800 peak 937 spectrum 1 weight 0.10000E+01 volume 0.90017E-03 ppm1 4.504 ppm2 6.574 CV 1
ASSI { 939}
(( segid " " and resid 48 and name HG1 ))
(( segid " " and resid 48 and name HN ))
3.600 1.600 1.600 peak 939 spectrum 1 weight 0.10000E+01 volume 0.89500E-03 ppm1 2.218 ppm2 9.017 CV 1
ASSI { 940}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HD22))
4.000 2.000 2.000 peak 940 spectrum 1 weight 0.10000E+01 volume 0.89251E-03 ppm1 5.560 ppm2 5.750 CV 1
ASSI { 941}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 49 and name HN ))
3.600 1.600 1.600 peak 941 spectrum 1 weight 0.10000E+01 volume 0.89251E-03 ppm1 1.947 ppm2 7.986 CV 1
ASSI { 942}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 66 and name HN ))
3.100 1.200 1.200 peak 942 spectrum 1 weight 0.10000E+01 volume 0.89251E-03 ppm1 8.119 ppm2 8.660 CV 1
ASSI { 944}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 86 and name HD21))
3.400 1.400 1.400 peak 944 spectrum 1 weight 0.10000E+01 volume 0.88476E-03 ppm1 0.432 ppm2 7.561 CV 1
ASSI { 948}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
3.500 1.500 1.500 peak 948 spectrum 1 weight 0.10000E+01 volume 0.87968E-03 ppm1 4.757 ppm2 1.783 CV 1
ASSI { 950}
(( segid " " and resid 15 and name HA ))
( segid " " and resid 16 and name HG2%)
3.900 1.900 1.900 peak 950 spectrum 1 weight 0.10000E+01 volume 0.87202E-03 ppm1 4.967 ppm2 0.269 CV 1
ASSI { 951}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 45 and name HN ))
3.400 3.400 2.600 peak 951 spectrum 1 weight 0.10000E+01 volume 0.86944E-03 ppm1 4.826 ppm2 8.273 CV 1
ASSI { 952}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 5 and name HN ))
2.800 1.000 1.000 peak 952 spectrum 1 weight 0.10000E+01 volume 0.86944E-03 ppm1 4.427 ppm2 8.969 CV 1
ASSI { 956}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 48 and name HG1 ))
3.600 1.600 1.600 peak 956 spectrum 1 weight 0.10000E+01 volume 0.84900E-03 ppm1 4.073 ppm2 2.225 CV 1
ASSI { 957}
(( segid " " and resid 98 and name HA ))
(( segid " " and resid 98 and name HB2 ))
3.400 1.500 1.500 peak 957 spectrum 1 weight 0.10000E+01 volume 0.84900E-03 ppm1 4.404 ppm2 3.196 CV 1
ASSI { 962}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HN ))
3.700 1.700 1.700 peak 962 spectrum 1 weight 0.10000E+01 volume 0.84643E-03 ppm1 2.739 ppm2 8.213 CV 1
ASSI { 965}
(( segid " " and resid 39 and name HG1 ))
(( segid " " and resid 40 and name HN ))
3.800 1.800 1.800 peak 965 spectrum 1 weight 0.10000E+01 volume 0.84387E-03 ppm1 2.339 ppm2 8.913 CV 1
ASSI { 966}
(( segid " " and resid 72 and name HA ))
( segid " " and resid 73 and name HD% )
3.000 1.100 1.100 peak 966 spectrum 1 weight 0.10000E+01 volume 0.84387E-03 ppm1 5.683 ppm2 6.881 CV 1
ASSI { 969}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HN ))
3.000 1.100 1.100 peak 969 spectrum 1 weight 0.10000E+01 volume 0.83876E-03 ppm1 4.912 ppm2 8.412 CV 1
ASSI { 970}
(( segid " " and resid 110 and name HB1 ))
(( segid " " and resid 110 and name HN ))
3.500 1.500 1.500 peak 970 spectrum 1 weight 0.10000E+01 volume 0.83365E-03 ppm1 2.693 ppm2 8.125 CV 1
ASSI { 973}
(( segid " " and resid 39 and name HG1 ))
(( segid " " and resid 39 and name HN ))
3.300 1.400 1.400 peak 973 spectrum 1 weight 0.10000E+01 volume 0.82087E-03 ppm1 2.339 ppm2 9.168 CV 1
ASSI { 976}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HN ))
3.400 1.400 1.400 peak 976 spectrum 1 weight 0.10000E+01 volume 0.81575E-03 ppm1 8.056 ppm2 8.386 CV 1
ASSI { 979}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 52 and name HN ))
3.100 1.200 1.200 peak 979 spectrum 1 weight 0.10000E+01 volume 0.81319E-03 ppm1 2.888 ppm2 8.827 CV 1
ASSI { 983}
(( segid " " and resid 91 and name HG2 ))
(( segid " " and resid 91 and name HE ))
3.100 1.200 1.200 peak 983 spectrum 1 weight 0.11000E+01 volume 0.81063E-03 ppm1 -0.110 ppm2 6.428 CV 1
ASSI { 985}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 100 and name HN ))
3.300 1.400 1.400 peak 985 spectrum 1 weight 0.10000E+01 volume 0.80552E-03 ppm1 4.498 ppm2 7.541 CV 1
ASSI { 986}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HN ))
3.200 1.300 1.300 peak 986 spectrum 1 weight 0.10000E+01 volume 0.80041E-03 ppm1 3.787 ppm2 8.053 CV 1
ASSI { 988}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 26 and name HN ))
2.700 0.900 0.900 peak 988 spectrum 1 weight 0.10000E+01 volume 0.79785E-03 ppm1 5.681 ppm2 8.547 CV 1
ASSI { 989}
(( segid " " and resid 94 and name HA ))
( segid " " and resid 94 and name HG2%)
3.800 1.800 1.800 peak 989 spectrum 1 weight 0.10000E+01 volume 0.79529E-03 ppm1 4.289 ppm2 0.837 CV 1
ASSI { 995}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HN ))
3.300 1.300 1.300 peak 995 spectrum 1 weight 0.10000E+01 volume 0.77995E-03 ppm1 4.090 ppm2 8.178 CV 1
ASSI { 998}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 20 and name HN ))
3.900 1.900 1.900 peak 998 spectrum 1 weight 0.10000E+01 volume 0.77483E-03 ppm1 1.853 ppm2 7.818 CV 1
ASSI { 1001}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 36 and name HE1 ))
3.900 1.900 1.900 peak 1001 spectrum 1 weight 0.11000E+01 volume 0.77228E-03 ppm1 4.117 ppm2 10.270 CV 1
ASSI { 1002}
(( segid " " and resid 33 and name HA1 ))
(( segid " " and resid 91 and name HG1 ))
2.900 1.100 1.100 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.77228E-03 ppm1 4.333 ppm2 0.341 CV 1
ASSI { 1003}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 29 and name HD22))
2.800 1.000 1.000 peak 1003 spectrum 1 weight 0.10000E+01 volume 0.77228E-03 ppm1 3.368 ppm2 6.939 CV 1
ASSI { 1005}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 8 and name HN ))
3.300 1.300 1.300 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.76972E-03 ppm1 4.089 ppm2 7.885 CV 1
ASSI { 1008}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 49 and name HN ))
3.200 1.300 1.300 peak 1008 spectrum 1 weight 0.11000E+01 volume 0.76716E-03 ppm1 4.075 ppm2 7.986 CV 1
ASSI { 1009}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 20 and name HN ))
3.400 1.400 1.400 peak 1009 spectrum 1 weight 0.10000E+01 volume 0.76716E-03 ppm1 3.203 ppm2 7.860 CV 1
ASSI { 1013}
(( segid " " and resid 9 and name HA ))
(( segid " " and resid 10 and name HN ))
3.300 1.400 1.400 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.76461E-03 ppm1 4.457 ppm2 7.259 CV 1
ASSI { 1014}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 73 and name HN ))
3.200 1.300 1.300 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.76204E-03 ppm1 1.752 ppm2 9.603 CV 1
ASSI { 1015}
(( segid " " and resid 55 and name HD22))
( segid " " and resid 57 and name HE% )
3.800 1.800 1.800 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.75949E-03 ppm1 5.751 ppm2 6.881 CV 1
ASSI { 1016}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HN ))
3.100 1.200 1.200 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.75949E-03 ppm1 5.005 ppm2 8.914 CV 1
ASSI { 1023}
(( segid " " and resid 96 and name HB1 ))
(( segid " " and resid 97 and name HN ))
3.800 1.800 1.800 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.74415E-03 ppm1 2.144 ppm2 8.808 CV 1
ASSI { 1024}
(( segid " " and resid 30 and name HD1 ))
(( segid " " and resid 29 and name HN ))
3.100 1.200 1.200 peak 1024 spectrum 1 weight 0.10000E+01 volume 0.73904E-03 ppm1 3.911 ppm2 8.177 CV 1
ASSI { 1026}
(( segid " " and resid 36 and name HE3 ))
(( segid " " and resid 88 and name HN ))
3.500 1.500 1.500 peak 1026 spectrum 1 weight 0.10000E+01 volume 0.73391E-03 ppm1 7.071 ppm2 9.393 CV 1
ASSI { 1027}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 2 and name HB1 ))
3.700 1.700 1.700 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.73136E-03 ppm1 4.815 ppm2 3.701 CV 1
ASSI { 1028}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 39 and name HN ))
4.000 2.000 2.000 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.72369E-03 ppm1 7.497 ppm2 9.167 CV 1
ASSI { 1029}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 7 and name HB1 ))
4.400 2.400 1.600 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.72369E-03 ppm1 -0.655 ppm2 1.865 CV 1
ASSI { 1030}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HN ))
3.000 1.100 1.100 peak 1030 spectrum 1 weight 0.10000E+01 volume 0.72369E-03 ppm1 3.911 ppm2 8.866 CV 1
ASSI { 1033}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 51 and name HN ))
3.700 1.700 1.700 peak 1033 spectrum 1 weight 0.10000E+01 volume 0.72113E-03 ppm1 2.028 ppm2 7.402 CV 1
ASSI { 1034}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 42 and name HN ))
3.500 1.500 1.500 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.71602E-03 ppm1 3.186 ppm2 7.308 CV 1
ASSI { 1035}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HB ))
3.100 1.200 1.200 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.71602E-03 ppm1 5.140 ppm2 2.001 CV 1
ASSI { 1036}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 62 and name HN ))
2.700 2.700 3.300 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.71602E-03 ppm1 2.631 ppm2 8.055 CV 1
ASSI { 1037}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 68 and name HN ))
3.400 1.400 1.400 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.71602E-03 ppm1 7.675 ppm2 8.339 CV 1
ASSI { 1040}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 97 and name HN ))
3.500 1.500 1.500 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.70834E-03 ppm1 3.815 ppm2 8.818 CV 1
ASSI { 1042}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 44 and name HN ))
3.800 1.800 1.800 peak 1042 spectrum 1 weight 0.10000E+01 volume 0.70834E-03 ppm1 1.225 ppm2 7.955 CV 1
ASSI { 1044}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 37 and name HD% )
3.700 1.700 1.700 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.70323E-03 ppm1 4.415 ppm2 6.834 CV 1
ASSI { 1045}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 36 and name HE3 ))
3.800 1.800 1.800 peak 1045 spectrum 1 weight 0.11000E+01 volume 0.70067E-03 ppm1 -0.464 ppm2 7.068 CV 1
ASSI { 1048}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 74 and name HD2 ))
3.200 1.300 1.300 peak 1048 spectrum 1 weight 0.10000E+01 volume 0.69556E-03 ppm1 3.029 ppm2 6.768 CV 1
ASSI { 1051}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 103 and name HN ))
3.800 1.800 1.800 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.69045E-03 ppm1 5.163 ppm2 9.220 CV 1
ASSI { 1055}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 65 and name HN ))
3.100 1.200 1.200 peak 1055 spectrum 1 weight 0.10000E+01 volume 0.68533E-03 ppm1 7.779 ppm2 8.116 CV 1
ASSI { 1058}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 103 and name HE% )
3.800 1.800 1.800 peak 1058 spectrum 1 weight 0.10000E+01 volume 0.67766E-03 ppm1 2.935 ppm2 6.913 CV 1
ASSI { 1060}
(( segid " " and resid 7 and name HD1 ))
(( segid " " and resid 27 and name HD2 ))
2.800 1.000 1.000 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.67510E-03 ppm1 1.696 ppm2 3.365 CV 1
ASSI { 1064}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 87 and name HB1 ))
4.100 2.100 1.900 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.66743E-03 ppm1 -1.281 ppm2 1.490 CV 1
ASSI { 1069}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 3 and name HB2 ))
3.800 1.800 1.800 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.66232E-03 ppm1 0.264 ppm2 2.900 CV 1
ASSI { 1070}
(( segid " " and resid 86 and name HA ))
( segid " " and resid 104 and name HG2%)
3.700 1.700 1.700 peak 1070 spectrum 1 weight 0.10000E+01 volume 0.65720E-03 ppm1 5.396 ppm2 0.434 CV 1
ASSI { 1073}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 105 and name HB ))
3.400 1.400 1.400 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.65465E-03 ppm1 3.432 ppm2 1.823 CV 1
ASSI { 1078}
(( segid " " and resid 55 and name HD22))
(( segid " " and resid 56 and name HN ))
4.500 2.500 1.500 peak 1078 spectrum 1 weight 0.10000E+01 volume 0.64697E-03 ppm1 5.746 ppm2 8.335 CV 1
ASSI { 1079}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 40 and name HN ))
3.200 1.300 1.300 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.64697E-03 ppm1 7.291 ppm2 8.960 CV 1
ASSI { 1080}
( segid " " and resid 5 and name HG1%)
( segid " " and resid 103 and name HE% )
3.300 1.300 1.300 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.64441E-03 ppm1 0.844 ppm2 6.914 CV 1
ASSI { 1082}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 5 and name HB ))
3.700 1.700 1.700 peak 1082 spectrum 1 weight 0.10000E+01 volume 0.63930E-03 ppm1 0.129 ppm2 1.874 CV 1
ASSI { 1083}
(( segid " " and resid 101 and name HG1 ))
(( segid " " and resid 10 and name HD22))
3.400 1.500 1.500 peak 1083 spectrum 1 weight 0.10000E+01 volume 0.63674E-03 ppm1 2.328 ppm2 6.989 CV 1
ASSI { 1089}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 108 and name HN ))
3.400 1.500 1.500 peak 1089 spectrum 1 weight 0.10000E+01 volume 0.62652E-03 ppm1 0.262 ppm2 9.178 CV 1
ASSI { 1090}
(( segid " " and resid 19 and name HA2 ))
(( segid " " and resid 20 and name HN ))
3.700 1.700 1.700 peak 1090 spectrum 1 weight 0.10000E+01 volume 0.62395E-03 ppm1 3.563 ppm2 7.859 CV 1
ASSI { 1091}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 36 and name HB2 ))
3.900 1.900 1.900 peak 1091 spectrum 1 weight 0.10000E+01 volume 0.62140E-03 ppm1 -1.279 ppm2 2.628 CV 1
ASSI { 1092}
(( segid " " and resid 3 and name HB1 ))
(( segid " " and resid 23 and name HN ))
3.500 1.600 1.600 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.62140E-03 ppm1 3.043 ppm2 8.722 CV 1
ASSI { 1093}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 86 and name HD22))
3.700 1.700 1.700 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.61884E-03 ppm1 0.433 ppm2 6.630 CV 1
ASSI { 1102}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 105 and name HG1%)
3.600 1.600 1.600 peak 1102 spectrum 1 weight 0.10000E+01 volume 0.60350E-03 ppm1 4.533 ppm2 0.752 CV 1
ASSI { 1104}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 8 and name HN ))
3.600 1.600 1.600 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.60095E-03 ppm1 3.906 ppm2 7.886 CV 1
ASSI { 1105}
( segid " " and resid 76 and name HG2%)
( segid " " and resid 51 and name HE% )
3.500 1.500 1.500 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.60095E-03 ppm1 0.921 ppm2 7.111 CV 1
ASSI { 1107}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 93 and name HN ))
3.600 1.600 1.600 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.59839E-03 ppm1 3.575 ppm2 6.883 CV 1
ASSI { 1112}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 89 and name HD% )
4.100 2.100 1.900 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.59327E-03 ppm1 4.779 ppm2 5.575 CV 1
ASSI { 1113}
(( segid " " and resid 78 and name HB1 ))
(( segid " " and resid 79 and name HN ))
4.300 2.300 1.700 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.59327E-03 ppm1 1.854 ppm2 7.324 CV 1
ASSI { 1114}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 103 and name HB2 ))
4.300 2.300 1.700 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.58816E-03 ppm1 -0.467 ppm2 2.257 CV 1
ASSI { 1125}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 52 and name HN ))
3.800 1.800 1.800 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.57282E-03 ppm1 1.349 ppm2 8.826 CV 1
ASSI { 1127}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 53 and name HN ))
3.600 3.600 2.400 peak 1127 spectrum 1 weight 0.10000E+01 volume 0.57026E-03 ppm1 1.370 ppm2 8.889 CV 1
ASSI { 1133}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 36 and name HZ2 ))
4.300 2.300 1.700 peak 1133 spectrum 1 weight 0.11000E+01 volume 0.56258E-03 ppm1 -1.279 ppm2 6.941 CV 1
ASSI { 1136}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 3 and name HE1 ))
4.300 2.300 1.700 peak 1136 spectrum 1 weight 0.11000E+01 volume 0.54469E-03 ppm1 0.272 ppm2 8.300 CV 1
ASSI { 1137}
(( segid " " and resid 3 and name HD2 ))
(( segid " " and resid 3 and name HN ))
4.000 2.000 2.000 peak 1137 spectrum 1 weight 0.10000E+01 volume 0.54213E-03 ppm1 6.990 ppm2 8.602 CV 1
ASSI { 1138}
(( segid " " and resid 86 and name HD21))
(( segid " " and resid 86 and name HN ))
3.100 1.200 1.200 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.53957E-03 ppm1 7.541 ppm2 8.803 CV 1
ASSI { 1139}
(( segid " " and resid 50 and name HG1 ))
(( segid " " and resid 50 and name HN ))
4.000 2.000 2.000 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.53957E-03 ppm1 2.759 ppm2 7.328 CV 1
ASSI { 1140}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 74 and name HN ))
3.500 1.600 1.600 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.53701E-03 ppm1 5.559 ppm2 9.601 CV 1
ASSI { 1143}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB1 ))
3.600 1.600 1.600 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.53445E-03 ppm1 4.932 ppm2 1.550 CV 1
ASSI { 1146}
(( segid " " and resid 102 and name HA ))
( segid " " and resid 88 and name HG2%)
4.100 2.100 1.900 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.52934E-03 ppm1 5.341 ppm2 1.091 CV 1
ASSI { 1147}
(( segid " " and resid 55 and name HD22))
(( segid " " and resid 55 and name HN ))
3.900 1.900 1.900 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.52678E-03 ppm1 5.752 ppm2 9.062 CV 1
ASSI { 1149}
(( segid " " and resid 104 and name HB ))
(( segid " " and resid 86 and name HD22))
4.600 2.600 1.400 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.52678E-03 ppm1 3.287 ppm2 6.638 CV 1
ASSI { 1152}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 6 and name HN ))
3.900 1.900 1.900 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.52678E-03 ppm1 1.874 ppm2 10.253 CV 1
ASSI { 1153}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 5 and name HN ))
3.800 1.800 1.800 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.52423E-03 ppm1 0.845 ppm2 8.950 CV 1
ASSI { 1154}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 7 and name HN ))
3.800 1.800 1.800 peak 1154 spectrum 1 weight 0.11000E+01 volume 0.52423E-03 ppm1 -0.653 ppm2 8.867 CV 1
ASSI { 1156}
(( segid " " and resid 38 and name HZ ))
(( segid " " and resid 86 and name HN ))
4.300 2.400 1.700 peak 1156 spectrum 1 weight 0.10000E+01 volume 0.51912E-03 ppm1 7.267 ppm2 8.762 CV 1
ASSI { 1159}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 11 and name HN ))
4.200 2.200 1.800 peak 1159 spectrum 1 weight 0.11000E+01 volume 0.51656E-03 ppm1 7.558 ppm2 9.673 CV 1
ASSI { 1161}
( segid " " and resid 103 and name HE% )
(( segid " " and resid 9 and name HN ))
3.700 1.700 1.700 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.51399E-03 ppm1 6.914 ppm2 8.169 CV 1
ASSI { 1162}
(( segid " " and resid 38 and name HB2 ))
( segid " " and resid 87 and name HD2%)
3.900 1.900 1.900 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.50888E-03 ppm1 3.120 ppm2 -0.809 CV 1
ASSI { 1171}
(( segid " " and resid 21 and name HB1 ))
(( segid " " and resid 22 and name HN ))
4.300 2.300 1.700 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.49354E-03 ppm1 1.606 ppm2 9.380 CV 1
ASSI { 1172}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 11 and name HN ))
3.600 1.600 1.600 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.49099E-03 ppm1 3.106 ppm2 9.670 CV 1
ASSI { 1174}
(( segid " " and resid 4 and name HB1 ))
(( segid " " and resid 3 and name HB1 ))
3.900 1.900 1.900 peak 1174 spectrum 1 weight 0.10000E+01 volume 0.49099E-03 ppm1 1.662 ppm2 3.035 CV 1
ASSI { 1176}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 99 and name HB1 ))
3.800 1.800 1.800 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.48843E-03 ppm1 4.589 ppm2 2.647 CV 1
ASSI { 1177}
(( segid " " and resid 20 and name HB1 ))
(( segid " " and resid 21 and name HN ))
4.500 2.600 1.500 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.48586E-03 ppm1 2.321 ppm2 8.212 CV 1
ASSI { 1178}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 3 and name HD2 ))
4.000 2.000 2.000 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.48075E-03 ppm1 0.668 ppm2 6.989 CV 1
ASSI { 1179}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 36 and name HE1 ))
4.300 2.300 1.700 peak 1179 spectrum 1 weight 0.11000E+01 volume 0.48075E-03 ppm1 3.878 ppm2 10.269 CV 1
ASSI { 1181}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 47 and name HD21))
3.300 3.300 2.700 peak 1181 spectrum 1 weight 0.10000E+01 volume 0.47308E-03 ppm1 2.757 ppm2 7.629 CV 1
ASSI { 1182}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 71 and name HN ))
4.100 2.100 1.900 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.47308E-03 ppm1 4.116 ppm2 9.584 CV 1
ASSI { 1183}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 83 and name HE1 ))
3.500 1.500 1.500 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.47053E-03 ppm1 0.262 ppm2 7.818 CV 1
ASSI { 1184}
(( segid " " and resid 54 and name HG1 ))
(( segid " " and resid 54 and name HN ))
3.900 1.900 1.900 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.46797E-03 ppm1 2.262 ppm2 8.602 CV 1
ASSI { 1186}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 37 and name HD% )
4.300 2.300 1.700 peak 1186 spectrum 1 weight 0.10000E+01 volume 0.46541E-03 ppm1 4.114 ppm2 6.842 CV 1
ASSI { 1188}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 75 and name HN ))
3.400 1.400 1.400 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.45774E-03 ppm1 5.134 ppm2 9.791 CV 1
ASSI { 1190}
(( segid " " and resid 110 and name HN ))
(( segid " " and resid 109 and name HN ))
4.200 2.200 1.800 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.45262E-03 ppm1 8.124 ppm2 9.071 CV 1
ASSI { 1191}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 71 and name HN ))
4.000 2.000 2.000 peak 1191 spectrum 1 weight 0.10000E+01 volume 0.45007E-03 ppm1 4.832 ppm2 9.585 CV 1
ASSI { 1192}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 10 and name HD22))
4.100 2.100 1.900 peak 1192 spectrum 1 weight 0.10000E+01 volume 0.45007E-03 ppm1 4.680 ppm2 6.988 CV 1
ASSI { 1195}
(( segid " " and resid 63 and name HG1 ))
(( segid " " and resid 64 and name HN ))
4.200 2.200 1.800 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.44240E-03 ppm1 1.423 ppm2 7.772 CV 1
ASSI { 1196}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 93 and name HD1 ))
4.400 2.400 1.600 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.43984E-03 ppm1 4.550 ppm2 7.094 CV 1
ASSI { 1198}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 12 and name HN ))
4.500 2.500 1.500 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.43728E-03 ppm1 0.781 ppm2 8.504 CV 1
ASSI { 1199}
(( segid " " and resid 103 and name HB1 ))
(( segid " " and resid 36 and name HZ3 ))
3.400 1.500 1.500 peak 1199 spectrum 1 weight 0.10000E+01 volume 0.43728E-03 ppm1 2.588 ppm2 6.753 CV 1
ASSI { 1203}
(( segid " " and resid 91 and name HB2 ))
( segid " " and resid 34 and name HD% )
3.300 1.400 1.400 peak 1203 spectrum 1 weight 0.10000E+01 volume 0.43728E-03 ppm1 0.041 ppm2 6.469 CV 1
ASSI { 1204}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 36 and name HH2 ))
3.600 1.600 1.600 peak 1204 spectrum 1 weight 0.11000E+01 volume 0.43473E-03 ppm1 0.051 ppm2 6.752 CV 1
ASSI { 1206}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 75 and name HN ))
3.700 1.700 1.700 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.43473E-03 ppm1 0.817 ppm2 9.795 CV 1
ASSI { 1207}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 10 and name HN ))
3.600 1.700 1.700 peak 1207 spectrum 1 weight 0.10000E+01 volume 0.43473E-03 ppm1 4.088 ppm2 7.257 CV 1
ASSI { 1211}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 9 and name HB2 ))
4.500 2.600 1.500 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.42705E-03 ppm1 0.779 ppm2 3.285 CV 1
ASSI { 1216}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 32 and name HN ))
3.700 1.700 1.700 peak 1216 spectrum 1 weight 0.10000E+01 volume 0.42449E-03 ppm1 4.424 ppm2 7.819 CV 1
ASSI { 1218}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 103 and name HN ))
4.000 2.000 2.000 peak 1218 spectrum 1 weight 0.10000E+01 volume 0.41682E-03 ppm1 7.565 ppm2 9.218 CV 1
ASSI { 1228}
(( segid " " and resid 91 and name HG2 ))
( segid " " and resid 34 and name HD% )
4.700 2.800 1.300 peak 1228 spectrum 1 weight 0.11000E+01 volume 0.39636E-03 ppm1 -0.113 ppm2 6.499 CV 1
ASSI { 1230}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 93 and name HZ2 ))
3.900 1.900 1.900 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.39636E-03 ppm1 6.882 ppm2 7.402 CV 1
ASSI { 1231}
(( segid " " and resid 106 and name HA ))
( segid " " and resid 106 and name HE% )
4.500 2.500 1.500 peak 1231 spectrum 1 weight 0.10000E+01 volume 0.39636E-03 ppm1 5.071 ppm2 6.575 CV 1
ASSI { 1236}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 34 and name HN ))
3.500 3.500 2.500 peak 1236 spectrum 1 weight 0.10000E+01 volume 0.38614E-03 ppm1 1.347 ppm2 7.562 CV 1
ASSI { 1237}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 36 and name HD1 ))
3.500 1.500 1.500 peak 1237 spectrum 1 weight 0.10000E+01 volume 0.38358E-03 ppm1 0.513 ppm2 7.402 CV 1
ASSI { 1238}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 25 and name HE21))
4.200 2.200 1.800 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.38358E-03 ppm1 2.170 ppm2 7.268 CV 1
ASSI { 1240}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HN ))
4.200 2.200 1.800 peak 1240 spectrum 1 weight 0.10000E+01 volume 0.38358E-03 ppm1 9.303 ppm2 9.599 CV 1
ASSI { 1241}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 110 and name HN ))
3.700 1.700 1.700 peak 1241 spectrum 1 weight 0.10000E+01 volume 0.38358E-03 ppm1 0.752 ppm2 8.122 CV 1
ASSI { 1242}
(( segid " " and resid 87 and name HG ))
( segid " " and resid 38 and name HD% )
4.100 2.100 1.900 peak 1242 spectrum 1 weight 0.10000E+01 volume 0.38103E-03 ppm1 0.646 ppm2 7.502 CV 1
ASSI { 1244}
( segid " " and resid 103 and name HE% )
(( segid " " and resid 11 and name HN ))
4.200 2.200 1.800 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.38103E-03 ppm1 6.916 ppm2 9.667 CV 1
ASSI { 1245}
(( segid " " and resid 56 and name HB1 ))
(( segid " " and resid 56 and name HA ))
3.700 1.700 1.700 peak 1245 spectrum 1 weight 0.10000E+01 volume 0.38103E-03 ppm1 1.473 ppm2 4.303 CV 1
ASSI { 1250}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 36 and name HZ3 ))
4.500 2.500 1.500 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.37335E-03 ppm1 -0.465 ppm2 6.752 CV 1
ASSI { 1252}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 26 and name HN ))
4.400 2.400 1.600 peak 1252 spectrum 1 weight 0.11000E+01 volume 0.37079E-03 ppm1 -0.655 ppm2 8.557 CV 1
ASSI { 1253}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 24 and name HN ))
3.500 1.500 1.500 peak 1253 spectrum 1 weight 0.10000E+01 volume 0.37079E-03 ppm1 5.353 ppm2 9.061 CV 1
ASSI { 1256}
(( segid " " and resid 99 and name HB2 ))
(( segid " " and resid 99 and name HN ))
3.600 1.700 1.700 peak 1256 spectrum 1 weight 0.10000E+01 volume 0.36568E-03 ppm1 2.497 ppm2 8.122 CV 1
ASSI { 1258}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HD22))
4.400 2.400 1.600 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.36568E-03 ppm1 2.744 ppm2 6.976 CV 1
ASSI { 1260}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 20 and name HN ))
2.300 2.300 3.700 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.36312E-03 ppm1 0.897 ppm2 7.859 CV 1
ASSI { 1264}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HN ))
3.300 1.400 1.400 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.36057E-03 ppm1 8.053 ppm2 8.486 CV 1
ASSI { 1266}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 71 and name HN ))
3.700 1.700 1.700 peak 1266 spectrum 1 weight 0.10000E+01 volume 0.35545E-03 ppm1 8.339 ppm2 9.592 CV 1
ASSI { 1267}
(( segid " " and resid 109 and name HA ))
( segid " " and resid 15 and name HG2%)
4.200 2.200 1.800 peak 1267 spectrum 1 weight 0.10000E+01 volume 0.35545E-03 ppm1 5.506 ppm2 1.160 CV 1
ASSI { 1268}
( segid " " and resid 89 and name HE% )
(( segid " " and resid 36 and name HE1 ))
3.800 1.800 1.800 peak 1268 spectrum 1 weight 0.10000E+01 volume 0.35545E-03 ppm1 6.474 ppm2 10.272 CV 1
ASSI { 1270}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 23 and name HN ))
4.400 2.400 1.600 peak 1270 spectrum 1 weight 0.10000E+01 volume 0.35545E-03 ppm1 2.882 ppm2 8.713 CV 1
ASSI { 1272}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 11 and name HN ))
4.300 2.300 1.700 peak 1272 spectrum 1 weight 0.10000E+01 volume 0.35290E-03 ppm1 0.432 ppm2 9.674 CV 1
ASSI { 1274}
(( segid " " and resid 102 and name HG1 ))
(( segid " " and resid 102 and name HE ))
3.600 1.600 1.600 peak 1274 spectrum 1 weight 0.10000E+01 volume 0.35034E-03 ppm1 1.700 ppm2 7.160 CV 1
ASSI { 1275}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 88 and name HN ))
3.500 1.500 1.500 peak 1275 spectrum 1 weight 0.10000E+01 volume 0.35034E-03 ppm1 5.166 ppm2 9.389 CV 1
ASSI { 1276}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 97 and name HN ))
4.200 2.200 1.800 peak 1276 spectrum 1 weight 0.10000E+01 volume 0.35034E-03 ppm1 1.926 ppm2 8.808 CV 1
ASSI { 1278}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 50 and name HN ))
4.600 2.700 1.400 peak 1278 spectrum 1 weight 0.10000E+01 volume 0.34778E-03 ppm1 2.666 ppm2 7.313 CV 1
ASSI { 1279}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 89 and name HN ))
4.200 2.200 1.800 peak 1279 spectrum 1 weight 0.10000E+01 volume 0.34778E-03 ppm1 1.245 ppm2 8.547 CV 1
ASSI { 1281}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 14 and name HN ))
4.000 2.000 2.000 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.34778E-03 ppm1 0.784 ppm2 9.239 CV 1
ASSI { 1283}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 11 and name HN ))
4.200 2.200 1.800 peak 1283 spectrum 1 weight 0.10000E+01 volume 0.34778E-03 ppm1 1.535 ppm2 9.673 CV 1
ASSI { 1285}
(( segid " " and resid 36 and name HE3 ))
(( segid " " and resid 103 and name HN ))
4.000 2.000 2.000 peak 1285 spectrum 1 weight 0.10000E+01 volume 0.34266E-03 ppm1 7.073 ppm2 9.216 CV 1
ASSI { 1286}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 15 and name HN ))
4.500 2.500 1.500 peak 1286 spectrum 1 weight 0.10000E+01 volume 0.34266E-03 ppm1 0.273 ppm2 8.476 CV 1
ASSI { 1287}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 6 and name HN ))
4.400 2.400 1.600 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.34266E-03 ppm1 3.452 ppm2 10.250 CV 1
ASSI { 1288}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 62 and name HN ))
4.400 2.400 1.600 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.34266E-03 ppm1 1.959 ppm2 8.054 CV 1
ASSI { 1293}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 75 and name HN ))
3.700 1.700 1.700 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.33755E-03 ppm1 4.935 ppm2 9.798 CV 1
ASSI { 1294}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 75 and name HN ))
3.700 1.700 1.700 peak 1294 spectrum 1 weight 0.10000E+01 volume 0.33755E-03 ppm1 0.589 ppm2 9.792 CV 1
ASSI { 1298}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 48 and name HN ))
4.300 2.300 1.700 peak 1298 spectrum 1 weight 0.10000E+01 volume 0.33499E-03 ppm1 2.598 ppm2 9.017 CV 1
ASSI { 1299}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 25 and name HE22))
5.300 3.500 0.700 peak 1299 spectrum 1 weight 0.10000E+01 volume 0.33499E-03 ppm1 -0.653 ppm2 6.635 CV 1
ASSI { 1300}
(( segid " " and resid 91 and name HG1 ))
( segid " " and resid 34 and name HE% )
4.000 2.000 2.000 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.33244E-03 ppm1 0.332 ppm2 7.120 CV 1
ASSI { 1306}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 26 and name HN ))
3.600 1.600 1.600 peak 1306 spectrum 1 weight 0.11000E+01 volume 0.32732E-03 ppm1 -1.281 ppm2 8.557 CV 1
ASSI { 1309}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 36 and name HZ3 ))
4.200 2.300 1.800 peak 1309 spectrum 1 weight 0.11000E+01 volume 0.32221E-03 ppm1 -0.653 ppm2 6.749 CV 1
ASSI { 1310}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 74 and name HE1 ))
4.300 2.300 1.700 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.31965E-03 ppm1 0.634 ppm2 7.952 CV 1
ASSI { 1314}
(( segid " " and resid 36 and name HE3 ))
(( segid " " and resid 89 and name HN ))
3.800 1.800 1.800 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.31965E-03 ppm1 7.070 ppm2 8.541 CV 1
ASSI { 1316}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 86 and name HN ))
4.800 2.900 1.200 peak 1316 spectrum 1 weight 0.10000E+01 volume 0.31709E-03 ppm1 0.260 ppm2 8.768 CV 1
ASSI { 1319}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 74 and name HE1 ))
4.300 2.300 1.700 peak 1319 spectrum 1 weight 0.10000E+01 volume 0.31453E-03 ppm1 1.454 ppm2 7.952 CV 1
ASSI { 1320}
(( segid " " and resid 10 and name HB1 ))
(( segid " " and resid 10 and name HD21))
4.300 2.400 1.700 peak 1320 spectrum 1 weight 0.10000E+01 volume 0.31453E-03 ppm1 3.104 ppm2 7.808 CV 1
ASSI { 1322}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 24 and name HN ))
4.400 2.400 1.600 peak 1322 spectrum 1 weight 0.10000E+01 volume 0.31198E-03 ppm1 8.724 ppm2 9.060 CV 1
ASSI { 1323}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 83 and name HN ))
3.500 1.600 1.600 peak 1323 spectrum 1 weight 0.10000E+01 volume 0.31198E-03 ppm1 2.910 ppm2 9.022 CV 1
ASSI { 1328}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 8 and name HN ))
3.500 1.500 1.500 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.30942E-03 ppm1 1.857 ppm2 7.886 CV 1
ASSI { 1330}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 15 and name HN ))
3.800 1.800 1.800 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.30431E-03 ppm1 4.980 ppm2 8.475 CV 1
ASSI { 1334}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 100 and name HN ))
4.300 2.300 1.700 peak 1334 spectrum 1 weight 0.10000E+01 volume 0.29920E-03 ppm1 4.592 ppm2 7.543 CV 1
ASSI { 1340}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 61 and name HN ))
3.700 1.700 1.700 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.29664E-03 ppm1 1.957 ppm2 8.387 CV 1
ASSI { 1344}
(( segid " " and resid 84 and name HA ))
( segid " " and resid 85 and name HG2%)
4.700 2.800 1.300 peak 1344 spectrum 1 weight 0.10000E+01 volume 0.29408E-03 ppm1 4.501 ppm2 0.261 CV 1
ASSI { 1346}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 57 and name HD% )
2.400 2.400 3.600 peak 1346 spectrum 1 weight 0.11000E+01 volume 0.29408E-03 ppm1 -0.465 ppm2 7.201 CV 1
ASSI { 1347}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 23 and name HN ))
3.900 1.900 1.900 peak 1347 spectrum 1 weight 0.10000E+01 volume 0.29408E-03 ppm1 1.560 ppm2 8.724 CV 1
ASSI { 1353}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 108 and name HN ))
4.000 2.000 2.000 peak 1353 spectrum 1 weight 0.10000E+01 volume 0.28896E-03 ppm1 8.646 ppm2 9.140 CV 1
ASSI { 1354}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 9 and name HB1 ))
4.500 2.500 1.500 peak 1354 spectrum 1 weight 0.10000E+01 volume 0.28640E-03 ppm1 0.782 ppm2 3.459 CV 1
ASSI { 1359}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HN ))
3.400 1.500 1.500 peak 1359 spectrum 1 weight 0.11000E+01 volume 0.28385E-03 ppm1 4.890 ppm2 7.957 CV 1
ASSI { 1361}
( segid " " and resid 34 and name HD% )
(( segid " " and resid 91 and name HN ))
3.400 1.500 1.500 peak 1361 spectrum 1 weight 0.10000E+01 volume 0.28385E-03 ppm1 6.504 ppm2 7.634 CV 1
ASSI { 1362}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 38 and name HN ))
4.600 2.600 1.400 peak 1362 spectrum 1 weight 0.10000E+01 volume 0.28129E-03 ppm1 0.664 ppm2 8.939 CV 1
ASSI { 1364}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HN ))
4.000 2.000 2.000 peak 1364 spectrum 1 weight 0.10000E+01 volume 0.28129E-03 ppm1 4.289 ppm2 6.746 CV 1
ASSI { 1366}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 55 and name HD21))
4.100 2.100 1.900 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.28129E-03 ppm1 5.560 ppm2 7.514 CV 1
ASSI { 1369}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 110 and name HD21))
4.700 2.800 1.300 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.27874E-03 ppm1 1.221 ppm2 7.496 CV 1
ASSI { 1370}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 110 and name HN ))
5.300 3.600 0.700 peak 1370 spectrum 1 weight 0.10000E+01 volume 0.27618E-03 ppm1 0.508 ppm2 8.126 CV 1
ASSI { 1371}
(( segid " " and resid 40 and name HA1 ))
( segid " " and resid 37 and name HD% )
5.400 3.600 0.600 peak 1371 spectrum 1 weight 0.10000E+01 volume 0.27618E-03 ppm1 4.243 ppm2 6.834 CV 1
ASSI { 1373}
(( segid " " and resid 10 and name HN ))
(( segid " " and resid 11 and name HN ))
3.900 1.900 1.900 peak 1373 spectrum 1 weight 0.10000E+01 volume 0.27362E-03 ppm1 7.258 ppm2 9.674 CV 1
ASSI { 1375}
(( segid " " and resid 50 and name HG1 ))
(( segid " " and resid 51 and name HN ))
4.000 2.000 2.000 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.27107E-03 ppm1 2.754 ppm2 7.420 CV 1
ASSI { 1378}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 72 and name HN ))
5.100 3.200 0.900 peak 1378 spectrum 1 weight 0.10000E+01 volume 0.27107E-03 ppm1 2.304 ppm2 9.303 CV 1
ASSI { 1387}
(( segid " " and resid 91 and name HA ))
( segid " " and resid 37 and name HD% )
5.300 3.500 0.700 peak 1387 spectrum 1 weight 0.10000E+01 volume 0.25828E-03 ppm1 4.325 ppm2 6.827 CV 1
ASSI { 1388}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 83 and name HE1 ))
4.100 2.100 1.900 peak 1388 spectrum 1 weight 0.10000E+01 volume 0.25828E-03 ppm1 0.588 ppm2 7.821 CV 1
ASSI { 1389}
( segid " " and resid 34 and name HD% )
(( segid " " and resid 35 and name HN ))
4.800 2.900 1.200 peak 1389 spectrum 1 weight 0.10000E+01 volume 0.25828E-03 ppm1 6.500 ppm2 7.854 CV 1
ASSI { 1390}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HN ))
4.500 2.500 1.500 peak 1390 spectrum 1 weight 0.10000E+01 volume 0.25444E-03 ppm1 8.721 ppm2 9.380 CV 1
ASSI { 1391}
(( segid " " and resid 82 and name HN ))
(( segid " " and resid 83 and name HN ))
4.600 2.700 1.400 peak 1391 spectrum 1 weight 0.10000E+01 volume 0.25086E-03 ppm1 8.119 ppm2 9.020 CV 1
ASSI { 1393}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 36 and name HE3 ))
3.700 1.700 1.700 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.24856E-03 ppm1 0.044 ppm2 7.072 CV 1
ASSI { 1394}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 91 and name HE ))
3.600 1.600 1.600 peak 1394 spectrum 1 weight 0.11000E+01 volume 0.24703E-03 ppm1 0.342 ppm2 6.430 CV 1
ASSI { 1395}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 36 and name HE1 ))
3.900 1.900 1.900 peak 1395 spectrum 1 weight 0.11000E+01 volume 0.24396E-03 ppm1 5.578 ppm2 10.272 CV 1
ASSI { 1396}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 90 and name HN ))
4.300 2.300 1.700 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.24344E-03 ppm1 7.631 ppm2 8.961 CV 1
ASSI { 1404}
(( segid " " and resid 25 and name HE22))
(( segid " " and resid 71 and name HN ))
4.900 3.000 1.100 peak 1404 spectrum 1 weight 0.10000E+01 volume 0.23373E-03 ppm1 6.676 ppm2 9.596 CV 1
ASSI { 1406}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 70 and name HN ))
4.600 2.600 1.400 peak 1406 spectrum 1 weight 0.10000E+01 volume 0.23219E-03 ppm1 3.507 ppm2 8.389 CV 1
ASSI { 1407}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 99 and name HN ))
4.600 2.700 1.400 peak 1407 spectrum 1 weight 0.10000E+01 volume 0.23117E-03 ppm1 3.200 ppm2 8.123 CV 1
ASSI { 1412}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 45 and name HN ))
4.700 2.800 1.300 peak 1412 spectrum 1 weight 0.10000E+01 volume 0.22401E-03 ppm1 2.338 ppm2 8.269 CV 1
ASSI { 1414}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 38 and name HN ))
3.900 1.900 1.900 peak 1414 spectrum 1 weight 0.11000E+01 volume 0.22197E-03 ppm1 -0.806 ppm2 8.965 CV 1
ASSI { 1417}
(( segid " " and resid 50 and name HA ))
(( segid " " and resid 49 and name HN ))
4.800 2.900 1.200 peak 1417 spectrum 1 weight 0.10000E+01 volume 0.22094E-03 ppm1 4.449 ppm2 7.989 CV 1
ASSI { 1419}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name HN ))
4.200 2.200 1.800 peak 1419 spectrum 1 weight 0.10000E+01 volume 0.21915E-03 ppm1 4.121 ppm2 7.336 CV 1
ASSI { 1421}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 7 and name HN ))
4.500 2.500 1.500 peak 1421 spectrum 1 weight 0.10000E+01 volume 0.21890E-03 ppm1 1.599 ppm2 8.864 CV 1
ASSI { 1422}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 25 and name HE22))
5.400 3.700 0.600 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.21890E-03 ppm1 -1.280 ppm2 6.638 CV 1
ASSI { 1424}
(( segid " " and resid 32 and name HB ))
(( segid " " and resid 33 and name HN ))
4.500 2.500 1.500 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.21762E-03 ppm1 4.579 ppm2 7.815 CV 1
ASSI { 1425}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 51 and name HN ))
4.000 2.000 2.000 peak 1425 spectrum 1 weight 0.10000E+01 volume 0.21711E-03 ppm1 6.655 ppm2 7.419 CV 1
ASSI { 1427}
(( segid " " and resid 91 and name HG1 ))
( segid " " and resid 34 and name HD% )
3.300 3.300 2.700 peak 1427 spectrum 1 weight 0.11000E+01 volume 0.21455E-03 ppm1 0.338 ppm2 6.502 CV 1
ASSI { 1428}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 71 and name HN ))
4.500 2.500 1.500 peak 1428 spectrum 1 weight 0.10000E+01 volume 0.21404E-03 ppm1 2.322 ppm2 9.594 CV 1
ASSI { 1429}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 52 and name HN ))
4.700 2.800 1.300 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.21353E-03 ppm1 0.905 ppm2 8.825 CV 1
ASSI { 1430}
( segid " " and resid 89 and name HE% )
(( segid " " and resid 36 and name HN ))
4.200 2.200 1.800 peak 1430 spectrum 1 weight 0.10000E+01 volume 0.21276E-03 ppm1 6.473 ppm2 8.915 CV 1
ASSI { 1434}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 21 and name HN ))
5.500 3.800 0.500 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.20688E-03 ppm1 2.264 ppm2 8.213 CV 1
ASSI { 1435}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 29 and name HD22))
4.600 2.700 1.400 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.20636E-03 ppm1 5.582 ppm2 6.944 CV 1
ASSI { 1436}
(( segid " " and resid 91 and name HA ))
( segid " " and resid 37 and name HE% )
4.900 3.000 1.100 peak 1436 spectrum 1 weight 0.10000E+01 volume 0.20586E-03 ppm1 4.304 ppm2 6.687 CV 1
ASSI { 1437}
(( segid " " and resid 36 and name HH2 ))
(( segid " " and resid 36 and name HE1 ))
4.800 2.900 1.200 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.20534E-03 ppm1 6.760 ppm2 10.260 CV 1
ASSI { 1440}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 93 and name HZ2 ))
4.600 2.600 1.400 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.20432E-03 ppm1 0.353 ppm2 7.403 CV 1
ASSI { 1441}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 75 and name HN ))
4.300 2.300 1.700 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.20381E-03 ppm1 1.298 ppm2 9.792 CV 1
ASSI { 1446}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 25 and name HE22))
5.100 3.300 0.900 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.19946E-03 ppm1 0.125 ppm2 6.639 CV 1
ASSI { 1448}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 106 and name HE% )
4.700 2.800 1.300 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.19819E-03 ppm1 4.296 ppm2 6.578 CV 1
ASSI { 1456}
(( segid " " and resid 29 and name HB1 ))
(( segid " " and resid 29 and name HD22))
4.900 3.000 1.100 peak 1456 spectrum 1 weight 0.10000E+01 volume 0.19051E-03 ppm1 3.203 ppm2 6.977 CV 1
ASSI { 1458}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 6 and name HN ))
5.000 3.100 1.000 peak 1458 spectrum 1 weight 0.11000E+01 volume 0.18821E-03 ppm1 0.125 ppm2 10.255 CV 1
ASSI { 1459}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 93 and name HZ3 ))
5.200 3.400 0.800 peak 1459 spectrum 1 weight 0.10000E+01 volume 0.18770E-03 ppm1 1.372 ppm2 7.206 CV 1
ASSI { 1461}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 39 and name HN ))
5.100 3.200 0.900 peak 1461 spectrum 1 weight 0.11000E+01 volume 0.18693E-03 ppm1 -0.807 ppm2 9.167 CV 1
ASSI { 1462}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 47 and name HN ))
4.700 2.800 1.300 peak 1462 spectrum 1 weight 0.10000E+01 volume 0.18693E-03 ppm1 2.273 ppm2 7.561 CV 1
ASSI { 1464}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 8 and name HN ))
5.000 3.200 1.000 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.18284E-03 ppm1 1.706 ppm2 7.888 CV 1
ASSI { 1468}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 106 and name HB2 ))
5.400 3.600 0.600 peak 1468 spectrum 1 weight 0.10000E+01 volume 0.17721E-03 ppm1 1.330 ppm2 2.413 CV 1
ASSI { 1469}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 25 and name HN ))
4.000 2.000 2.000 peak 1469 spectrum 1 weight 0.10000E+01 volume 0.17594E-03 ppm1 5.157 ppm2 8.414 CV 1
ASSI { 1470}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HN ))
5.100 3.300 0.900 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.17364E-03 ppm1 8.268 ppm2 8.502 CV 1
ASSI { 1471}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 56 and name HN ))
4.800 2.900 1.200 peak 1471 spectrum 1 weight 0.10000E+01 volume 0.17261E-03 ppm1 2.249 ppm2 8.334 CV 1
ASSI { 1473}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 36 and name HD1 ))
4.700 2.700 1.300 peak 1473 spectrum 1 weight 0.10000E+01 volume 0.17159E-03 ppm1 5.007 ppm2 7.399 CV 1
ASSI { 1476}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 88 and name HN ))
5.700 4.000 0.300 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.16903E-03 ppm1 -0.464 ppm2 9.385 CV 1
ASSI { 1479}
(( segid " " and resid 81 and name HA1 ))
(( segid " " and resid 47 and name HD22))
4.300 2.300 1.700 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.16673E-03 ppm1 4.284 ppm2 6.988 CV 1
ASSI { 1483}
( segid " " and resid 34 and name HD% )
(( segid " " and resid 90 and name HN ))
4.700 2.800 1.300 peak 1483 spectrum 1 weight 0.10000E+01 volume 0.16213E-03 ppm1 6.502 ppm2 8.973 CV 1
ASSI { 1486}
(( segid " " and resid 2 and name HB1 ))
(( segid " " and resid 3 and name HD2 ))
4.900 3.000 1.100 peak 1486 spectrum 1 weight 0.10000E+01 volume 0.16187E-03 ppm1 3.741 ppm2 6.989 CV 1
ASSI { 1488}
(( segid " " and resid 110 and name HN ))
(( segid " " and resid 18 and name HN ))
4.100 2.100 1.900 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.16034E-03 ppm1 8.124 ppm2 8.412 CV 1
ASSI { 1495}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 107 and name HN ))
4.700 2.700 1.300 peak 1495 spectrum 1 weight 0.10000E+01 volume 0.15752E-03 ppm1 0.463 ppm2 9.179 CV 1
ASSI { 1496}
(( segid " " and resid 60 and name HB1 ))
(( segid " " and resid 61 and name HN ))
4.800 2.900 1.200 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.15676E-03 ppm1 2.219 ppm2 8.389 CV 1
ASSI { 1498}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 72 and name HN ))
5.100 3.300 0.900 peak 1498 spectrum 1 weight 0.10000E+01 volume 0.15624E-03 ppm1 1.884 ppm2 9.299 CV 1
ASSI { 1500}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 25 and name HN ))
4.700 2.800 1.300 peak 1500 spectrum 1 weight 0.11000E+01 volume 0.15599E-03 ppm1 8.942 ppm2 8.417 CV 1
ASSI { 1502}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 10 and name HN ))
4.100 2.100 1.900 peak 1502 spectrum 1 weight 0.10000E+01 volume 0.15522E-03 ppm1 3.290 ppm2 7.259 CV 1
ASSI { 1503}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 11 and name HN ))
4.800 2.900 1.200 peak 1503 spectrum 1 weight 0.10000E+01 volume 0.15471E-03 ppm1 3.279 ppm2 9.670 CV 1
ASSI { 1504}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 83 and name HD2 ))
4.700 2.700 1.300 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.15318E-03 ppm1 0.260 ppm2 6.737 CV 1
ASSI { 1508}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 3 and name HE1 ))
4.400 2.400 1.600 peak 1508 spectrum 1 weight 0.10000E+01 volume 0.14781E-03 ppm1 0.579 ppm2 8.300 CV 1
ASSI { 1513}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 9 and name HN ))
5.400 3.600 0.600 peak 1513 spectrum 1 weight 0.10000E+01 volume 0.14320E-03 ppm1 0.844 ppm2 8.173 CV 1
ASSI { 1517}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 73 and name HN ))
4.200 2.300 1.800 peak 1517 spectrum 1 weight 0.11000E+01 volume 0.14115E-03 ppm1 0.126 ppm2 9.603 CV 1
ASSI { 1519}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 38 and name HZ ))
5.000 3.100 1.000 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.14090E-03 ppm1 0.651 ppm2 7.266 CV 1
ASSI { 1520}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HN ))
4.500 2.500 1.500 peak 1520 spectrum 1 weight 0.10000E+01 volume 0.13860E-03 ppm1 7.565 ppm2 9.015 CV 1
ASSI { 1521}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HN ))
4.600 2.600 1.400 peak 1521 spectrum 1 weight 0.11000E+01 volume 0.13783E-03 ppm1 8.862 ppm2 10.238 CV 1
ASSI { 1523}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 76 and name HN ))
4.800 2.900 1.200 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.13348E-03 ppm1 1.237 ppm2 8.716 CV 1
ASSI { 1527}
( segid " " and resid 103 and name HD% )
(( segid " " and resid 11 and name HN ))
5.300 3.500 0.700 peak 1527 spectrum 1 weight 0.10000E+01 volume 0.13298E-03 ppm1 6.695 ppm2 9.671 CV 1
ASSI { 1528}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 83 and name HE1 ))
5.200 3.300 0.800 peak 1528 spectrum 1 weight 0.10000E+01 volume 0.13272E-03 ppm1 0.895 ppm2 7.778 CV 1
ASSI { 1529}
(( segid " " and resid 108 and name HD1 ))
(( segid " " and resid 110 and name HD22))
4.400 2.400 1.600 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.13144E-03 ppm1 1.479 ppm2 6.640 CV 1
ASSI { 1531}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 36 and name HE1 ))
4.600 2.600 1.400 peak 1531 spectrum 1 weight 0.11000E+01 volume 0.12940E-03 ppm1 -0.651 ppm2 10.272 CV 1
ASSI { 1533}
(( segid " " and resid 27 and name HB1 ))
(( segid " " and resid 29 and name HD22))
5.800 4.200 0.200 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.12632E-03 ppm1 2.406 ppm2 6.987 CV 1
ASSI { 1540}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 95 and name HN ))
3.500 3.500 2.500 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.12044E-03 ppm1 0.836 ppm2 7.587 CV 1
ASSI { 1542}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 79 and name HN ))
4.700 2.700 1.300 peak 1542 spectrum 1 weight 0.10000E+01 volume 0.11865E-03 ppm1 0.818 ppm2 7.323 CV 1
ASSI { 1543}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 36 and name HD1 ))
5.200 3.400 0.800 peak 1543 spectrum 1 weight 0.10000E+01 volume 0.11815E-03 ppm1 1.350 ppm2 7.417 CV 1
ASSI { 1555}
(( segid " " and resid 98 and name HB1 ))
(( segid " " and resid 98 and name HD2 ))
4.700 2.700 1.300 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.10970E-03 ppm1 3.259 ppm2 7.229 CV 1
ASSI { 1557}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 5 and name HN ))
5.900 4.300 0.100 peak 1557 spectrum 1 weight 0.11000E+01 volume 0.10868E-03 ppm1 0.132 ppm2 8.947 CV 1
ASSI { 1559}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 29 and name HN ))
5.100 3.200 0.900 peak 1559 spectrum 1 weight 0.10000E+01 volume 0.10766E-03 ppm1 3.578 ppm2 8.222 CV 1
ASSI { 1563}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 50 and name HN ))
5.800 4.200 0.200 peak 1563 spectrum 1 weight 0.10000E+01 volume 0.10459E-03 ppm1 2.902 ppm2 7.313 CV 1
ASSI { 1565}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 72 and name HN ))
4.600 2.600 1.400 peak 1565 spectrum 1 weight 0.10000E+01 volume 0.10408E-03 ppm1 0.429 ppm2 9.332 CV 1
ASSI { 1569}
(( segid " " and resid 20 and name HG1 ))
(( segid " " and resid 20 and name HN ))
4.900 3.000 1.100 peak 1569 spectrum 1 weight 0.10000E+01 volume 0.10050E-03 ppm1 2.408 ppm2 7.861 CV 1
ASSI { 1571}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 25 and name HN ))
5.700 4.000 0.300 peak 1571 spectrum 1 weight 0.10000E+01 volume 0.99735E-04 ppm1 0.597 ppm2 8.420 CV 1
ASSI { 1572}
(( segid " " and resid 3 and name HB1 ))
(( segid " " and resid 17 and name HN ))
5.200 3.300 0.800 peak 1572 spectrum 1 weight 0.10000E+01 volume 0.98960E-04 ppm1 3.039 ppm2 8.337 CV 1
ASSI { 1573}
(( segid " " and resid 81 and name HA2 ))
(( segid " " and resid 47 and name HD22))
5.600 4.000 0.400 peak 1573 spectrum 1 weight 0.10000E+01 volume 0.98960E-04 ppm1 3.690 ppm2 6.989 CV 1
ASSI { 1578}
(( segid " " and resid 74 and name HB2 ))
(( segid " " and resid 74 and name HE1 ))
5.800 4.200 0.200 peak 1578 spectrum 1 weight 0.10000E+01 volume 0.93597E-04 ppm1 2.996 ppm2 7.952 CV 1
ASSI { 1579}
( segid " " and resid 6 and name HG2%)
(( segid " " and resid 72 and name HE1 ))
5.600 3.900 0.400 peak 1579 spectrum 1 weight 0.10000E+01 volume 0.91549E-04 ppm1 1.071 ppm2 7.953 CV 1
ASSI { 1580}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 86 and name HN ))
4.900 3.000 1.100 peak 1580 spectrum 1 weight 0.10000E+01 volume 0.90266E-04 ppm1 7.497 ppm2 8.769 CV 1
ASSI { 1581}
(( segid " " and resid 56 and name HD1 ))
( segid " " and resid 57 and name HD% )
5.300 3.400 0.700 peak 1581 spectrum 1 weight 0.10000E+01 volume 0.89251E-04 ppm1 1.441 ppm2 7.205 CV 1
ASSI { 1584}
(( segid " " and resid 98 and name HB2 ))
(( segid " " and resid 98 and name HD2 ))
5.000 3.200 1.000 peak 1584 spectrum 1 weight 0.10000E+01 volume 0.86686E-04 ppm1 3.196 ppm2 7.229 CV 1
ASSI { 1589}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 110 and name HD21))
6.000 4.600 0.000 peak 1589 spectrum 1 weight 0.10000E+01 volume 0.84643E-04 ppm1 0.972 ppm2 7.504 CV 1
ASSI { 1596}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 41 and name HN ))
4.500 2.500 1.500 peak 1596 spectrum 1 weight 0.10000E+01 volume 0.79274E-04 ppm1 3.437 ppm2 8.647 CV 1
ASSI { 1597}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 21 and name HN ))
5.300 3.500 0.700 peak 1597 spectrum 1 weight 0.10000E+01 volume 0.78506E-04 ppm1 0.719 ppm2 8.214 CV 1
ASSI { 1599}
(( segid " " and resid 46 and name HB1 ))
(( segid " " and resid 48 and name HN ))
6.000 4.500 0.000 peak 1599 spectrum 1 weight 0.10000E+01 volume 0.76204E-04 ppm1 2.298 ppm2 9.015 CV 1
ASSI { 1602}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 49 and name HN ))
6.000 4.400 0.000 peak 1602 spectrum 1 weight 0.10000E+01 volume 0.71346E-04 ppm1 7.420 ppm2 7.988 CV 1
ASSI { 1607}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 25 and name HE21))
5.100 3.300 0.900 peak 1607 spectrum 1 weight 0.10000E+01 volume 0.68021E-04 ppm1 1.554 ppm2 7.244 CV 1
ASSI { 1608}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 51 and name HN ))
4.800 2.900 1.200 peak 1608 spectrum 1 weight 0.10000E+01 volume 0.67766E-04 ppm1 2.222 ppm2 7.418 CV 1
ASSI { 1609}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 3 and name HD2 ))
4.400 2.400 1.600 peak 1609 spectrum 1 weight 0.10000E+01 volume 0.67766E-04 ppm1 2.762 ppm2 7.019 CV 1
ASSI { 1611}
( segid " " and resid 64 and name HD2%)
(( segid " " and resid 65 and name HN ))
6.000 4.600 0.000 peak 1611 spectrum 1 weight 0.10000E+01 volume 0.66999E-04 ppm1 0.820 ppm2 8.116 CV 1
ASSI { 1612}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 26 and name HN ))
5.700 4.100 0.300 peak 1612 spectrum 1 weight 0.10000E+01 volume 0.66232E-04 ppm1 3.037 ppm2 8.547 CV 1
ASSI { 1614}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 47 and name HN ))
5.000 3.100 1.000 peak 1614 spectrum 1 weight 0.10000E+01 volume 0.63930E-04 ppm1 4.289 ppm2 7.583 CV 1
ASSI { 1618}
(( segid " " and resid 43 and name HD1 ))
( segid " " and resid 38 and name HD% )
6.000 4.600 0.000 peak 1618 spectrum 1 weight 0.10000E+01 volume 0.61884E-04 ppm1 1.651 ppm2 7.506 CV 1
ASSI { 1623}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 70 and name HN ))
5.700 4.100 0.300 peak 1623 spectrum 1 weight 0.10000E+01 volume 0.59583E-04 ppm1 2.336 ppm2 8.384 CV 1
ASSI { 1624}
(( segid " " and resid 104 and name HA ))
( segid " " and resid 103 and name HE% )
5.600 3.900 0.400 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.58304E-04 ppm1 5.334 ppm2 6.942 CV 1
ASSI { 1626}
(( segid " " and resid 20 and name HG1 ))
(( segid " " and resid 21 and name HN ))
6.000 5.700 0.000 peak 1626 spectrum 1 weight 0.10000E+01 volume 0.54980E-04 ppm1 2.412 ppm2 8.215 CV 1
ASSI { 1627}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 51 and name HN ))
5.700 4.100 0.300 peak 1627 spectrum 1 weight 0.10000E+01 volume 0.54724E-04 ppm1 2.896 ppm2 7.421 CV 1
ASSI { 1628}
( segid " " and resid 37 and name HD% )
(( segid " " and resid 35 and name HN ))
5.200 3.300 0.800 peak 1628 spectrum 1 weight 0.10000E+01 volume 0.54469E-04 ppm1 6.830 ppm2 7.852 CV 1
ASSI { 1630}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HN ))
5.400 3.700 0.600 peak 1630 spectrum 1 weight 0.10000E+01 volume 0.53445E-04 ppm1 0.633 ppm2 8.211 CV 1
ASSI { 1631}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 74 and name HB2 ))
5.600 3.900 0.400 peak 1631 spectrum 1 weight 0.10000E+01 volume 0.53190E-04 ppm1 2.178 ppm2 3.019 CV 1
ASSI { 1633}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 38 and name HD% )
6.000 5.300 0.000 peak 1633 spectrum 1 weight 0.11000E+01 volume 0.52678E-04 ppm1 -0.465 ppm2 7.496 CV 1
ASSI { 1634}
(( segid " " and resid 101 and name HG1 ))
(( segid " " and resid 102 and name HN ))
4.500 4.500 1.500 peak 1634 spectrum 1 weight 0.10000E+01 volume 0.50121E-04 ppm1 2.290 ppm2 8.486 CV 1
ASSI { 1640}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 25 and name HN ))
5.800 4.200 0.200 peak 1640 spectrum 1 weight 0.11000E+01 volume 0.45007E-04 ppm1 -0.652 ppm2 8.428 CV 1
ASSI { 1642}
(( segid " " and resid 56 and name HB1 ))
(( segid " " and resid 56 and name HN ))
5.600 3.900 0.400 peak 1642 spectrum 1 weight 0.10000E+01 volume 0.44495E-04 ppm1 1.476 ppm2 8.333 CV 1
OR { 1642}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 56 and name HN ))
ASSI { 1643}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 53 and name HN ))
5.700 4.100 0.300 peak 1643 spectrum 1 weight 0.10000E+01 volume 0.44240E-04 ppm1 8.274 ppm2 8.897 CV 1
ASSI { 1644}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 75 and name HN ))
6.000 4.800 0.000 peak 1644 spectrum 1 weight 0.11000E+01 volume 0.43984E-04 ppm1 8.724 ppm2 9.791 CV 1
ASSI { 1645}
( segid " " and resid 85 and name HG2%)
( segid " " and resid 38 and name HE% )
6.000 5.000 0.000 peak 1645 spectrum 1 weight 0.10000E+01 volume 0.43728E-04 ppm1 0.261 ppm2 6.875 CV 1
ASSI { 1646}
(( segid " " and resid 46 and name HG1 ))
(( segid " " and resid 47 and name HN ))
6.000 5.500 0.000 peak 1646 spectrum 1 weight 0.10000E+01 volume 0.43217E-04 ppm1 1.999 ppm2 7.562 CV 1
ASSI { 1647}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 26 and name HN ))
5.800 4.100 0.200 peak 1647 spectrum 1 weight 0.11000E+01 volume 0.43217E-04 ppm1 0.129 ppm2 8.548 CV 1
ASSI { 1649}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 58 and name HN ))
5.800 4.200 0.200 peak 1649 spectrum 1 weight 0.10000E+01 volume 0.42449E-04 ppm1 3.104 ppm2 8.485 CV 1
ASSI { 1653}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 52 and name HN ))
5.800 4.200 0.200 peak 1653 spectrum 1 weight 0.10000E+01 volume 0.41427E-04 ppm1 0.585 ppm2 8.824 CV 1
ASSI { 1654}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 36 and name HZ3 ))
6.000 5.600 0.000 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.39892E-04 ppm1 -0.806 ppm2 6.751 CV 1
ASSI { 1655}
(( segid " " and resid 109 and name HA ))
( segid " " and resid 77 and name HG1%)
5.800 4.100 0.200 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.36568E-04 ppm1 5.513 ppm2 0.945 CV 1
ASSI { 1662}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 21 and name HN ))
6.000 5.000 0.000 peak 1662 spectrum 1 weight 0.10000E+01 volume 0.34011E-04 ppm1 4.631 ppm2 8.216 CV 1
ASSI { 1667}
(( segid " " and resid 6 and name HA ))
( segid " " and resid 103 and name HE% )
6.000 4.600 0.000 peak 1667 spectrum 1 weight 0.10000E+01 volume 0.32221E-04 ppm1 5.162 ppm2 6.941 CV 1
ASSI { 1668}
(( segid " " and resid 108 and name HB1 ))
(( segid " " and resid 110 and name HD22))
5.600 3.900 0.400 peak 1668 spectrum 1 weight 0.10000E+01 volume 0.32221E-04 ppm1 1.779 ppm2 6.639 CV 1
ASSI { 1669}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 73 and name HN ))
6.000 4.900 0.000 peak 1669 spectrum 1 weight 0.10000E+01 volume 0.31709E-04 ppm1 0.590 ppm2 9.600 CV 1
OR { 1669}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 73 and name HN ))
ASSI { 1673}
( segid " " and resid 26 and name HD1%)
( segid " " and resid 103 and name HE% )
6.000 4.600 0.000 peak 1673 spectrum 1 weight 0.10000E+01 volume 0.30175E-04 ppm1 -0.653 ppm2 6.883 CV 1
ASSI { 1674}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 44 and name HN ))
5.900 4.300 0.100 peak 1674 spectrum 1 weight 0.10000E+01 volume 0.29664E-04 ppm1 7.499 ppm2 7.952 CV 1
ASSI { 1675}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 75 and name HN ))
6.000 5.300 0.000 peak 1675 spectrum 1 weight 0.11000E+01 volume 0.29152E-04 ppm1 9.601 ppm2 9.788 CV 1
ASSI { 1678}
(( segid " " and resid 59 and name HA ))
(( segid " " and resid 69 and name HN ))
6.000 5.500 0.000 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.28385E-04 ppm1 4.509 ppm2 8.213 CV 1
ASSI { 1679}
(( segid " " and resid 110 and name HB2 ))
(( segid " " and resid 110 and name HD21))
5.600 3.900 0.400 peak 1679 spectrum 1 weight 0.10000E+01 volume 0.28129E-04 ppm1 2.663 ppm2 7.503 CV 1
OR { 1679}
(( segid " " and resid 110 and name HB1 ))
(( segid " " and resid 110 and name HD21))
ASSI { 1682}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HN ))
5.700 4.100 0.300 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.24089E-04 ppm1 4.399 ppm2 8.504 CV 1
ASSI { 1690}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 86 and name HD21))
6.000 4.500 0.000 peak 1690 spectrum 1 weight 0.10000E+01 volume 0.17286E-04 ppm1 5.390 ppm2 7.562 CV 1
ASSI { 1691}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 22 and name HN ))
6.000 5.700 0.000 peak 1691 spectrum 1 weight 0.10000E+01 volume 0.17159E-04 ppm1 8.214 ppm2 9.387 CV 1
ASSI { 1692}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 15 and name HN ))
6.000 6.000 0.000 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.17107E-04 ppm1 1.166 ppm2 8.472 CV 1
ASSI { 1694}
(( segid " " and resid 27 and name HB1 ))
(( segid " " and resid 70 and name HN ))
6.000 6.000 0.000 peak 1694 spectrum 1 weight 0.10000E+01 volume 0.15599E-04 ppm1 2.406 ppm2 8.380 CV 1
ASSI { 1699}
(( segid " " and resid 81 and name HA1 ))
(( segid " " and resid 81 and name HN ))
6.000 5.200 0.000 peak 1699 spectrum 1 weight 0.10000E+01 volume 0.12965E-04 ppm1 4.241 ppm2 8.450 CV 1
ASSI { 1703}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HE22))
6.000 6.000 0.000 peak 1703 spectrum 1 weight 0.10000E+01 volume 0.11789E-04 ppm1 1.171 ppm2 6.674 CV 1
ASSI { 1705}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 84 and name HN ))
6.000 5.200 0.000 peak 1705 spectrum 1 weight 0.11000E+01 volume 0.11098E-04 ppm1 4.500 ppm2 9.063 CV 1
ASSI { 1706}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 92 and name HD1 ))
6.000 6.000 0.000 peak 1706 spectrum 1 weight 0.10000E+01 volume 0.99984E-05 ppm1 1.300 ppm2 3.567 CV 1
ASSI { 1707}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 21 and name HN ))
6.000 5.800 0.000 peak 1707 spectrum 1 weight 0.10000E+01 volume 0.94105E-05 ppm1 7.867 ppm2 8.211 CV 1
ASSI { 1713}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 91 and name HN ))
6.000 6.000 0.000 peak 1713 spectrum 1 weight 0.10000E+01 volume 0.26339E-05 ppm1 0.349 ppm2 7.638 CV 1
ASSI { 1715}
(( segid " " and resid 93 and name HA ))
(( segid " " and resid 94 and name HN ))
6.000 6.000 0.000 peak 1715 spectrum 1 weight 0.10000E+01 volume 0.21097E-05 ppm1 4.548 ppm2 6.745 CV 1
ASSI { 1716}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 69 and name HN ))
6.000 6.000 0.000 peak 1716 spectrum 1 weight 0.10000E+01 volume 0.19332E-05 ppm1 3.507 ppm2 8.216 CV 1
ASSI { 6}
(( segid " " and resid 59 and name HG1 ))
(( segid " " and resid 59 and name HD2 ))
1.900 0.500 0.500 peak 6 spectrum 1 weight 0.10000E+01 volume 0.17736E-01 ppm1 2.023 ppm2 3.552 CV 1
ASSI { 7}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 78 and name HB1 ))
1.600 0.300 0.600 peak 7 spectrum 1 weight 0.10000E+01 volume 0.15875E-01 ppm1 1.347 ppm2 1.812 CV 1
ASSI { 8}
(( segid " " and resid 110 and name HB1 ))
(( segid " " and resid 110 and name HA ))
2.000 0.500 0.500 peak 8 spectrum 1 weight 0.10000E+01 volume 0.15765E-01 ppm1 2.697 ppm2 4.534 CV 1
ASSI { 10}
(( segid " " and resid 27 and name HB1 ))
(( segid " " and resid 27 and name HG2 ))
2.300 0.600 0.600 peak 10 spectrum 1 weight 0.10000E+01 volume 0.14670E-01 ppm1 2.404 ppm2 2.016 CV 1
ASSI { 12}
(( segid " " and resid 11 and name HA2 ))
(( segid " " and resid 11 and name HA1 ))
1.800 0.400 0.400 peak 12 spectrum 1 weight 0.10000E+01 volume 0.14342E-01 ppm1 3.367 ppm2 4.243 CV 1
ASSI { 13}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HB1 ))
1.800 0.400 0.400 peak 13 spectrum 1 weight 0.10000E+01 volume 0.14123E-01 ppm1 2.744 ppm2 3.214 CV 1
ASSI { 15}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 42 and name HG2%)
2.100 0.600 0.600 peak 15 spectrum 1 weight 0.10000E+01 volume 0.13904E-01 ppm1 4.392 ppm2 1.242 CV 1
ASSI { 16}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HG1 ))
1.600 0.300 0.600 peak 16 spectrum 1 weight 0.10000E+01 volume 0.13794E-01 ppm1 1.161 ppm2 1.839 CV 1
ASSI { 17}
(( segid " " and resid 52 and name HB ))
( segid " " and resid 52 and name HG2%)
2.100 0.600 0.600 peak 17 spectrum 1 weight 0.10000E+01 volume 0.13794E-01 ppm1 4.364 ppm2 1.251 CV 1
ASSI { 19}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 18 and name HG1%)
2.100 0.500 0.500 peak 19 spectrum 1 weight 0.10000E+01 volume 0.13576E-01 ppm1 3.202 ppm2 0.780 CV 1
ASSI { 21}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HD1 ))
2.300 2.300 3.700 peak 21 spectrum 1 weight 0.10000E+01 volume 0.12699E-01 ppm1 4.900 ppm2 1.646 CV 1
ASSI { 22}
(( segid " " and resid 76 and name HB ))
( segid " " and resid 76 and name HG2%)
2.100 0.500 0.500 peak 22 spectrum 1 weight 0.10000E+01 volume 0.12481E-01 ppm1 4.039 ppm2 0.933 CV 1
ASSI { 23}
(( segid " " and resid 94 and name HB ))
( segid " " and resid 94 and name HG2%)
2.000 0.500 0.500 peak 23 spectrum 1 weight 0.10000E+01 volume 0.11933E-01 ppm1 3.976 ppm2 0.842 CV 1
ASSI { 24}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 31 and name HB ))
2.100 0.600 0.600 peak 24 spectrum 1 weight 0.10000E+01 volume 0.11933E-01 ppm1 1.322 ppm2 4.251 CV 1
ASSI { 27}
(( segid " " and resid 15 and name HB ))
( segid " " and resid 15 and name HG2%)
2.200 0.600 0.600 peak 27 spectrum 1 weight 0.10000E+01 volume 0.11495E-01 ppm1 4.048 ppm2 1.169 CV 1
ASSI { 29}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 26 and name HB2 ))
2.000 0.500 0.500 peak 29 spectrum 1 weight 0.10000E+01 volume 0.11057E-01 ppm1 -1.271 ppm2 0.432 CV 1
ASSI { 30}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 26 and name HB2 ))
2.500 0.800 0.800 peak 30 spectrum 1 weight 0.10000E+01 volume 0.11057E-01 ppm1 -0.642 ppm2 0.413 CV 1
ASSI { 31}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 100 and name HA ))
2.400 2.400 3.600 peak 31 spectrum 1 weight 0.10000E+01 volume 0.10948E-01 ppm1 1.307 ppm2 4.486 CV 1
ASSI { 32}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB1 ))
2.300 0.700 0.700 peak 32 spectrum 1 weight 0.10000E+01 volume 0.10806E-01 ppm1 4.125 ppm2 3.796 CV 1
ASSI { 37}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 91 and name HA ))
2.600 2.600 3.400 peak 37 spectrum 1 weight 0.10000E+01 volume 0.10258E-01 ppm1 1.246 ppm2 4.359 CV 1
ASSI { 38}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 16 and name HN ))
2.000 0.500 0.500 peak 38 spectrum 1 weight 0.10000E+01 volume 0.10214E-01 ppm1 4.985 ppm2 8.676 CV 1
ASSI { 39}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 12 and name HB% )
2.100 0.600 0.600 peak 39 spectrum 1 weight 0.10000E+01 volume 0.10138E-01 ppm1 4.385 ppm2 1.501 CV 1
ASSI { 40}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 82 and name HA ))
2.100 0.500 0.500 peak 40 spectrum 1 weight 0.10000E+01 volume 0.10115E-01 ppm1 0.942 ppm2 4.933 CV 1
ASSI { 41}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HG ))
2.000 0.500 0.500 peak 41 spectrum 1 weight 0.10000E+01 volume 0.10115E-01 ppm1 -0.458 ppm2 0.625 CV 1
ASSI { 42}
(( segid " " and resid 80 and name HA ))
( segid " " and resid 80 and name HB% )
2.200 0.600 0.600 peak 42 spectrum 1 weight 0.10000E+01 volume 0.95465E-02 ppm1 3.997 ppm2 1.389 CV 1
ASSI { 43}
(( segid " " and resid 79 and name HA ))
( segid " " and resid 79 and name HB% )
2.200 0.600 0.600 peak 43 spectrum 1 weight 0.10000E+01 volume 0.93055E-02 ppm1 4.698 ppm2 1.574 CV 1
ASSI { 47}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 16 and name HB ))
2.100 0.600 0.600 peak 47 spectrum 1 weight 0.10000E+01 volume 0.91084E-02 ppm1 0.519 ppm2 2.029 CV 1
ASSI { 52}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 62 and name HA ))
2.400 0.700 0.700 peak 52 spectrum 1 weight 0.10000E+01 volume 0.86600E-02 ppm1 3.940 ppm2 4.290 CV 1
ASSI { 53}
(( segid " " and resid 75 and name HA ))
(( segid " " and resid 76 and name HN ))
2.100 0.500 0.500 peak 53 spectrum 1 weight 0.10000E+01 volume 0.85174E-02 ppm1 5.142 ppm2 8.734 CV 1
ASSI { 54}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 75 and name HB ))
2.200 0.600 0.600 peak 54 spectrum 1 weight 0.10000E+01 volume 0.84736E-02 ppm1 0.933 ppm2 2.005 CV 1
ASSI { 55}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 64 and name HA ))
2.300 0.700 0.700 peak 55 spectrum 1 weight 0.10000E+01 volume 0.84408E-02 ppm1 1.566 ppm2 4.316 CV 1
ASSI { 56}
(( segid " " and resid 96 and name HD1 ))
(( segid " " and resid 96 and name HG1 ))
2.000 0.500 0.500 peak 56 spectrum 1 weight 0.10000E+01 volume 0.84298E-02 ppm1 3.522 ppm2 1.985 CV 1
ASSI { 57}
( segid " " and resid 17 and name HB% )
(( segid " " and resid 17 and name HA ))
2.300 0.600 0.600 peak 57 spectrum 1 weight 0.10000E+01 volume 0.83751E-02 ppm1 1.327 ppm2 5.104 CV 1
ASSI { 58}
(( segid " " and resid 70 and name HB ))
( segid " " and resid 70 and name HG2%)
2.200 0.600 0.600 peak 58 spectrum 1 weight 0.10000E+01 volume 0.81562E-02 ppm1 3.803 ppm2 1.002 CV 1
ASSI { 59}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 24 and name HG12))
1.800 0.400 0.400 peak 59 spectrum 1 weight 0.10000E+01 volume 0.81124E-02 ppm1 1.564 ppm2 0.638 CV 1
ASSI { 62}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 50 and name HE% )
2.600 2.600 3.400 peak 62 spectrum 1 weight 0.10000E+01 volume 0.78496E-02 ppm1 4.068 ppm2 1.994 CV 1
ASSI { 64}
( segid " " and resid 26 and name HD1%)
( segid " " and resid 26 and name HD2%)
2.200 0.600 0.600 peak 64 spectrum 1 weight 0.10000E+01 volume 0.77182E-02 ppm1 -0.642 ppm2 -1.274 CV 1
ASSI { 65}
(( segid " " and resid 102 and name HD1 ))
(( segid " " and resid 102 and name HG1 ))
2.400 0.700 0.700 peak 65 spectrum 1 weight 0.10000E+01 volume 0.77073E-02 ppm1 3.147 ppm2 1.710 CV 1
ASSI { 68}
( segid " " and resid 17 and name HB% )
(( segid " " and resid 20 and name HG1 ))
2.400 2.400 3.600 peak 68 spectrum 1 weight 0.10000E+01 volume 0.76197E-02 ppm1 1.327 ppm2 2.373 CV 1
ASSI { 70}
(( segid " " and resid 22 and name HB ))
( segid " " and resid 21 and name HD1%)
2.800 2.800 3.200 peak 70 spectrum 1 weight 0.10000E+01 volume 0.74774E-02 ppm1 1.991 ppm2 0.698 CV 1
ASSI { 73}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 38 and name HA ))
2.200 0.600 0.600 peak 73 spectrum 1 weight 0.10000E+01 volume 0.72475E-02 ppm1 -0.807 ppm2 4.887 CV 1
ASSI { 77}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 14 and name HN ))
2.700 2.700 3.300 peak 77 spectrum 1 weight 0.10000E+01 volume 0.70394E-02 ppm1 5.098 ppm2 9.224 CV 1
ASSI { 78}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 87 and name HD2%)
2.200 0.600 0.600 peak 78 spectrum 1 weight 0.10000E+01 volume 0.70176E-02 ppm1 -0.458 ppm2 -0.802 CV 1
ASSI { 84}
(( segid " " and resid 2 and name HB1 ))
( segid " " and resid 22 and name HG2%)
2.400 0.700 0.700 peak 84 spectrum 1 weight 0.10000E+01 volume 0.67986E-02 ppm1 3.738 ppm2 0.680 CV 1
ASSI { 85}
(( segid " " and resid 4 and name HB1 ))
(( segid " " and resid 4 and name HA ))
2.200 0.600 0.600 peak 85 spectrum 1 weight 0.10000E+01 volume 0.67986E-02 ppm1 1.666 ppm2 4.898 CV 1
ASSI { 88}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 14 and name HG ))
2.300 0.700 0.700 peak 88 spectrum 1 weight 0.10000E+01 volume 0.66891E-02 ppm1 0.582 ppm2 1.334 CV 1
ASSI { 91}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 94 and name HB ))
2.300 0.700 0.700 peak 91 spectrum 1 weight 0.10000E+01 volume 0.65687E-02 ppm1 4.295 ppm2 3.958 CV 1
ASSI { 92}
(( segid " " and resid 65 and name HB1 ))
( segid " " and resid 65 and name HD2%)
2.500 0.800 0.800 peak 92 spectrum 1 weight 0.10000E+01 volume 0.64154E-02 ppm1 1.567 ppm2 0.884 CV 1
OR { 92}
(( segid " " and resid 65 and name HB1 ))
( segid " " and resid 65 and name HD1%)
ASSI { 96}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 87 and name HG ))
2.200 0.600 0.600 peak 96 spectrum 1 weight 0.10000E+01 volume 0.62622E-02 ppm1 -0.807 ppm2 0.641 CV 1
ASSI { 100}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 6 and name HB ))
2.300 0.700 0.700 peak 100 spectrum 1 weight 0.10000E+01 volume 0.61636E-02 ppm1 5.171 ppm2 4.717 CV 1
ASSI { 102}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 36 and name HZ2 ))
2.500 2.500 3.500 peak 102 spectrum 1 weight 0.10000E+01 volume 0.61527E-02 ppm1 3.924 ppm2 6.904 CV 1
ASSI { 106}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 24 and name HG11))
2.100 0.500 0.500 peak 106 spectrum 1 weight 0.10000E+01 volume 0.59994E-02 ppm1 0.610 ppm2 1.608 CV 1
ASSI { 107}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HB2 ))
1.900 0.400 0.400 peak 107 spectrum 1 weight 0.10000E+01 volume 0.59775E-02 ppm1 3.128 ppm2 2.652 CV 1
ASSI { 113}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 7 and name HD1 ))
2.200 0.600 0.600 peak 113 spectrum 1 weight 0.10000E+01 volume 0.58242E-02 ppm1 -0.642 ppm2 1.667 CV 1
ASSI { 114}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 42 and name HA ))
2.400 0.700 0.700 peak 114 spectrum 1 weight 0.10000E+01 volume 0.58242E-02 ppm1 1.230 ppm2 5.094 CV 1
ASSI { 115}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HB1 ))
2.600 0.900 0.900 peak 115 spectrum 1 weight 0.10000E+01 volume 0.58242E-02 ppm1 4.919 ppm2 2.866 CV 1
ASSI { 116}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 33 and name HA1 ))
2.700 2.700 3.300 peak 116 spectrum 1 weight 0.10000E+01 volume 0.58242E-02 ppm1 3.847 ppm2 4.288 CV 1
ASSI { 118}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 103 and name HN ))
2.100 0.500 0.500 peak 118 spectrum 1 weight 0.10000E+01 volume 0.56929E-02 ppm1 5.349 ppm2 9.228 CV 1
ASSI { 119}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 22 and name HB ))
2.200 0.600 0.600 peak 119 spectrum 1 weight 0.10000E+01 volume 0.56929E-02 ppm1 0.680 ppm2 1.960 CV 1
ASSI { 120}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB2 ))
2.500 0.800 0.800 peak 120 spectrum 1 weight 0.10000E+01 volume 0.56929E-02 ppm1 5.083 ppm2 2.668 CV 1
ASSI { 124}
(( segid " " and resid 63 and name HE1 ))
(( segid " " and resid 63 and name HD1 ))
2.400 0.700 0.700 peak 124 spectrum 1 weight 0.10000E+01 volume 0.54630E-02 ppm1 2.972 ppm2 1.639 CV 1
ASSI { 126}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 78 and name HD1 ))
2.400 0.700 0.700 peak 126 spectrum 1 weight 0.10000E+01 volume 0.54082E-02 ppm1 2.020 ppm2 1.591 CV 1
ASSI { 128}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 37 and name HN ))
2.200 0.600 0.600 peak 128 spectrum 1 weight 0.10000E+01 volume 0.53864E-02 ppm1 5.014 ppm2 9.105 CV 1
ASSI { 130}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 26 and name HA ))
2.200 0.600 0.600 peak 130 spectrum 1 weight 0.10000E+01 volume 0.52878E-02 ppm1 -0.642 ppm2 4.743 CV 1
ASSI { 133}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 92 and name HA ))
2.500 0.800 0.800 peak 133 spectrum 1 weight 0.10000E+01 volume 0.52221E-02 ppm1 1.839 ppm2 3.551 CV 1
ASSI { 136}
( segid " " and resid 87 and name HD1%)
( segid " " and resid 26 and name HD2%)
2.300 0.700 0.700 peak 136 spectrum 1 weight 0.10000E+01 volume 0.51893E-02 ppm1 -0.458 ppm2 -1.272 CV 1
ASSI { 138}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 30 and name HD1 ))
2.600 0.900 0.900 peak 138 spectrum 1 weight 0.10000E+01 volume 0.51345E-02 ppm1 5.586 ppm2 3.934 CV 1
ASSI { 142}
(( segid " " and resid 26 and name HB1 ))
( segid " " and resid 26 and name HD2%)
2.900 1.000 1.000 peak 142 spectrum 1 weight 0.10000E+01 volume 0.49922E-02 ppm1 0.530 ppm2 -1.275 CV 1
ASSI { 143}
(( segid " " and resid 107 and name HB1 ))
( segid " " and resid 16 and name HG1%)
2.500 0.800 0.800 peak 143 spectrum 1 weight 0.10000E+01 volume 0.49703E-02 ppm1 1.925 ppm2 0.535 CV 1
ASSI { 146}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 3 and name HB2 ))
3.400 1.400 1.400 peak 146 spectrum 1 weight 0.10000E+01 volume 0.49266E-02 ppm1 0.756 ppm2 2.807 CV 1
ASSI { 150}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 88 and name HB ))
2.500 0.800 0.800 peak 150 spectrum 1 weight 0.10000E+01 volume 0.48608E-02 ppm1 1.839 ppm2 3.861 CV 1
ASSI { 152}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 21 and name HB2 ))
2.500 0.800 0.800 peak 152 spectrum 1 weight 0.10000E+01 volume 0.48389E-02 ppm1 0.657 ppm2 1.533 CV 1
ASSI { 155}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HN ))
2.600 0.800 0.800 peak 155 spectrum 1 weight 0.10000E+01 volume 0.48061E-02 ppm1 1.225 ppm2 9.252 CV 1
ASSI { 157}
(( segid " " and resid 57 and name HB1 ))
(( segid " " and resid 57 and name HA ))
2.100 0.600 0.600 peak 157 spectrum 1 weight 0.10000E+01 volume 0.47623E-02 ppm1 3.114 ppm2 5.061 CV 1
ASSI { 162}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 83 and name HB2 ))
2.900 2.900 3.100 peak 162 spectrum 1 weight 0.10000E+01 volume 0.46856E-02 ppm1 1.925 ppm2 2.822 CV 1
ASSI { 168}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 61 and name HA ))
2.600 0.800 0.800 peak 168 spectrum 1 weight 0.10000E+01 volume 0.45214E-02 ppm1 2.629 ppm2 4.487 CV 1
ASSI { 169}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 24 and name HB ))
2.300 0.700 0.700 peak 169 spectrum 1 weight 0.10000E+01 volume 0.45105E-02 ppm1 0.133 ppm2 1.774 CV 1
ASSI { 170}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 48 and name HB1 ))
2.700 2.700 3.300 peak 170 spectrum 1 weight 0.10000E+01 volume 0.44777E-02 ppm1 3.210 ppm2 1.929 CV 1
ASSI { 172}
( segid " " and resid 26 and name HD2%)
( segid " " and resid 73 and name HD% )
2.600 0.800 0.800 peak 172 spectrum 1 weight 0.10000E+01 volume 0.44668E-02 ppm1 -1.271 ppm2 6.864 CV 1
ASSI { 174}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 90 and name HB2 ))
2.200 0.600 0.600 peak 174 spectrum 1 weight 0.10000E+01 volume 0.44120E-02 ppm1 1.838 ppm2 1.419 CV 1
ASSI { 180}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 92 and name HD1 ))
3.000 1.100 1.100 peak 180 spectrum 1 weight 0.10000E+01 volume 0.42806E-02 ppm1 4.324 ppm2 3.559 CV 1
ASSI { 182}
(( segid " " and resid 4 and name HG1 ))
(( segid " " and resid 4 and name HE1 ))
2.500 0.800 0.800 peak 182 spectrum 1 weight 0.10000E+01 volume 0.42368E-02 ppm1 1.152 ppm2 2.805 CV 1
ASSI { 198}
( segid " " and resid 13 and name HG2%)
(( segid " " and resid 106 and name HB1 ))
2.800 1.000 1.000 peak 198 spectrum 1 weight 0.10000E+01 volume 0.39959E-02 ppm1 0.954 ppm2 3.156 CV 1
ASSI { 200}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 46 and name HD2 ))
2.000 0.500 0.500 peak 200 spectrum 1 weight 0.10000E+01 volume 0.39850E-02 ppm1 3.208 ppm2 2.667 CV 1
ASSI { 209}
(( segid " " and resid 76 and name HB ))
(( segid " " and resid 76 and name HN ))
2.500 0.800 0.800 peak 209 spectrum 1 weight 0.10000E+01 volume 0.38864E-02 ppm1 4.043 ppm2 8.728 CV 1
ASSI { 212}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 18 and name HA ))
2.900 2.900 3.100 peak 212 spectrum 1 weight 0.10000E+01 volume 0.38646E-02 ppm1 2.046 ppm2 3.204 CV 1
ASSI { 214}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 43 and name HA ))
3.500 1.500 1.500 peak 214 spectrum 1 weight 0.10000E+01 volume 0.38318E-02 ppm1 2.339 ppm2 4.872 CV 1
ASSI { 215}
(( segid " " and resid 21 and name HG ))
( segid " " and resid 21 and name HD1%)
2.500 0.800 0.800 peak 215 spectrum 1 weight 0.10000E+01 volume 0.38208E-02 ppm1 1.324 ppm2 0.690 CV 1
ASSI { 217}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 91 and name HB2 ))
1.800 0.400 0.400 peak 217 spectrum 1 weight 0.10000E+01 volume 0.37660E-02 ppm1 0.757 ppm2 0.011 CV 1
ASSI { 220}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 24 and name HG2%)
2.400 0.700 0.700 peak 220 spectrum 1 weight 0.10000E+01 volume 0.37223E-02 ppm1 4.456 ppm2 0.136 CV 1
ASSI { 226}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 76 and name HN ))
2.800 1.000 1.000 peak 226 spectrum 1 weight 0.10000E+01 volume 0.36785E-02 ppm1 0.597 ppm2 8.717 CV 1
ASSI { 230}
(( segid " " and resid 101 and name HG1 ))
(( segid " " and resid 36 and name HH2 ))
2.700 0.900 0.900 peak 230 spectrum 1 weight 0.10000E+01 volume 0.36456E-02 ppm1 2.289 ppm2 6.777 CV 1
ASSI { 232}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB2 ))
2.200 0.600 0.600 peak 232 spectrum 1 weight 0.10000E+01 volume 0.36237E-02 ppm1 3.924 ppm2 1.729 CV 1
ASSI { 238}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 90 and name HG1 ))
2.600 0.900 0.900 peak 238 spectrum 1 weight 0.10000E+01 volume 0.35581E-02 ppm1 1.839 ppm2 2.523 CV 1
ASSI { 239}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 107 and name HB1 ))
2.600 2.600 3.400 peak 239 spectrum 1 weight 0.10000E+01 volume 0.35471E-02 ppm1 2.900 ppm2 1.941 CV 1
ASSI { 240}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 108 and name HN ))
2.400 0.700 0.700 peak 240 spectrum 1 weight 0.10000E+01 volume 0.35471E-02 ppm1 4.970 ppm2 9.156 CV 1
ASSI { 244}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 10 and name HA ))
3.100 1.200 1.200 peak 244 spectrum 1 weight 0.10000E+01 volume 0.35143E-02 ppm1 -0.642 ppm2 3.982 CV 1
ASSI { 247}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 26 and name HA ))
2.700 0.900 0.900 peak 247 spectrum 1 weight 0.10000E+01 volume 0.34924E-02 ppm1 0.412 ppm2 4.757 CV 1
ASSI { 248}
(( segid " " and resid 29 and name HA ))
(( segid " " and resid 30 and name HB1 ))
6.000 6.000 0.000 peak 248 spectrum 1 weight 0.10000E+01 volume 0.20691E-05 ppm1 5.578 ppm2 2.095 CV 1
ASSI { 253}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 75 and name HB ))
2.500 0.800 0.800 peak 253 spectrum 1 weight 0.10000E+01 volume 0.34814E-02 ppm1 0.598 ppm2 2.024 CV 1
ASSI { 254}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 55 and name HB2 ))
3.100 3.100 2.900 peak 254 spectrum 1 weight 0.10000E+01 volume 0.34704E-02 ppm1 1.447 ppm2 2.137 CV 1
ASSI { 256}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 106 and name HA ))
2.400 0.700 0.700 peak 256 spectrum 1 weight 0.10000E+01 volume 0.34486E-02 ppm1 4.509 ppm2 5.100 CV 1
ASSI { 257}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 83 and name HB2 ))
3.100 3.100 2.900 peak 257 spectrum 1 weight 0.10000E+01 volume 0.34486E-02 ppm1 0.597 ppm2 2.773 CV 1
ASSI { 261}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 75 and name HA ))
2.900 1.100 1.100 peak 261 spectrum 1 weight 0.10000E+01 volume 0.34048E-02 ppm1 0.596 ppm2 5.130 CV 1
ASSI { 262}
(( segid " " and resid 9 and name HB1 ))
( segid " " and resid 5 and name HG1%)
2.700 0.900 0.900 peak 262 spectrum 1 weight 0.10000E+01 volume 0.33938E-02 ppm1 3.467 ppm2 0.817 CV 1
ASSI { 265}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 106 and name HN ))
3.700 3.700 2.300 peak 265 spectrum 1 weight 0.10000E+01 volume 0.33720E-02 ppm1 0.834 ppm2 8.646 CV 1
ASSI { 267}
(( segid " " and resid 102 and name HG1 ))
(( segid " " and resid 87 and name HA ))
2.700 2.700 3.300 peak 267 spectrum 1 weight 0.10000E+01 volume 0.33610E-02 ppm1 1.668 ppm2 4.885 CV 1
ASSI { 269}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 38 and name HD% )
2.400 0.700 0.700 peak 269 spectrum 1 weight 0.10000E+01 volume 0.33391E-02 ppm1 4.892 ppm2 7.500 CV 1
ASSI { 270}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name HN ))
2.500 0.800 0.800 peak 270 spectrum 1 weight 0.10000E+01 volume 0.33391E-02 ppm1 5.096 ppm2 8.644 CV 1
ASSI { 274}
(( segid " " and resid 79 and name HA ))
( segid " " and resid 18 and name HG1%)
3.100 3.100 2.900 peak 274 spectrum 1 weight 0.10000E+01 volume 0.33062E-02 ppm1 4.699 ppm2 0.759 CV 1
ASSI { 275}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 16 and name HN ))
2.700 0.900 0.900 peak 275 spectrum 1 weight 0.10000E+01 volume 0.33062E-02 ppm1 1.169 ppm2 8.672 CV 1
ASSI { 277}
(( segid " " and resid 82 and name HB ))
(( segid " " and resid 82 and name HA ))
2.600 0.900 0.900 peak 277 spectrum 1 weight 0.10000E+01 volume 0.32953E-02 ppm1 3.860 ppm2 4.913 CV 1
ASSI { 280}
(( segid " " and resid 35 and name HA ))
( segid " " and resid 35 and name HB% )
2.600 0.800 0.800 peak 280 spectrum 1 weight 0.10000E+01 volume 0.32625E-02 ppm1 4.123 ppm2 1.274 CV 1
ASSI { 281}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 73 and name HB1 ))
2.600 2.600 3.400 peak 281 spectrum 1 weight 0.10000E+01 volume 0.32296E-02 ppm1 0.937 ppm2 2.809 CV 1
ASSI { 282}
(( segid " " and resid 87 and name HA ))
( segid " " and resid 87 and name HD2%)
2.600 0.900 0.900 peak 282 spectrum 1 weight 0.10000E+01 volume 0.32077E-02 ppm1 4.892 ppm2 -0.799 CV 1
ASSI { 284}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB2 ))
2.900 1.000 1.000 peak 284 spectrum 1 weight 0.10000E+01 volume 0.31858E-02 ppm1 4.435 ppm2 1.985 CV 1
ASSI { 289}
( segid " " and resid 87 and name HD2%)
( segid " " and resid 73 and name HD% )
2.700 0.900 0.900 peak 289 spectrum 1 weight 0.10000E+01 volume 0.31310E-02 ppm1 -0.807 ppm2 6.901 CV 1
ASSI { 290}
(( segid " " and resid 29 and name HB2 ))
(( segid " " and resid 29 and name HA ))
3.000 1.100 1.100 peak 290 spectrum 1 weight 0.10000E+01 volume 0.31201E-02 ppm1 2.744 ppm2 5.566 CV 1
ASSI { 294}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 9 and name HB2 ))
6.000 6.000 0.000 peak 294 spectrum 1 weight 0.10000E+01 volume 0.81014E-05 ppm1 -1.270 ppm2 3.277 CV 1
ASSI { 297}
(( segid " " and resid 14 and name HB2 ))
( segid " " and resid 14 and name HD1%)
2.700 0.900 0.900 peak 297 spectrum 1 weight 0.10000E+01 volume 0.30873E-02 ppm1 1.224 ppm2 0.614 CV 1
ASSI { 299}
( segid " " and resid 24 and name HD1%)
( segid " " and resid 103 and name HE% )
2.900 1.100 1.100 peak 299 spectrum 1 weight 0.10000E+01 volume 0.30544E-02 ppm1 0.610 ppm2 6.902 CV 1
ASSI { 308}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 77 and name HG1%)
2.900 1.100 1.100 peak 308 spectrum 1 weight 0.10000E+01 volume 0.29888E-02 ppm1 3.816 ppm2 0.888 CV 1
ASSI { 309}
(( segid " " and resid 107 and name HB2 ))
( segid " " and resid 16 and name HG1%)
2.600 0.800 0.800 peak 309 spectrum 1 weight 0.10000E+01 volume 0.29778E-02 ppm1 1.014 ppm2 0.544 CV 1
ASSI { 312}
(( segid " " and resid 26 and name HA ))
(( segid " " and resid 27 and name HD1 ))
2.200 0.600 0.600 peak 312 spectrum 1 weight 0.10000E+01 volume 0.29340E-02 ppm1 4.721 ppm2 4.034 CV 1
ASSI { 313}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 10 and name HA ))
2.400 0.700 0.700 peak 313 spectrum 1 weight 0.10000E+01 volume 0.29231E-02 ppm1 2.934 ppm2 3.993 CV 1
ASSI { 316}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 15 and name HA ))
2.700 0.900 0.900 peak 316 spectrum 1 weight 0.10000E+01 volume 0.29011E-02 ppm1 4.046 ppm2 4.959 CV 1
ASSI { 319}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB1 ))
2.400 0.700 0.700 peak 319 spectrum 1 weight 0.10000E+01 volume 0.28793E-02 ppm1 4.889 ppm2 3.475 CV 1
ASSI { 320}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HD1 ))
2.900 1.000 1.000 peak 320 spectrum 1 weight 0.10000E+01 volume 0.28793E-02 ppm1 1.687 ppm2 3.149 CV 1
ASSI { 323}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 22 and name HA ))
2.500 0.800 0.800 peak 323 spectrum 1 weight 0.10000E+01 volume 0.28683E-02 ppm1 0.680 ppm2 4.415 CV 1
ASSI { 325}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 3 and name HB2 ))
3.100 3.100 2.900 peak 325 spectrum 1 weight 0.10000E+01 volume 0.28464E-02 ppm1 1.173 ppm2 2.789 CV 1
ASSI { 326}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 28 and name HA ))
3.000 3.000 3.000 peak 326 spectrum 1 weight 0.10000E+01 volume 0.28245E-02 ppm1 2.027 ppm2 4.794 CV 1
ASSI { 330}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 58 and name HB2 ))
2.500 0.800 0.800 peak 330 spectrum 1 weight 0.10000E+01 volume 0.28245E-02 ppm1 3.799 ppm2 2.662 CV 1
ASSI { 337}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 90 and name HN ))
3.100 1.200 1.200 peak 337 spectrum 1 weight 0.10000E+01 volume 0.27807E-02 ppm1 1.272 ppm2 8.974 CV 1
ASSI { 340}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 109 and name HB% )
3.400 1.400 1.400 peak 340 spectrum 1 weight 0.10000E+01 volume 0.27589E-02 ppm1 0.519 ppm2 1.323 CV 1
ASSI { 343}
(( segid " " and resid 48 and name HA ))
( segid " " and resid 52 and name HG2%)
3.100 3.100 2.900 peak 343 spectrum 1 weight 0.10000E+01 volume 0.27150E-02 ppm1 4.077 ppm2 1.262 CV 1
ASSI { 344}
(( segid " " and resid 43 and name HB1 ))
(( segid " " and resid 38 and name HB2 ))
2.700 0.900 0.900 peak 344 spectrum 1 weight 0.10000E+01 volume 0.27041E-02 ppm1 2.168 ppm2 3.175 CV 1
ASSI { 347}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 38 and name HZ ))
2.800 1.000 1.000 peak 347 spectrum 1 weight 0.10000E+01 volume 0.27041E-02 ppm1 -0.807 ppm2 7.258 CV 1
ASSI { 352}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 91 and name HA ))
3.500 1.500 1.500 peak 352 spectrum 1 weight 0.10000E+01 volume 0.26712E-02 ppm1 0.834 ppm2 4.354 CV 1
ASSI { 353}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB1 ))
2.600 0.800 0.800 peak 353 spectrum 1 weight 0.10000E+01 volume 0.26712E-02 ppm1 4.875 ppm2 2.162 CV 1
ASSI { 355}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HA ))
2.800 1.000 1.000 peak 355 spectrum 1 weight 0.10000E+01 volume 0.26603E-02 ppm1 1.957 ppm2 4.870 CV 1
ASSI { 359}
(( segid " " and resid 78 and name HD1 ))
(( segid " " and resid 78 and name HA ))
3.100 1.200 1.200 peak 359 spectrum 1 weight 0.10000E+01 volume 0.26384E-02 ppm1 1.570 ppm2 4.445 CV 1
ASSI { 360}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 38 and name HB2 ))
2.700 2.700 3.300 peak 360 spectrum 1 weight 0.10000E+01 volume 0.26056E-02 ppm1 1.233 ppm2 3.162 CV 1
ASSI { 364}
(( segid " " and resid 19 and name HA2 ))
( segid " " and resid 76 and name HG2%)
3.000 3.000 3.000 peak 364 spectrum 1 weight 0.10000E+01 volume 0.25399E-02 ppm1 3.580 ppm2 0.883 CV 1
ASSI { 365}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 108 and name HB2 ))
3.300 1.400 1.400 peak 365 spectrum 1 weight 0.10000E+01 volume 0.25290E-02 ppm1 0.269 ppm2 1.269 CV 1
ASSI { 366}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 52 and name HG2%)
3.200 1.200 1.200 peak 366 spectrum 1 weight 0.10000E+01 volume 0.25290E-02 ppm1 4.822 ppm2 1.265 CV 1
ASSI { 367}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 21 and name HA ))
2.900 1.000 1.000 peak 367 spectrum 1 weight 0.10000E+01 volume 0.25071E-02 ppm1 1.321 ppm2 4.881 CV 1
ASSI { 369}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 21 and name HA ))
2.600 0.800 0.800 peak 369 spectrum 1 weight 0.10000E+01 volume 0.24961E-02 ppm1 1.511 ppm2 4.877 CV 1
ASSI { 371}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 22 and name HA ))
2.800 2.800 3.200 peak 371 spectrum 1 weight 0.10000E+01 volume 0.24851E-02 ppm1 2.053 ppm2 4.383 CV 1
ASSI { 376}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 87 and name HN ))
3.000 3.000 3.000 peak 376 spectrum 1 weight 0.10000E+01 volume 0.24633E-02 ppm1 5.170 ppm2 9.297 CV 1
ASSI { 383}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 27 and name HG2 ))
2.300 0.600 0.600 peak 383 spectrum 1 weight 0.10000E+01 volume 0.24304E-02 ppm1 3.380 ppm2 2.043 CV 1
ASSI { 384}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 60 and name HD1 ))
2.900 2.900 3.100 peak 384 spectrum 1 weight 0.10000E+01 volume 0.24085E-02 ppm1 1.563 ppm2 3.566 CV 1
ASSI { 385}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 76 and name HG2%)
3.400 1.400 1.400 peak 385 spectrum 1 weight 0.10000E+01 volume 0.24085E-02 ppm1 5.090 ppm2 0.911 CV 1
ASSI { 395}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 2 and name HB1 ))
3.200 1.200 1.200 peak 395 spectrum 1 weight 0.10000E+01 volume 0.23538E-02 ppm1 2.051 ppm2 3.751 CV 1
ASSI { 403}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 105 and name HA ))
2.800 1.000 1.000 peak 403 spectrum 1 weight 0.10000E+01 volume 0.23100E-02 ppm1 0.437 ppm2 4.336 CV 1
ASSI { 404}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 38 and name HZ ))
2.900 1.100 1.100 peak 404 spectrum 1 weight 0.10000E+01 volume 0.22991E-02 ppm1 4.004 ppm2 7.293 CV 1
ASSI { 405}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HA ))
3.000 3.000 3.000 peak 405 spectrum 1 weight 0.10000E+01 volume 0.22991E-02 ppm1 4.907 ppm2 4.465 CV 1
ASSI { 406}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 82 and name HA ))
3.300 1.300 1.300 peak 406 spectrum 1 weight 0.10000E+01 volume 0.22881E-02 ppm1 1.274 ppm2 4.883 CV 1
ASSI { 409}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 26 and name HA ))
1.900 1.900 4.100 peak 409 spectrum 1 weight 0.10000E+01 volume 0.22772E-02 ppm1 2.259 ppm2 4.724 CV 1
ASSI { 411}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 5 and name HB ))
2.600 0.900 0.900 peak 411 spectrum 1 weight 0.10000E+01 volume 0.22662E-02 ppm1 4.455 ppm2 1.877 CV 1
ASSI { 414}
(( segid " " and resid 21 and name HB1 ))
( segid " " and resid 21 and name HD1%)
3.300 1.400 1.400 peak 414 spectrum 1 weight 0.10000E+01 volume 0.22552E-02 ppm1 1.624 ppm2 0.684 CV 1
ASSI { 418}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 1 and name HB1 ))
3.400 3.400 2.600 peak 418 spectrum 1 weight 0.10000E+01 volume 0.22443E-02 ppm1 0.652 ppm2 3.704 CV 1
ASSI { 420}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 24 and name HG12))
2.800 1.000 1.000 peak 420 spectrum 1 weight 0.10000E+01 volume 0.22334E-02 ppm1 1.776 ppm2 0.613 CV 1
OR { 420}
(( segid " " and resid 24 and name HB ))
( segid " " and resid 24 and name HD1%)
ASSI { 422}
(( segid " " and resid 27 and name HD1 ))
(( segid " " and resid 27 and name HG2 ))
3.000 1.100 1.100 peak 422 spectrum 1 weight 0.10000E+01 volume 0.22224E-02 ppm1 4.033 ppm2 2.045 CV 1
ASSI { 429}
(( segid " " and resid 80 and name HA ))
( segid " " and resid 18 and name HG1%)
3.200 3.200 2.800 peak 429 spectrum 1 weight 0.10000E+01 volume 0.21677E-02 ppm1 3.997 ppm2 0.772 CV 1
ASSI { 434}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 26 and name HA ))
2.600 0.800 0.800 peak 434 spectrum 1 weight 0.10000E+01 volume 0.21130E-02 ppm1 0.531 ppm2 4.773 CV 1
ASSI { 435}
(( segid " " and resid 56 and name HD1 ))
( segid " " and resid 73 and name HD% )
3.200 3.200 2.800 peak 435 spectrum 1 weight 0.10000E+01 volume 0.21130E-02 ppm1 1.451 ppm2 6.874 CV 1
ASSI { 439}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 88 and name HN ))
3.800 1.800 1.800 peak 439 spectrum 1 weight 0.10000E+01 volume 0.20801E-02 ppm1 -0.807 ppm2 9.383 CV 1
ASSI { 440}
(( segid " " and resid 29 and name HB1 ))
( segid " " and resid 31 and name HG2%)
3.300 1.300 1.300 peak 440 spectrum 1 weight 0.10000E+01 volume 0.20691E-02 ppm1 3.211 ppm2 1.305 CV 1
ASSI { 441}
( segid " " and resid 90 and name HE% )
( segid " " and resid 37 and name HD% )
3.400 1.500 1.500 peak 441 spectrum 1 weight 0.10000E+01 volume 0.20691E-02 ppm1 1.840 ppm2 6.823 CV 1
ASSI { 443}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 66 and name HA1 ))
3.400 1.400 1.400 peak 443 spectrum 1 weight 0.10000E+01 volume 0.20582E-02 ppm1 4.432 ppm2 4.044 CV 1
ASSI { 444}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 59 and name HG1 ))
3.900 1.900 1.900 peak 444 spectrum 1 weight 0.10000E+01 volume 0.20582E-02 ppm1 4.581 ppm2 1.997 CV 1
ASSI { 455}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 23 and name HA ))
3.400 3.400 2.600 peak 455 spectrum 1 weight 0.10000E+01 volume 0.19706E-02 ppm1 0.679 ppm2 4.925 CV 1
ASSI { 456}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 48 and name HB1 ))
3.400 3.400 2.600 peak 456 spectrum 1 weight 0.10000E+01 volume 0.19597E-02 ppm1 2.609 ppm2 1.913 CV 1
ASSI { 465}
( segid " " and resid 75 and name HG2%)
( segid " " and resid 109 and name HB% )
2.900 1.000 1.000 peak 465 spectrum 1 weight 0.10000E+01 volume 0.19049E-02 ppm1 0.597 ppm2 1.311 CV 1
ASSI { 481}
(( segid " " and resid 104 and name HB ))
(( segid " " and resid 104 and name HA ))
2.900 1.100 1.100 peak 481 spectrum 1 weight 0.10000E+01 volume 0.18174E-02 ppm1 3.277 ppm2 5.343 CV 1
ASSI { 484}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HN ))
2.900 1.000 1.000 peak 484 spectrum 1 weight 0.10000E+01 volume 0.18064E-02 ppm1 1.274 ppm2 9.169 CV 1
ASSI { 486}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HD1 ))
3.400 1.500 1.500 peak 486 spectrum 1 weight 0.10000E+01 volume 0.17954E-02 ppm1 4.328 ppm2 2.600 CV 1
ASSI { 488}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 102 and name HA ))
3.600 3.600 2.400 peak 488 spectrum 1 weight 0.10000E+01 volume 0.17736E-02 ppm1 3.115 ppm2 5.348 CV 1
ASSI { 491}
(( segid " " and resid 99 and name HA ))
(( segid " " and resid 99 and name HB2 ))
3.000 1.100 1.100 peak 491 spectrum 1 weight 0.10000E+01 volume 0.17626E-02 ppm1 4.574 ppm2 2.501 CV 1
ASSI { 498}
(( segid " " and resid 104 and name HB ))
(( segid " " and resid 104 and name HN ))
2.800 1.000 1.000 peak 498 spectrum 1 weight 0.10000E+01 volume 0.17188E-02 ppm1 3.278 ppm2 7.571 CV 1
ASSI { 501}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 50 and name HA ))
3.500 3.500 2.500 peak 501 spectrum 1 weight 0.10000E+01 volume 0.17079E-02 ppm1 4.080 ppm2 4.485 CV 1
ASSI { 502}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 71 and name HG1 ))
2.400 0.700 0.700 peak 502 spectrum 1 weight 0.10000E+01 volume 0.16969E-02 ppm1 3.886 ppm2 2.522 CV 1
ASSI { 506}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 53 and name HG1%)
3.200 1.300 1.300 peak 506 spectrum 1 weight 0.10000E+01 volume 0.16859E-02 ppm1 3.572 ppm2 1.330 CV 1
ASSI { 507}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HA ))
2.500 0.800 0.800 peak 507 spectrum 1 weight 0.10000E+01 volume 0.16750E-02 ppm1 1.339 ppm2 4.899 CV 1
ASSI { 508}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 26 and name HD1%)
2.700 0.900 0.900 peak 508 spectrum 1 weight 0.10000E+01 volume 0.16750E-02 ppm1 3.924 ppm2 -0.640 CV 1
ASSI { 509}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 73 and name HB1 ))
3.700 1.700 1.700 peak 509 spectrum 1 weight 0.10000E+01 volume 0.16750E-02 ppm1 0.610 ppm2 2.794 CV 1
ASSI { 510}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 50 and name HA ))
3.700 1.700 1.700 peak 510 spectrum 1 weight 0.10000E+01 volume 0.16750E-02 ppm1 2.020 ppm2 4.474 CV 1
ASSI { 513}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 108 and name HN ))
3.600 1.700 1.700 peak 513 spectrum 1 weight 0.10000E+01 volume 0.16750E-02 ppm1 1.243 ppm2 9.141 CV 1
ASSI { 522}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 66 and name HA2 ))
3.500 1.500 1.500 peak 522 spectrum 1 weight 0.10000E+01 volume 0.15875E-02 ppm1 4.433 ppm2 3.765 CV 1
ASSI { 526}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 36 and name HH2 ))
3.200 1.300 1.300 peak 526 spectrum 1 weight 0.10000E+01 volume 0.15765E-02 ppm1 2.934 ppm2 6.752 CV 1
ASSI { 530}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 77 and name HA ))
3.300 1.400 1.400 peak 530 spectrum 1 weight 0.10000E+01 volume 0.15437E-02 ppm1 2.021 ppm2 3.801 CV 1
ASSI { 531}
(( segid " " and resid 69 and name HA2 ))
(( segid " " and resid 60 and name HG1 ))
3.100 1.200 1.200 peak 531 spectrum 1 weight 0.10000E+01 volume 0.15437E-02 ppm1 4.237 ppm2 1.981 CV 1
ASSI { 533}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 34 and name HB2 ))
3.300 1.300 1.300 peak 533 spectrum 1 weight 0.10000E+01 volume 0.15327E-02 ppm1 3.844 ppm2 0.751 CV 1
ASSI { 536}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 91 and name HD1 ))
2.900 1.100 1.100 peak 536 spectrum 1 weight 0.10000E+01 volume 0.15327E-02 ppm1 0.039 ppm2 2.596 CV 1
ASSI { 542}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 15 and name HA ))
3.300 1.400 1.400 peak 542 spectrum 1 weight 0.10000E+01 volume 0.15108E-02 ppm1 0.520 ppm2 4.991 CV 1
ASSI { 544}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 107 and name HB1 ))
3.300 3.300 2.700 peak 544 spectrum 1 weight 0.10000E+01 volume 0.15108E-02 ppm1 1.545 ppm2 1.937 CV 1
ASSI { 546}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 108 and name HN ))
3.100 1.200 1.200 peak 546 spectrum 1 weight 0.10000E+01 volume 0.14998E-02 ppm1 0.519 ppm2 9.163 CV 1
ASSI { 547}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 88 and name HN ))
3.200 1.300 1.300 peak 547 spectrum 1 weight 0.10000E+01 volume 0.14889E-02 ppm1 1.502 ppm2 9.355 CV 1
ASSI { 548}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 36 and name HE1 ))
2.800 1.000 1.000 peak 548 spectrum 1 weight 0.10000E+01 volume 0.14780E-02 ppm1 0.530 ppm2 10.286 CV 1
ASSI { 549}
( segid " " and resid 24 and name HD1%)
( segid " " and resid 87 and name HD1%)
3.900 1.900 1.900 peak 549 spectrum 1 weight 0.10000E+01 volume 0.14780E-02 ppm1 0.611 ppm2 -0.471 CV 1
ASSI { 550}
(( segid " " and resid 30 and name HD2 ))
( segid " " and resid 31 and name HG2%)
2.000 2.000 4.000 peak 550 spectrum 1 weight 0.10000E+01 volume 0.14670E-02 ppm1 3.603 ppm2 1.335 CV 1
ASSI { 551}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 24 and name HA ))
3.300 3.300 2.700 peak 551 spectrum 1 weight 0.10000E+01 volume 0.14670E-02 ppm1 3.013 ppm2 4.475 CV 1
ASSI { 553}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HB1 ))
2.700 0.900 0.900 peak 553 spectrum 1 weight 0.10000E+01 volume 0.14560E-02 ppm1 4.329 ppm2 0.776 CV 1
ASSI { 554}
( segid " " and resid 67 and name HB% )
(( segid " " and resid 60 and name HG2 ))
3.700 1.700 1.700 peak 554 spectrum 1 weight 0.10000E+01 volume 0.14560E-02 ppm1 1.427 ppm2 1.851 CV 1
ASSI { 557}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 26 and name HA ))
2.900 1.000 1.000 peak 557 spectrum 1 weight 0.10000E+01 volume 0.14451E-02 ppm1 -1.271 ppm2 4.767 CV 1
ASSI { 564}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 107 and name HN ))
3.200 1.300 1.300 peak 564 spectrum 1 weight 0.10000E+01 volume 0.14013E-02 ppm1 1.925 ppm2 9.209 CV 1
ASSI { 569}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 106 and name HN ))
3.200 1.300 1.300 peak 569 spectrum 1 weight 0.10000E+01 volume 0.13794E-02 ppm1 0.436 ppm2 8.635 CV 1
ASSI { 573}
(( segid " " and resid 2 and name HB1 ))
( segid " " and resid 17 and name HB% )
3.200 1.300 1.300 peak 573 spectrum 1 weight 0.10000E+01 volume 0.13465E-02 ppm1 3.705 ppm2 1.310 CV 1
ASSI { 582}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 74 and name HA ))
3.400 1.500 1.500 peak 582 spectrum 1 weight 0.10000E+01 volume 0.12918E-02 ppm1 0.655 ppm2 5.333 CV 1
ASSI { 583}
(( segid " " and resid 4 and name HD1 ))
(( segid " " and resid 4 and name HA ))
3.900 1.900 1.900 peak 583 spectrum 1 weight 0.10000E+01 volume 0.12918E-02 ppm1 1.486 ppm2 4.886 CV 1
ASSI { 586}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 74 and name HB2 ))
3.700 1.700 1.700 peak 586 spectrum 1 weight 0.10000E+01 volume 0.12809E-02 ppm1 0.653 ppm2 3.007 CV 1
ASSI { 590}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 27 and name HA ))
3.800 1.800 1.800 peak 590 spectrum 1 weight 0.10000E+01 volume 0.12590E-02 ppm1 2.188 ppm2 4.813 CV 1
ASSI { 591}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 107 and name HA ))
3.000 1.100 1.100 peak 591 spectrum 1 weight 0.10000E+01 volume 0.12590E-02 ppm1 1.925 ppm2 4.977 CV 1
ASSI { 592}
(( segid " " and resid 21 and name HB1 ))
(( segid " " and resid 1 and name HB1 ))
3.300 1.300 1.300 peak 592 spectrum 1 weight 0.10000E+01 volume 0.12590E-02 ppm1 1.624 ppm2 3.722 CV 1
ASSI { 594}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 88 and name HN ))
3.700 1.800 1.800 peak 594 spectrum 1 weight 0.10000E+01 volume 0.12590E-02 ppm1 1.100 ppm2 9.364 CV 1
ASSI { 596}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 43 and name HD1 ))
3.600 1.700 1.700 peak 596 spectrum 1 weight 0.10000E+01 volume 0.12590E-02 ppm1 5.112 ppm2 1.660 CV 1
ASSI { 597}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HE3 ))
4.200 2.200 1.800 peak 597 spectrum 1 weight 0.10000E+01 volume 0.12481E-02 ppm1 3.231 ppm2 7.576 CV 1
ASSI { 598}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HA ))
3.900 1.900 1.900 peak 598 spectrum 1 weight 0.10000E+01 volume 0.12481E-02 ppm1 -0.459 ppm2 4.889 CV 1
ASSI { 601}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 91 and name HA ))
2.900 1.100 1.100 peak 601 spectrum 1 weight 0.10000E+01 volume 0.12371E-02 ppm1 0.040 ppm2 4.325 CV 1
ASSI { 603}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 83 and name HB2 ))
3.900 3.900 2.100 peak 603 spectrum 1 weight 0.10000E+01 volume 0.12261E-02 ppm1 1.253 ppm2 2.805 CV 1
ASSI { 608}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 87 and name HN ))
2.900 1.000 1.000 peak 608 spectrum 1 weight 0.10000E+01 volume 0.12043E-02 ppm1 1.248 ppm2 9.373 CV 1
ASSI { 609}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 87 and name HA ))
3.300 1.400 1.400 peak 609 spectrum 1 weight 0.10000E+01 volume 0.12043E-02 ppm1 1.248 ppm2 4.902 CV 1
ASSI { 615}
(( segid " " and resid 1 and name HA ))
( segid " " and resid 21 and name HD1%)
3.900 1.900 1.900 peak 615 spectrum 1 weight 0.10000E+01 volume 0.11933E-02 ppm1 4.491 ppm2 0.671 CV 1
ASSI { 617}
(( segid " " and resid 48 and name HB1 ))
( segid " " and resid 52 and name HG2%)
3.700 3.700 2.300 peak 617 spectrum 1 weight 0.10000E+01 volume 0.11824E-02 ppm1 1.954 ppm2 1.262 CV 1
ASSI { 619}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 108 and name HN ))
3.900 1.900 1.900 peak 619 spectrum 1 weight 0.10000E+01 volume 0.11824E-02 ppm1 4.920 ppm2 9.113 CV 1
ASSI { 621}
(( segid " " and resid 41 and name HA2 ))
( segid " " and resid 90 and name HE% )
4.100 2.100 1.900 peak 621 spectrum 1 weight 0.10000E+01 volume 0.11714E-02 ppm1 3.164 ppm2 1.813 CV 1
ASSI { 622}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 106 and name HN ))
3.800 1.800 1.800 peak 622 spectrum 1 weight 0.10000E+01 volume 0.11714E-02 ppm1 3.159 ppm2 8.666 CV 1
ASSI { 623}
(( segid " " and resid 107 and name HB2 ))
(( segid " " and resid 107 and name HN ))
3.100 1.200 1.200 peak 623 spectrum 1 weight 0.10000E+01 volume 0.11714E-02 ppm1 1.015 ppm2 9.201 CV 1
ASSI { 626}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 87 and name HG ))
3.200 1.300 1.300 peak 626 spectrum 1 weight 0.10000E+01 volume 0.11605E-02 ppm1 1.499 ppm2 0.644 CV 1
ASSI { 628}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 103 and name HB1 ))
3.300 1.400 1.400 peak 628 spectrum 1 weight 0.10000E+01 volume 0.11386E-02 ppm1 -0.641 ppm2 2.592 CV 1
ASSI { 631}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 24 and name HA ))
3.000 1.100 1.100 peak 631 spectrum 1 weight 0.10000E+01 volume 0.11386E-02 ppm1 1.777 ppm2 4.455 CV 1
ASSI { 635}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 78 and name HE1 ))
3.700 1.700 1.700 peak 635 spectrum 1 weight 0.10000E+01 volume 0.11166E-02 ppm1 1.354 ppm2 2.863 CV 1
ASSI { 636}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 16 and name HN ))
3.500 1.600 1.600 peak 636 spectrum 1 weight 0.10000E+01 volume 0.11166E-02 ppm1 2.043 ppm2 8.666 CV 1
ASSI { 637}
(( segid " " and resid 102 and name HD1 ))
(( segid " " and resid 102 and name HA ))
4.000 2.000 2.000 peak 637 spectrum 1 weight 0.10000E+01 volume 0.11166E-02 ppm1 3.146 ppm2 5.323 CV 1
ASSI { 638}
(( segid " " and resid 28 and name HA ))
(( segid " " and resid 36 and name HE1 ))
3.000 1.100 1.100 peak 638 spectrum 1 weight 0.10000E+01 volume 0.11166E-02 ppm1 4.783 ppm2 10.278 CV 1
ASSI { 639}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 22 and name HN ))
3.200 1.300 1.300 peak 639 spectrum 1 weight 0.10000E+01 volume 0.11166E-02 ppm1 0.599 ppm2 9.359 CV 1
ASSI { 641}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 39 and name HG1 ))
3.300 1.400 1.400 peak 641 spectrum 1 weight 0.10000E+01 volume 0.11057E-02 ppm1 4.405 ppm2 2.313 CV 1
ASSI { 646}
(( segid " " and resid 2 and name HA ))
(( segid " " and resid 21 and name HB1 ))
3.600 3.600 2.400 peak 646 spectrum 1 weight 0.10000E+01 volume 0.10904E-02 ppm1 4.644 ppm2 1.573 CV 1
ASSI { 649}
(( segid " " and resid 102 and name HB2 ))
(( segid " " and resid 102 and name HA ))
2.900 1.000 1.000 peak 649 spectrum 1 weight 0.10000E+01 volume 0.10674E-02 ppm1 1.688 ppm2 5.340 CV 1
ASSI { 650}
(( segid " " and resid 106 and name HB2 ))
(( segid " " and resid 14 and name HN ))
3.900 1.900 1.900 peak 650 spectrum 1 weight 0.10000E+01 volume 0.10630E-02 ppm1 2.408 ppm2 9.232 CV 1
ASSI { 657}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 48 and name HB1 ))
3.900 1.900 1.900 peak 657 spectrum 1 weight 0.10000E+01 volume 0.10422E-02 ppm1 4.443 ppm2 1.930 CV 1
ASSI { 663}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HD1 ))
3.700 1.700 1.700 peak 663 spectrum 1 weight 0.10000E+01 volume 0.10236E-02 ppm1 5.586 ppm2 1.434 CV 1
ASSI { 666}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 10 and name HA ))
3.500 1.600 1.600 peak 666 spectrum 1 weight 0.10000E+01 volume 0.10192E-02 ppm1 1.544 ppm2 3.999 CV 1
ASSI { 667}
(( segid " " and resid 27 and name HD1 ))
(( segid " " and resid 26 and name HB2 ))
4.300 2.300 1.700 peak 667 spectrum 1 weight 0.10000E+01 volume 0.10182E-02 ppm1 4.035 ppm2 0.431 CV 1
ASSI { 668}
(( segid " " and resid 41 and name HA1 ))
(( segid " " and resid 37 and name HB2 ))
4.600 2.700 1.400 peak 668 spectrum 1 weight 0.10000E+01 volume 0.10182E-02 ppm1 3.907 ppm2 2.538 CV 1
ASSI { 670}
(( segid " " and resid 37 and name HB1 ))
( segid " " and resid 90 and name HE% )
4.300 2.300 1.700 peak 670 spectrum 1 weight 0.10000E+01 volume 0.10094E-02 ppm1 3.453 ppm2 1.818 CV 1
ASSI { 679}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 76 and name HN ))
3.200 1.300 1.300 peak 679 spectrum 1 weight 0.10000E+01 volume 0.99296E-03 ppm1 5.360 ppm2 8.676 CV 1
ASSI { 681}
(( segid " " and resid 92 and name HA ))
(( segid " " and resid 90 and name HB1 ))
4.000 2.000 2.000 peak 681 spectrum 1 weight 0.10000E+01 volume 0.98968E-03 ppm1 3.576 ppm2 1.744 CV 1
ASSI { 683}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 106 and name HD% )
3.500 1.600 1.600 peak 683 spectrum 1 weight 0.10000E+01 volume 0.98753E-03 ppm1 4.311 ppm2 6.688 CV 1
ASSI { 684}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 9 and name HD2 ))
2.000 2.000 4.000 peak 684 spectrum 1 weight 0.10000E+01 volume 0.98641E-03 ppm1 0.581 ppm2 6.985 CV 1
ASSI { 685}
( segid " " and resid 67 and name HB% )
( segid " " and resid 70 and name HG2%)
3.500 3.500 2.500 peak 685 spectrum 1 weight 0.10000E+01 volume 0.98529E-03 ppm1 1.422 ppm2 0.956 CV 1
ASSI { 687}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 87 and name HN ))
3.800 1.800 1.800 peak 687 spectrum 1 weight 0.10000E+01 volume 0.98202E-03 ppm1 -0.458 ppm2 9.348 CV 1
ASSI { 689}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 14 and name HN ))
4.000 2.000 2.000 peak 689 spectrum 1 weight 0.10000E+01 volume 0.96670E-03 ppm1 3.156 ppm2 9.242 CV 1
ASSI { 691}
(( segid " " and resid 85 and name HA ))
( segid " " and resid 84 and name HB% )
3.600 1.600 1.600 peak 691 spectrum 1 weight 0.10000E+01 volume 0.95577E-03 ppm1 3.999 ppm2 1.362 CV 1
ASSI { 695}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 48 and name HB1 ))
3.300 3.300 2.700 peak 695 spectrum 1 weight 0.10000E+01 volume 0.94699E-03 ppm1 2.667 ppm2 1.935 CV 1
ASSI { 696}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 87 and name HB1 ))
4.500 2.500 1.500 peak 696 spectrum 1 weight 0.10000E+01 volume 0.94372E-03 ppm1 2.257 ppm2 1.496 CV 1
ASSI { 699}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 72 and name HB2 ))
3.600 1.700 1.700 peak 699 spectrum 1 weight 0.10000E+01 volume 0.93382E-03 ppm1 5.582 ppm2 2.631 CV 1
ASSI { 700}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 73 and name HB1 ))
4.000 2.000 2.000 peak 700 spectrum 1 weight 0.10000E+01 volume 0.93055E-03 ppm1 0.134 ppm2 2.792 CV 1
ASSI { 703}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 43 and name HB2 ))
3.800 1.800 1.800 peak 703 spectrum 1 weight 0.10000E+01 volume 0.92289E-03 ppm1 4.405 ppm2 1.874 CV 1
ASSI { 707}
(( segid " " and resid 24 and name HB ))
( segid " " and resid 73 and name HD% )
4.100 2.100 1.900 peak 707 spectrum 1 weight 0.10000E+01 volume 0.91850E-03 ppm1 1.772 ppm2 6.890 CV 1
ASSI { 712}
(( segid " " and resid 27 and name HB1 ))
( segid " " and resid 65 and name HD2%)
3.600 1.700 1.700 peak 712 spectrum 1 weight 0.10000E+01 volume 0.89879E-03 ppm1 2.393 ppm2 0.906 CV 1
ASSI { 714}
( segid " " and resid 8 and name HB% )
( segid " " and resid 105 and name HG2%)
4.500 2.500 1.500 peak 714 spectrum 1 weight 0.10000E+01 volume 0.89225E-03 ppm1 1.084 ppm2 0.673 CV 1
ASSI { 715}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 23 and name HA ))
3.800 1.900 1.900 peak 715 spectrum 1 weight 0.10000E+01 volume 0.88459E-03 ppm1 1.776 ppm2 4.956 CV 1
ASSI { 716}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HD1 ))
3.600 1.600 1.600 peak 716 spectrum 1 weight 0.10000E+01 volume 0.88132E-03 ppm1 4.325 ppm2 3.198 CV 1
ASSI { 722}
(( segid " " and resid 23 and name HG1 ))
(( segid " " and resid 23 and name HA ))
3.300 1.400 1.400 peak 722 spectrum 1 weight 0.10000E+01 volume 0.86927E-03 ppm1 1.818 ppm2 4.911 CV 1
ASSI { 728}
(( segid " " and resid 90 and name HG1 ))
(( segid " " and resid 100 and name HB2 ))
4.000 2.000 2.000 peak 728 spectrum 1 weight 0.10000E+01 volume 0.85502E-03 ppm1 2.517 ppm2 3.705 CV 1
ASSI { 730}
(( segid " " and resid 95 and name HA2 ))
(( segid " " and resid 96 and name HG1 ))
4.200 2.200 1.800 peak 730 spectrum 1 weight 0.10000E+01 volume 0.85393E-03 ppm1 3.776 ppm2 1.964 CV 1
ASSI { 731}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HZ ))
4.000 2.000 2.000 peak 731 spectrum 1 weight 0.10000E+01 volume 0.85393E-03 ppm1 5.085 ppm2 7.304 CV 1
ASSI { 732}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 26 and name HA ))
3.500 1.500 1.500 peak 732 spectrum 1 weight 0.10000E+01 volume 0.85174E-03 ppm1 3.919 ppm2 4.767 CV 1
ASSI { 733}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 61 and name HB1 ))
3.800 1.800 1.800 peak 733 spectrum 1 weight 0.10000E+01 volume 0.84627E-03 ppm1 0.905 ppm2 2.611 CV 1
ASSI { 735}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HA ))
2.900 1.100 1.100 peak 735 spectrum 1 weight 0.10000E+01 volume 0.83203E-03 ppm1 3.128 ppm2 5.010 CV 1
ASSI { 737}
( segid " " and resid 26 and name HD1%)
(( segid " " and resid 6 and name HA ))
3.600 1.700 1.700 peak 737 spectrum 1 weight 0.10000E+01 volume 0.82766E-03 ppm1 -0.641 ppm2 5.157 CV 1
ASSI { 738}
(( segid " " and resid 30 and name HD1 ))
(( segid " " and resid 30 and name HB2 ))
4.100 2.100 1.900 peak 738 spectrum 1 weight 0.10000E+01 volume 0.82656E-03 ppm1 3.913 ppm2 1.818 CV 1
ASSI { 739}
( segid " " and resid 8 and name HB% )
(( segid " " and resid 7 and name HG1 ))
4.000 2.000 2.000 peak 739 spectrum 1 weight 0.10000E+01 volume 0.81890E-03 ppm1 1.084 ppm2 1.506 CV 1
ASSI { 740}
(( segid " " and resid 107 and name HB2 ))
( segid " " and resid 12 and name HB% )
3.800 1.800 1.800 peak 740 spectrum 1 weight 0.10000E+01 volume 0.20582E-04 ppm1 1.014 ppm2 1.532 CV 1
ASSI { 749}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 61 and name HB1 ))
3.400 1.400 1.400 peak 749 spectrum 1 weight 0.10000E+01 volume 0.79481E-03 ppm1 1.566 ppm2 2.652 CV 1
ASSI { 754}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 104 and name HA ))
3.800 1.800 1.800 peak 754 spectrum 1 weight 0.10000E+01 volume 0.77730E-03 ppm1 4.312 ppm2 5.297 CV 1
ASSI { 766}
(( segid " " and resid 41 and name HA1 ))
( segid " " and resid 90 and name HE% )
4.300 2.300 1.700 peak 766 spectrum 1 weight 0.10000E+01 volume 0.75212E-03 ppm1 3.908 ppm2 1.813 CV 1
ASSI { 768}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 90 and name HN ))
3.900 1.900 1.900 peak 768 spectrum 1 weight 0.10000E+01 volume 0.74774E-03 ppm1 4.122 ppm2 8.976 CV 1
ASSI { 770}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 1 and name HB1 ))
4.200 2.200 1.800 peak 770 spectrum 1 weight 0.10000E+01 volume 0.74007E-03 ppm1 1.511 ppm2 3.721 CV 1
ASSI { 773}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 46 and name HG1 ))
4.500 2.500 1.500 peak 773 spectrum 1 weight 0.10000E+01 volume 0.73022E-03 ppm1 3.571 ppm2 1.952 CV 1
ASSI { 781}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 52 and name HA ))
3.500 1.500 1.500 peak 781 spectrum 1 weight 0.10000E+01 volume 0.71161E-03 ppm1 1.954 ppm2 4.830 CV 1
ASSI { 783}
(( segid " " and resid 88 and name HA ))
( segid " " and resid 88 and name HG2%)
3.200 1.300 1.300 peak 783 spectrum 1 weight 0.10000E+01 volume 0.69738E-03 ppm1 5.161 ppm2 1.054 CV 1
ASSI { 785}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 107 and name HN ))
3.300 1.400 1.400 peak 785 spectrum 1 weight 0.10000E+01 volume 0.69519E-03 ppm1 2.914 ppm2 9.187 CV 1
ASSI { 787}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 13 and name HA ))
4.000 2.000 2.000 peak 787 spectrum 1 weight 0.10000E+01 volume 0.69409E-03 ppm1 0.584 ppm2 5.338 CV 1
ASSI { 789}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 50 and name HB1 ))
3.900 1.900 1.900 peak 789 spectrum 1 weight 0.10000E+01 volume 0.68752E-03 ppm1 4.125 ppm2 1.908 CV 1
ASSI { 790}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 93 and name HB2 ))
4.100 2.100 1.900 peak 790 spectrum 1 weight 0.10000E+01 volume 0.68533E-03 ppm1 1.352 ppm2 3.196 CV 1
ASSI { 791}
(( segid " " and resid 76 and name HB ))
(( segid " " and resid 51 and name HB1 ))
3.400 1.400 1.400 peak 791 spectrum 1 weight 0.10000E+01 volume 0.68315E-03 ppm1 4.041 ppm2 2.866 CV 1
ASSI { 792}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 19 and name HA2 ))
4.800 2.900 1.200 peak 792 spectrum 1 weight 0.10000E+01 volume 0.67657E-03 ppm1 0.754 ppm2 3.573 CV 1
ASSI { 796}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 66 and name HA2 ))
3.900 1.900 1.900 peak 796 spectrum 1 weight 0.10000E+01 volume 0.66782E-03 ppm1 1.569 ppm2 3.785 CV 1
ASSI { 799}
(( segid " " and resid 27 and name HG1 ))
( segid " " and resid 70 and name HG2%)
4.400 2.400 1.600 peak 799 spectrum 1 weight 0.10000E+01 volume 0.66563E-03 ppm1 2.185 ppm2 0.990 CV 1
ASSI { 804}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 36 and name HZ3 ))
4.500 2.500 1.500 peak 804 spectrum 1 weight 0.10000E+01 volume 0.64592E-03 ppm1 1.500 ppm2 6.752 CV 1
ASSI { 808}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 74 and name HB2 ))
4.400 2.400 1.600 peak 808 spectrum 1 weight 0.10000E+01 volume 0.63826E-03 ppm1 1.315 ppm2 2.992 CV 1
ASSI { 810}
(( segid " " and resid 73 and name HB2 ))
( segid " " and resid 24 and name HG2%)
3.200 1.300 1.300 peak 810 spectrum 1 weight 0.10000E+01 volume 0.63497E-03 ppm1 2.601 ppm2 0.155 CV 1
ASSI { 814}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 86 and name HB1 ))
3.600 1.600 1.600 peak 814 spectrum 1 weight 0.10000E+01 volume 0.62622E-03 ppm1 0.438 ppm2 2.715 CV 1
ASSI { 816}
(( segid " " and resid 83 and name HB2 ))
(( segid " " and resid 107 and name HN ))
4.300 2.300 1.700 peak 816 spectrum 1 weight 0.10000E+01 volume 0.62402E-03 ppm1 2.804 ppm2 9.181 CV 1
ASSI { 817}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 92 and name HG2 ))
6.000 6.000 0.000 peak 817 spectrum 1 weight 0.10000E+01 volume 0.27370E-04 ppm1 0.379 ppm2 1.613 CV 1
ASSI { 821}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 37 and name HA ))
2.200 2.200 3.800 peak 821 spectrum 1 weight 0.10000E+01 volume 0.61307E-03 ppm1 1.839 ppm2 4.807 CV 1
ASSI { 822}
(( segid " " and resid 56 and name HB1 ))
(( segid " " and resid 56 and name HE1 ))
4.000 2.000 2.000 peak 822 spectrum 1 weight 0.10000E+01 volume 0.61307E-03 ppm1 1.476 ppm2 2.641 CV 1
ASSI { 824}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 74 and name HA ))
4.100 2.100 1.900 peak 824 spectrum 1 weight 0.10000E+01 volume 0.60870E-03 ppm1 1.485 ppm2 5.333 CV 1
ASSI { 827}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 107 and name HN ))
4.100 2.100 1.900 peak 827 spectrum 1 weight 0.10000E+01 volume 0.59337E-03 ppm1 0.270 ppm2 9.217 CV 1
ASSI { 830}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 1 and name HA ))
3.900 1.900 1.900 peak 830 spectrum 1 weight 0.10000E+01 volume 0.58899E-03 ppm1 1.325 ppm2 4.472 CV 1
ASSI { 831}
(( segid " " and resid 32 and name HB ))
( segid " " and resid 34 and name HE% )
4.000 2.000 2.000 peak 831 spectrum 1 weight 0.10000E+01 volume 0.58790E-03 ppm1 4.586 ppm2 7.117 CV 1
ASSI { 834}
( segid " " and resid 26 and name HD1%)
( segid " " and resid 6 and name HG2%)
4.600 2.600 1.400 peak 834 spectrum 1 weight 0.10000E+01 volume 0.58024E-03 ppm1 -0.641 ppm2 1.097 CV 1
ASSI { 837}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 87 and name HA ))
3.200 1.300 1.300 peak 837 spectrum 1 weight 0.10000E+01 volume 0.57147E-03 ppm1 1.504 ppm2 4.899 CV 1
ASSI { 838}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 38 and name HB1 ))
4.200 2.300 1.800 peak 838 spectrum 1 weight 0.10000E+01 volume 0.56929E-03 ppm1 -0.807 ppm2 3.489 CV 1
ASSI { 839}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 27 and name HB1 ))
4.700 2.700 1.300 peak 839 spectrum 1 weight 0.10000E+01 volume 0.56709E-03 ppm1 5.089 ppm2 2.408 CV 1
ASSI { 840}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 37 and name HN ))
2.200 2.200 3.800 peak 840 spectrum 1 weight 0.10000E+01 volume 0.56600E-03 ppm1 1.840 ppm2 9.072 CV 1
ASSI { 841}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HB ))
4.000 2.000 2.000 peak 841 spectrum 1 weight 0.10000E+01 volume 0.56600E-03 ppm1 4.823 ppm2 2.212 CV 1
ASSI { 842}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 73 and name HB1 ))
4.100 2.100 1.900 peak 842 spectrum 1 weight 0.10000E+01 volume 0.56053E-03 ppm1 0.273 ppm2 2.841 CV 1
ASSI { 844}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 13 and name HA ))
4.200 2.200 1.800 peak 844 spectrum 1 weight 0.10000E+01 volume 0.55615E-03 ppm1 1.301 ppm2 5.328 CV 1
ASSI { 845}
( segid " " and resid 80 and name HB% )
(( segid " " and resid 110 and name HB2 ))
4.400 2.400 1.600 peak 845 spectrum 1 weight 0.10000E+01 volume 0.55505E-03 ppm1 1.418 ppm2 2.645 CV 1
ASSI { 848}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
4.200 2.200 1.800 peak 848 spectrum 1 weight 0.10000E+01 volume 0.54739E-03 ppm1 1.251 ppm2 2.865 CV 1
ASSI { 851}
(( segid " " and resid 6 and name HA ))
(( segid " " and resid 25 and name HB1 ))
3.400 1.500 1.500 peak 851 spectrum 1 weight 0.10000E+01 volume 0.54520E-03 ppm1 5.170 ppm2 1.595 CV 1
ASSI { 855}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HN ))
3.400 1.500 1.500 peak 855 spectrum 1 weight 0.10000E+01 volume 0.53206E-03 ppm1 4.119 ppm2 7.863 CV 1
ASSI { 857}
(( segid " " and resid 26 and name HB1 ))
( segid " " and resid 73 and name HD% )
4.400 2.500 1.600 peak 857 spectrum 1 weight 0.10000E+01 volume 0.52878E-03 ppm1 0.535 ppm2 6.894 CV 1
ASSI { 859}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 78 and name HA ))
3.500 1.600 1.600 peak 859 spectrum 1 weight 0.10000E+01 volume 0.52331E-03 ppm1 1.352 ppm2 4.474 CV 1
ASSI { 862}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 104 and name HA ))
4.400 2.400 1.600 peak 862 spectrum 1 weight 0.10000E+01 volume 0.51454E-03 ppm1 -0.807 ppm2 5.312 CV 1
ASSI { 863}
(( segid " " and resid 11 and name HA2 ))
( segid " " and resid 104 and name HG2%)
3.700 1.700 1.700 peak 863 spectrum 1 weight 0.10000E+01 volume 0.51345E-03 ppm1 3.358 ppm2 0.449 CV 1
ASSI { 864}
(( segid " " and resid 92 and name HB2 ))
( segid " " and resid 37 and name HE% )
5.100 3.200 0.900 peak 864 spectrum 1 weight 0.10000E+01 volume 0.51345E-03 ppm1 1.355 ppm2 6.717 CV 1
ASSI { 866}
(( segid " " and resid 10 and name HA ))
( segid " " and resid 105 and name HG2%)
3.900 1.900 1.900 peak 866 spectrum 1 weight 0.10000E+01 volume 0.51236E-03 ppm1 3.996 ppm2 0.709 CV 1
ASSI { 870}
( segid " " and resid 50 and name HE% )
( segid " " and resid 77 and name HG2%)
4.200 2.200 1.800 peak 870 spectrum 1 weight 0.10000E+01 volume 0.50141E-03 ppm1 2.019 ppm2 0.866 CV 1
ASSI { 871}
(( segid " " and resid 56 and name HB1 ))
(( segid " " and resid 72 and name HB1 ))
4.300 2.300 1.700 peak 871 spectrum 1 weight 0.10000E+01 volume 0.50032E-03 ppm1 1.474 ppm2 3.026 CV 1
ASSI { 872}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 85 and name HB ))
4.700 2.700 1.300 peak 872 spectrum 1 weight 0.10000E+01 volume 0.49922E-03 ppm1 4.507 ppm2 2.045 CV 1
ASSI { 874}
( segid " " and resid 8 and name HB% )
(( segid " " and resid 6 and name HB ))
4.100 2.100 1.900 peak 874 spectrum 1 weight 0.10000E+01 volume 0.49812E-03 ppm1 1.086 ppm2 4.716 CV 1
ASSI { 876}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 105 and name HN ))
4.400 2.400 1.600 peak 876 spectrum 1 weight 0.10000E+01 volume 0.49812E-03 ppm1 5.397 ppm2 7.838 CV 1
ASSI { 877}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HG1 ))
3.200 1.300 1.300 peak 877 spectrum 1 weight 0.10000E+01 volume 0.49484E-03 ppm1 4.324 ppm2 0.319 CV 1
ASSI { 885}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 4 and name HA ))
4.900 3.000 1.100 peak 885 spectrum 1 weight 0.10000E+01 volume 0.47842E-03 ppm1 0.133 ppm2 4.865 CV 1
ASSI { 886}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 104 and name HN ))
3.900 2.000 2.000 peak 886 spectrum 1 weight 0.10000E+01 volume 0.47076E-03 ppm1 2.265 ppm2 7.523 CV 1
ASSI { 887}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 13 and name HA ))
4.400 2.400 1.600 peak 887 spectrum 1 weight 0.10000E+01 volume 0.46967E-03 ppm1 1.228 ppm2 5.338 CV 1
ASSI { 891}
(( segid " " and resid 93 and name HB2 ))
(( segid " " and resid 93 and name HD1 ))
3.500 1.600 1.600 peak 891 spectrum 1 weight 0.10000E+01 volume 0.46638E-03 ppm1 3.232 ppm2 7.112 CV 1
ASSI { 892}
(( segid " " and resid 46 and name HD1 ))
( segid " " and resid 53 and name HG1%)
4.400 2.400 1.600 peak 892 spectrum 1 weight 0.10000E+01 volume 0.46419E-03 ppm1 3.208 ppm2 1.327 CV 1
ASSI { 894}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 16 and name HN ))
4.100 2.100 1.900 peak 894 spectrum 1 weight 0.10000E+01 volume 0.45872E-03 ppm1 0.582 ppm2 8.684 CV 1
ASSI { 897}
(( segid " " and resid 86 and name HA ))
(( segid " " and resid 36 and name HZ3 ))
5.100 3.300 0.900 peak 897 spectrum 1 weight 0.10000E+01 volume 0.45214E-03 ppm1 5.394 ppm2 6.736 CV 1
ASSI { 899}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 96 and name HD1 ))
3.500 1.500 1.500 peak 899 spectrum 1 weight 0.10000E+01 volume 0.45214E-03 ppm1 0.038 ppm2 3.550 CV 1
ASSI { 901}
(( segid " " and resid 94 and name HB ))
(( segid " " and resid 91 and name HB2 ))
5.400 3.600 0.600 peak 901 spectrum 1 weight 0.10000E+01 volume 0.44886E-03 ppm1 3.974 ppm2 0.012 CV 1
ASSI { 903}
(( segid " " and resid 71 and name HG2 ))
(( segid " " and resid 36 and name HD1 ))
4.500 2.500 1.500 peak 903 spectrum 1 weight 0.10000E+01 volume 0.44777E-03 ppm1 2.342 ppm2 7.398 CV 1
ASSI { 905}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 24 and name HG2%)
4.300 2.300 1.700 peak 905 spectrum 1 weight 0.10000E+01 volume 0.44010E-03 ppm1 3.924 ppm2 0.144 CV 1
ASSI { 907}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 28 and name HA ))
3.200 1.300 1.300 peak 907 spectrum 1 weight 0.10000E+01 volume 0.43901E-03 ppm1 3.886 ppm2 4.799 CV 1
ASSI { 915}
(( segid " " and resid 13 and name HA ))
(( segid " " and resid 105 and name HA ))
4.400 2.400 1.600 peak 915 spectrum 1 weight 0.10000E+01 volume 0.41821E-03 ppm1 5.344 ppm2 4.323 CV 1
ASSI { 916}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 27 and name HD1 ))
4.600 2.700 1.400 peak 916 spectrum 1 weight 0.10000E+01 volume 0.41602E-03 ppm1 -1.269 ppm2 4.019 CV 1
ASSI { 923}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 36 and name HZ3 ))
3.600 1.600 1.600 peak 923 spectrum 1 weight 0.10000E+01 volume 0.39850E-03 ppm1 0.046 ppm2 6.797 CV 1
ASSI { 928}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 106 and name HB2 ))
4.600 2.600 1.400 peak 928 spectrum 1 weight 0.10000E+01 volume 0.39193E-03 ppm1 3.872 ppm2 2.414 CV 1
ASSI { 930}
(( segid " " and resid 15 and name HB ))
( segid " " and resid 16 and name HG2%)
4.800 2.800 1.200 peak 930 spectrum 1 weight 0.10000E+01 volume 0.38646E-03 ppm1 4.050 ppm2 0.269 CV 1
ASSI { 938}
( segid " " and resid 24 and name HD1%)
( segid " " and resid 26 and name HD2%)
4.700 2.800 1.300 peak 938 spectrum 1 weight 0.10000E+01 volume 0.37660E-03 ppm1 0.608 ppm2 -1.271 CV 1
ASSI { 943}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 3 and name HB2 ))
3.900 1.900 1.900 peak 943 spectrum 1 weight 0.10000E+01 volume 0.36894E-03 ppm1 0.521 ppm2 2.820 CV 1
ASSI { 950}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 13 and name HA ))
4.100 2.100 1.900 peak 950 spectrum 1 weight 0.10000E+01 volume 0.35909E-03 ppm1 1.542 ppm2 5.349 CV 1
ASSI { 953}
(( segid " " and resid 13 and name HB ))
(( segid " " and resid 14 and name HN ))
4.500 2.500 1.500 peak 953 spectrum 1 weight 0.10000E+01 volume 0.35361E-03 ppm1 3.871 ppm2 9.260 CV 1
ASSI { 954}
( segid " " and resid 8 and name HB% )
(( segid " " and resid 9 and name HE1 ))
4.300 2.300 1.700 peak 954 spectrum 1 weight 0.10000E+01 volume 0.35143E-03 ppm1 1.085 ppm2 7.727 CV 1
ASSI { 955}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 27 and name HD1 ))
4.200 2.200 1.800 peak 955 spectrum 1 weight 0.10000E+01 volume 0.35033E-03 ppm1 0.524 ppm2 4.041 CV 1
ASSI { 956}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 106 and name HB2 ))
4.900 3.000 1.100 peak 956 spectrum 1 weight 0.10000E+01 volume 0.34924E-03 ppm1 4.312 ppm2 2.412 CV 1
ASSI { 961}
(( segid " " and resid 78 and name HA ))
(( segid " " and resid 77 and name HA ))
4.200 2.200 1.800 peak 961 spectrum 1 weight 0.10000E+01 volume 0.34266E-03 ppm1 4.469 ppm2 3.810 CV 1
ASSI { 963}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 88 and name HN ))
4.100 2.100 1.900 peak 963 spectrum 1 weight 0.10000E+01 volume 0.33829E-03 ppm1 4.900 ppm2 9.398 CV 1
ASSI { 964}
(( segid " " and resid 104 and name HB ))
(( segid " " and resid 11 and name HA1 ))
2.400 2.400 3.600 peak 964 spectrum 1 weight 0.10000E+01 volume 0.33610E-03 ppm1 3.278 ppm2 4.255 CV 1
ASSI { 965}
(( segid " " and resid 68 and name HA1 ))
( segid " " and resid 67 and name HB% )
4.400 2.400 1.600 peak 965 spectrum 1 weight 0.10000E+01 volume 0.33500E-03 ppm1 4.014 ppm2 1.414 CV 1
ASSI { 966}
(( segid " " and resid 42 and name HA ))
(( segid " " and resid 38 and name HB1 ))
4.600 2.600 1.400 peak 966 spectrum 1 weight 0.10000E+01 volume 0.33391E-03 ppm1 5.106 ppm2 3.468 CV 1
ASSI { 967}
(( segid " " and resid 27 and name HG2 ))
( segid " " and resid 26 and name HD1%)
4.900 3.000 1.100 peak 967 spectrum 1 weight 0.10000E+01 volume 0.33282E-03 ppm1 2.021 ppm2 -0.633 CV 1
ASSI { 968}
(( segid " " and resid 4 and name HG1 ))
(( segid " " and resid 4 and name HA ))
4.300 2.300 1.700 peak 968 spectrum 1 weight 0.10000E+01 volume 0.33282E-03 ppm1 1.145 ppm2 4.876 CV 1
ASSI { 969}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HA ))
4.300 2.300 1.700 peak 969 spectrum 1 weight 0.10000E+01 volume 0.33062E-03 ppm1 2.669 ppm2 4.322 CV 1
ASSI { 973}
( segid " " and resid 75 and name HG1%)
( segid " " and resid 87 and name HD1%)
4.400 2.400 1.600 peak 973 spectrum 1 weight 0.10000E+01 volume 0.32515E-03 ppm1 0.935 ppm2 -0.459 CV 1
ASSI { 974}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 87 and name HN ))
2.400 2.400 3.600 peak 974 spectrum 1 weight 0.10000E+01 volume 0.32405E-03 ppm1 0.438 ppm2 9.303 CV 1
ASSI { 979}
(( segid " " and resid 27 and name HD1 ))
(( segid " " and resid 36 and name HZ2 ))
5.000 3.100 1.000 peak 979 spectrum 1 weight 0.10000E+01 volume 0.31967E-03 ppm1 4.037 ppm2 6.909 CV 1
ASSI { 980}
(( segid " " and resid 91 and name HG2 ))
( segid " " and resid 34 and name HE% )
4.700 2.700 1.300 peak 980 spectrum 1 weight 0.10000E+01 volume 0.31858E-03 ppm1 -0.142 ppm2 7.147 CV 1
ASSI { 983}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB2 ))
3.600 1.600 1.600 peak 983 spectrum 1 weight 0.10000E+01 volume 0.31530E-03 ppm1 4.892 ppm2 3.160 CV 1
ASSI { 991}
(( segid " " and resid 16 and name HA ))
(( segid " " and resid 3 and name HE1 ))
4.600 2.600 1.400 peak 991 spectrum 1 weight 0.10000E+01 volume 0.30763E-03 ppm1 4.620 ppm2 8.068 CV 1
ASSI { 994}
(( segid " " and resid 102 and name HD1 ))
(( segid " " and resid 103 and name HN ))
4.900 3.000 1.100 peak 994 spectrum 1 weight 0.10000E+01 volume 0.30435E-03 ppm1 3.145 ppm2 9.250 CV 1
ASSI { 996}
(( segid " " and resid 41 and name HA2 ))
( segid " " and resid 37 and name HD% )
4.100 2.100 1.900 peak 996 spectrum 1 weight 0.10000E+01 volume 0.30106E-03 ppm1 3.167 ppm2 6.832 CV 1
ASSI { 1001}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 83 and name HE1 ))
4.800 2.800 1.200 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.29231E-03 ppm1 4.500 ppm2 7.846 CV 1
ASSI { 1005}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 87 and name HN ))
4.900 3.000 1.100 peak 1005 spectrum 1 weight 0.10000E+01 volume 0.28793E-03 ppm1 -1.271 ppm2 9.296 CV 1
ASSI { 1012}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 85 and name HG1%)
4.900 3.000 1.100 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.28245E-03 ppm1 4.887 ppm2 0.595 CV 1
ASSI { 1013}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 32 and name HG2%)
5.200 3.400 0.800 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.28245E-03 ppm1 3.839 ppm2 1.306 CV 1
ASSI { 1014}
(( segid " " and resid 88 and name HA ))
(( segid " " and resid 89 and name HB2 ))
5.200 3.300 0.800 peak 1014 spectrum 1 weight 0.10000E+01 volume 0.27917E-03 ppm1 5.169 ppm2 0.048 CV 1
ASSI { 1016}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 7 and name HA ))
5.100 3.200 0.900 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.27917E-03 ppm1 0.359 ppm2 3.913 CV 1
ASSI { 1017}
(( segid " " and resid 27 and name HG1 ))
( segid " " and resid 26 and name HD1%)
5.300 3.500 0.700 peak 1017 spectrum 1 weight 0.10000E+01 volume 0.27917E-03 ppm1 2.186 ppm2 -0.647 CV 1
ASSI { 1018}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 22 and name HA ))
4.700 2.700 1.300 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.27807E-03 ppm1 3.198 ppm2 4.420 CV 1
ASSI { 1028}
( segid " " and resid 26 and name HD2%)
(( segid " " and resid 25 and name HB1 ))
4.700 2.800 1.300 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.27041E-03 ppm1 -1.271 ppm2 1.580 CV 1
ASSI { 1029}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 96 and name HD1 ))
4.700 2.700 1.300 peak 1029 spectrum 1 weight 0.10000E+01 volume 0.27041E-03 ppm1 0.753 ppm2 3.555 CV 1
ASSI { 1031}
( segid " " and resid 104 and name HG2%)
(( segid " " and resid 85 and name HB ))
4.600 2.600 1.400 peak 1031 spectrum 1 weight 0.10000E+01 volume 0.26603E-03 ppm1 0.437 ppm2 2.024 CV 1
ASSI { 1034}
(( segid " " and resid 103 and name HA ))
( segid " " and resid 26 and name HD2%)
5.100 3.300 0.900 peak 1034 spectrum 1 weight 0.10000E+01 volume 0.26165E-03 ppm1 4.680 ppm2 -1.282 CV 1
ASSI { 1037}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 46 and name HD1 ))
4.000 2.000 2.000 peak 1037 spectrum 1 weight 0.10000E+01 volume 0.26056E-03 ppm1 2.342 ppm2 3.227 CV 1
ASSI { 1039}
( segid " " and resid 87 and name HD2%)
(( segid " " and resid 39 and name HA ))
4.000 2.000 2.000 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.26056E-03 ppm1 -0.807 ppm2 3.995 CV 1
ASSI { 1040}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 16 and name HN ))
5.200 3.400 0.800 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.25508E-03 ppm1 1.290 ppm2 8.673 CV 1
ASSI { 1041}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 36 and name HB2 ))
5.400 3.700 0.600 peak 1041 spectrum 1 weight 0.10000E+01 volume 0.25508E-03 ppm1 1.246 ppm2 2.634 CV 1
ASSI { 1044}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 85 and name HA ))
5.300 3.600 0.700 peak 1044 spectrum 1 weight 0.10000E+01 volume 0.25290E-03 ppm1 0.613 ppm2 3.986 CV 1
ASSI { 1049}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 23 and name HA ))
4.800 2.900 1.200 peak 1049 spectrum 1 weight 0.10000E+01 volume 0.23866E-03 ppm1 0.610 ppm2 4.938 CV 1
ASSI { 1051}
(( segid " " and resid 36 and name HB1 ))
( segid " " and resid 87 and name HD1%)
3.900 1.900 1.900 peak 1051 spectrum 1 weight 0.10000E+01 volume 0.23757E-03 ppm1 3.134 ppm2 -0.452 CV 1
ASSI { 1056}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 87 and name HG ))
5.700 4.100 0.300 peak 1056 spectrum 1 weight 0.10000E+01 volume 0.23318E-03 ppm1 2.259 ppm2 0.667 CV 1
ASSI { 1057}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 7 and name HA ))
4.400 2.500 1.600 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.23209E-03 ppm1 2.280 ppm2 3.890 CV 1
ASSI { 1059}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 45 and name HA ))
4.300 2.300 1.700 peak 1059 spectrum 1 weight 0.10000E+01 volume 0.23100E-03 ppm1 1.954 ppm2 3.574 CV 1
ASSI { 1066}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 72 and name HA ))
4.500 2.600 1.500 peak 1066 spectrum 1 weight 0.10000E+01 volume 0.21677E-03 ppm1 1.158 ppm2 5.703 CV 1
ASSI { 1067}
(( segid " " and resid 108 and name HD1 ))
(( segid " " and resid 108 and name HN ))
5.200 3.400 0.800 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.21458E-03 ppm1 1.493 ppm2 9.162 CV 1
ASSI { 1068}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 93 and name HD1 ))
5.200 3.300 0.800 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.21239E-03 ppm1 4.300 ppm2 7.117 CV 1
ASSI { 1069}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 109 and name HB% )
4.400 2.500 1.600 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.21130E-03 ppm1 3.203 ppm2 1.348 CV 1
ASSI { 1071}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 86 and name HB1 ))
5.000 3.200 1.000 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.21019E-03 ppm1 4.884 ppm2 2.686 CV 1
ASSI { 1072}
(( segid " " and resid 86 and name HA ))
( segid " " and resid 87 and name HD1%)
5.200 3.400 0.800 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.20691E-03 ppm1 5.394 ppm2 -0.482 CV 1
ASSI { 1073}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 72 and name HA ))
4.500 2.500 1.500 peak 1073 spectrum 1 weight 0.10000E+01 volume 0.20582E-03 ppm1 0.134 ppm2 5.690 CV 1
ASSI { 1077}
(( segid " " and resid 27 and name HD2 ))
(( segid " " and resid 36 and name HE1 ))
4.300 2.300 1.700 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.20144E-03 ppm1 3.376 ppm2 10.257 CV 1
ASSI { 1079}
( segid " " and resid 12 and name HB% )
( segid " " and resid 106 and name HD% )
4.900 3.000 1.100 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.19706E-03 ppm1 1.543 ppm2 6.715 CV 1
ASSI { 1082}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 14 and name HN ))
4.500 2.600 1.500 peak 1082 spectrum 1 weight 0.10000E+01 volume 0.19268E-03 ppm1 1.545 ppm2 9.249 CV 1
ASSI { 1087}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 36 and name HD1 ))
4.800 2.800 1.200 peak 1087 spectrum 1 weight 0.10000E+01 volume 0.19049E-03 ppm1 4.122 ppm2 7.425 CV 1
ASSI { 1093}
(( segid " " and resid 102 and name HA ))
(( segid " " and resid 88 and name HB ))
5.500 3.800 0.500 peak 1093 spectrum 1 weight 0.10000E+01 volume 0.17626E-03 ppm1 5.351 ppm2 3.836 CV 1
ASSI { 1095}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 7 and name HD1 ))
5.200 3.400 0.800 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.17407E-03 ppm1 3.998 ppm2 1.703 CV 1
ASSI { 1096}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 71 and name HB1 ))
5.300 3.500 0.700 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.17407E-03 ppm1 3.885 ppm2 2.015 CV 1
ASSI { 1097}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 25 and name HG1 ))
5.800 4.300 0.200 peak 1097 spectrum 1 weight 0.10000E+01 volume 0.17407E-03 ppm1 5.711 ppm2 1.813 CV 1
ASSI { 1098}
( segid " " and resid 8 and name HB% )
(( segid " " and resid 6 and name HA ))
5.300 3.500 0.700 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.17188E-03 ppm1 1.085 ppm2 5.131 CV 1
ASSI { 1099}
(( segid " " and resid 69 and name HA1 ))
(( segid " " and resid 58 and name HB2 ))
5.200 3.400 0.800 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.17188E-03 ppm1 4.439 ppm2 2.619 CV 1
ASSI { 1100}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 106 and name HN ))
5.600 4.000 0.400 peak 1100 spectrum 1 weight 0.10000E+01 volume 0.17079E-03 ppm1 0.610 ppm2 8.655 CV 1
ASSI { 1105}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 90 and name HN ))
4.900 3.000 1.100 peak 1105 spectrum 1 weight 0.10000E+01 volume 0.16641E-03 ppm1 3.842 ppm2 8.999 CV 1
ASSI { 1107}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 86 and name HA ))
5.200 3.400 0.800 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.16531E-03 ppm1 1.245 ppm2 5.364 CV 1
ASSI { 1112}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 75 and name HN ))
5.100 3.300 0.900 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.15984E-03 ppm1 0.610 ppm2 9.762 CV 1
ASSI { 1118}
(( segid " " and resid 92 and name HB2 ))
(( segid " " and resid 91 and name HA ))
6.000 4.700 0.000 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.15655E-03 ppm1 1.346 ppm2 4.363 CV 1
ASSI { 1120}
(( segid " " and resid 33 and name HA2 ))
(( segid " " and resid 91 and name HD1 ))
5.800 4.300 0.200 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.15437E-03 ppm1 3.700 ppm2 2.629 CV 1
ASSI { 1122}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 74 and name HA ))
5.000 3.100 1.000 peak 1122 spectrum 1 weight 0.10000E+01 volume 0.14780E-03 ppm1 1.319 ppm2 5.301 CV 1
ASSI { 1125}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 1 and name HB1 ))
4.500 2.500 1.500 peak 1125 spectrum 1 weight 0.10000E+01 volume 0.14013E-03 ppm1 1.518 ppm2 3.702 CV 1
ASSI { 1126}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 86 and name HA ))
5.200 3.300 0.800 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.13904E-03 ppm1 4.017 ppm2 5.368 CV 1
ASSI { 1132}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 18 and name HA ))
5.500 3.800 0.500 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.13465E-03 ppm1 5.099 ppm2 3.183 CV 1
ASSI { 1134}
(( segid " " and resid 9 and name HB2 ))
( segid " " and resid 103 and name HD% )
5.000 3.100 1.000 peak 1134 spectrum 1 weight 0.10000E+01 volume 0.13465E-03 ppm1 3.295 ppm2 6.722 CV 1
ASSI { 1137}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 22 and name HN ))
5.800 4.300 0.200 peak 1137 spectrum 1 weight 0.10000E+01 volume 0.13028E-03 ppm1 1.513 ppm2 9.400 CV 1
ASSI { 1138}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 35 and name HN ))
4.900 3.000 1.100 peak 1138 spectrum 1 weight 0.10000E+01 volume 0.12918E-03 ppm1 4.321 ppm2 7.864 CV 1
ASSI { 1144}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 56 and name HG1 ))
5.000 3.100 1.000 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.12261E-03 ppm1 5.583 ppm2 1.011 CV 1
ASSI { 1146}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 66 and name HA2 ))
4.800 2.900 1.200 peak 1146 spectrum 1 weight 0.10000E+01 volume 0.12261E-03 ppm1 1.958 ppm2 3.753 CV 1
ASSI { 1147}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 95 and name HA2 ))
5.400 3.600 0.600 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.12261E-03 ppm1 0.339 ppm2 3.764 CV 1
ASSI { 1151}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 92 and name HD1 ))
5.900 4.300 0.100 peak 1151 spectrum 1 weight 0.10000E+01 volume 0.11933E-03 ppm1 0.345 ppm2 3.537 CV 1
ASSI { 1152}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 73 and name HA ))
5.100 3.200 0.900 peak 1152 spectrum 1 weight 0.10000E+01 volume 0.11824E-03 ppm1 2.254 ppm2 5.046 CV 1
ASSI { 1153}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 88 and name HN ))
2.900 2.900 3.100 peak 1153 spectrum 1 weight 0.10000E+01 volume 0.11824E-03 ppm1 1.839 ppm2 9.402 CV 1
ASSI { 1157}
( segid " " and resid 87 and name HD1%)
(( segid " " and resid 10 and name HA ))
5.900 4.400 0.100 peak 1157 spectrum 1 weight 0.10000E+01 volume 0.11386E-03 ppm1 -0.455 ppm2 4.009 CV 1
ASSI { 1161}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 90 and name HG2 ))
5.800 4.200 0.200 peak 1161 spectrum 1 weight 0.10000E+01 volume 0.10948E-03 ppm1 3.845 ppm2 1.769 CV 1
ASSI { 1164}
(( segid " " and resid 50 and name HG1 ))
(( segid " " and resid 77 and name HA ))
5.800 4.200 0.200 peak 1164 spectrum 1 weight 0.10000E+01 volume 0.10149E-03 ppm1 2.792 ppm2 3.788 CV 1
ASSI { 1165}
(( segid " " and resid 34 and name HB2 ))
( segid " " and resid 89 and name HD% )
4.900 3.000 1.100 peak 1165 spectrum 1 weight 0.10000E+01 volume 0.96885E-04 ppm1 0.740 ppm2 5.573 CV 1
ASSI { 1171}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 71 and name HB1 ))
5.500 3.700 0.500 peak 1171 spectrum 1 weight 0.10000E+01 volume 0.87366E-04 ppm1 0.433 ppm2 1.993 CV 1
ASSI { 1172}
(( segid " " and resid 48 and name HG1 ))
(( segid " " and resid 49 and name HA ))
5.100 3.300 0.900 peak 1172 spectrum 1 weight 0.10000E+01 volume 0.86488E-04 ppm1 2.216 ppm2 4.110 CV 1
ASSI { 1177}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 110 and name HB1 ))
4.600 2.600 1.400 peak 1177 spectrum 1 weight 0.10000E+01 volume 0.76635E-04 ppm1 3.997 ppm2 2.696 CV 1
ASSI { 1178}
(( segid " " and resid 72 and name HA ))
(( segid " " and resid 56 and name HD1 ))
6.000 4.700 0.000 peak 1178 spectrum 1 weight 0.10000E+01 volume 0.73679E-04 ppm1 5.709 ppm2 1.438 CV 1
ASSI { 1179}
(( segid " " and resid 69 and name HA1 ))
(( segid " " and resid 60 and name HG1 ))
5.500 3.700 0.500 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.73460E-04 ppm1 4.432 ppm2 1.976 CV 1
ASSI { 1183}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 45 and name HA ))
4.900 3.000 1.100 peak 1183 spectrum 1 weight 0.10000E+01 volume 0.67111E-04 ppm1 2.328 ppm2 3.567 CV 1
ASSI { 1185}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 110 and name HB2 ))
5.200 3.400 0.800 peak 1185 spectrum 1 weight 0.10000E+01 volume 0.65578E-04 ppm1 5.105 ppm2 2.606 CV 1
ASSI { 1188}
(( segid " " and resid 109 and name HA ))
(( segid " " and resid 22 and name HB ))
3.200 3.200 2.800 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.61965E-04 ppm1 5.524 ppm2 1.972 CV 1
ASSI { 1190}
(( segid " " and resid 19 and name HA2 ))
(( segid " " and resid 78 and name HB2 ))
5.500 3.800 0.500 peak 1190 spectrum 1 weight 0.10000E+01 volume 0.57367E-04 ppm1 3.590 ppm2 1.370 CV 1
ASSI { 1201}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 23 and name HA ))
2.200 0.600 0.600 peak 1201 spectrum 1 weight 0.11000E+01 volume 0.34924E-02 ppm1 5.341 ppm2 4.937 CV 1
ASSI { 1206}
( segid " " and resid 24 and name HG2%)
( segid " " and resid 26 and name HD2%)
2.500 0.800 0.800 peak 1206 spectrum 1 weight 0.11000E+01 volume 0.33062E-02 ppm1 0.133 ppm2 -1.272 CV 1
ASSI { 1207}
(( segid " " and resid 27 and name HD2 ))
( segid " " and resid 26 and name HD2%)
5.000 3.200 1.000 peak 1207 spectrum 1 weight 0.11000E+01 volume 0.24195E-03 ppm1 3.381 ppm2 -1.268 CV 1
ASSI { 1208}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 51 and name HA ))
3.200 1.300 1.300 peak 1208 spectrum 1 weight 0.11000E+01 volume 0.34924E-02 ppm1 3.817 ppm2 5.078 CV 1
ASSI { 4}
(( segid " " and resid 83 and name HE1 ))
(( segid " " and resid 45 and name HA ))
3.800 1.800 1.800 peak 4 spectrum 1 weight 0.10000E+01 volume 0.45304E-03 ppm1 7.815 ppm2 3.576 CV 1
ASSI { 9}
(( segid " " and resid 83 and name HE1 ))
(( segid " " and resid 87 and name HG ))
5.300 3.500 0.700 peak 9 spectrum 1 weight 0.10000E+01 volume 0.13364E-03 ppm1 7.814 ppm2 0.691 CV 1
ASSI { 13}
(( segid " " and resid 9 and name HE1 ))
( segid " " and resid 24 and name HD1%)
4.100 2.100 1.900 peak 13 spectrum 1 weight 0.10000E+01 volume 0.11152E-04 ppm1 7.731 ppm2 0.589 CV 1
ASSI { 20}
( segid " " and resid 38 and name HD% )
( segid " " and resid 38 and name HE% )
2.600 0.800 0.800 peak 20 spectrum 1 weight 0.10000E+01 volume 0.20758E-02 ppm1 7.504 ppm2 6.894 CV 1
ASSI { 21}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 43 and name HA ))
2.100 0.500 0.500 peak 21 spectrum 1 weight 0.10000E+01 volume 0.68788E-02 ppm1 7.503 ppm2 4.897 CV 1
ASSI { 28}
( segid " " and resid 38 and name HD% )
( segid " " and resid 53 and name HG1%)
3.600 1.600 1.600 peak 28 spectrum 1 weight 0.10000E+01 volume 0.87125E-03 ppm1 7.505 ppm2 1.338 CV 1
ASSI { 29}
( segid " " and resid 38 and name HD% )
( segid " " and resid 85 and name HG1%)
3.600 1.600 1.600 peak 29 spectrum 1 weight 0.10000E+01 volume 0.90456E-03 ppm1 7.502 ppm2 0.618 CV 1
ASSI { 30}
( segid " " and resid 38 and name HD% )
(( segid " " and resid 87 and name HN ))
4.600 2.600 1.400 peak 30 spectrum 1 weight 0.10000E+01 volume 0.17879E-03 ppm1 7.501 ppm2 9.352 CV 1
ASSI { 32}
( segid " " and resid 106 and name HD% )
(( segid " " and resid 106 and name HN ))
2.600 0.800 0.800 peak 32 spectrum 1 weight 0.10000E+01 volume 0.33485E-02 ppm1 6.703 ppm2 8.662 CV 1
ASSI { 44}
( segid " " and resid 51 and name HD% )
( segid " " and resid 75 and name HG2%)
4.100 2.100 1.900 peak 44 spectrum 1 weight 0.10000E+01 volume 0.41061E-03 ppm1 6.664 ppm2 0.597 CV 1
ASSI { 49}
( segid " " and resid 37 and name HD% )
(( segid " " and resid 38 and name HB2 ))
6.000 5.100 0.000 peak 49 spectrum 1 weight 0.10000E+01 volume 0.25303E-04 ppm1 6.848 ppm2 3.114 CV 1
ASSI { 54}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 89 and name HN ))
4.300 2.300 1.700 peak 54 spectrum 1 weight 0.10000E+01 volume 0.57879E-03 ppm1 5.586 ppm2 8.573 CV 1
ASSI { 60}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 89 and name HB1 ))
2.200 0.600 0.600 peak 60 spectrum 1 weight 0.10000E+01 volume 0.48333E-02 ppm1 5.586 ppm2 2.288 CV 1
ASSI { 61}
( segid " " and resid 89 and name HD% )
( segid " " and resid 35 and name HB% )
4.400 2.400 1.600 peak 61 spectrum 1 weight 0.10000E+01 volume 0.46819E-03 ppm1 5.585 ppm2 1.258 CV 1
ASSI { 62}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 89 and name HB2 ))
2.600 0.800 0.800 peak 62 spectrum 1 weight 0.10000E+01 volume 0.25606E-02 ppm1 5.587 ppm2 0.043 CV 1
ASSI { 70}
( segid " " and resid 73 and name HD% )
(( segid " " and resid 43 and name HB1 ))
2.900 1.100 1.100 peak 70 spectrum 1 weight 0.10000E+01 volume 0.21212E-02 ppm1 6.874 ppm2 2.179 CV 1
ASSI { 79}
( segid " " and resid 34 and name HE% )
(( segid " " and resid 96 and name HB2 ))
3.400 1.500 1.500 peak 79 spectrum 1 weight 0.10000E+01 volume 0.96817E-03 ppm1 7.134 ppm2 1.928 CV 1
ASSI { 84}
(( segid " " and resid 38 and name HZ ))
(( segid " " and resid 45 and name HA ))
3.000 1.100 1.100 peak 84 spectrum 1 weight 0.10000E+01 volume 0.10576E-02 ppm1 7.283 ppm2 3.567 CV 1
ASSI { 87}
(( segid " " and resid 38 and name HZ ))
(( segid " " and resid 85 and name HB ))
3.500 1.600 1.600 peak 87 spectrum 1 weight 0.10000E+01 volume 0.12561E-02 ppm1 7.269 ppm2 2.053 CV 1
ASSI { 90}
(( segid " " and resid 38 and name HZ ))
( segid " " and resid 85 and name HG1%)
2.600 0.800 0.800 peak 90 spectrum 1 weight 0.10000E+01 volume 0.34849E-02 ppm1 7.292 ppm2 0.608 CV 1
ASSI { 95}
(( segid " " and resid 93 and name HD1 ))
(( segid " " and resid 93 and name HB1 ))
3.400 1.400 1.400 peak 95 spectrum 1 weight 0.10000E+01 volume 0.27576E-02 ppm1 7.100 ppm2 3.301 CV 1
ASSI { 100}
( segid " " and resid 38 and name HE% )
(( segid " " and resid 45 and name HA ))
3.600 1.600 1.600 peak 100 spectrum 1 weight 0.10000E+01 volume 0.45455E-03 ppm1 6.902 ppm2 3.577 CV 1
ASSI { 101}
( segid " " and resid 38 and name HE% )
(( segid " " and resid 46 and name HD1 ))
4.100 2.100 1.900 peak 101 spectrum 1 weight 0.10000E+01 volume 0.26364E-03 ppm1 6.886 ppm2 3.193 CV 1
ASSI { 103}
( segid " " and resid 38 and name HE% )
(( segid " " and resid 43 and name HB1 ))
4.700 2.700 1.300 peak 103 spectrum 1 weight 0.10000E+01 volume 0.30152E-03 ppm1 6.889 ppm2 2.128 CV 1
ASSI { 104}
( segid " " and resid 38 and name HE% )
( segid " " and resid 53 and name HG1%)
2.900 1.100 1.100 peak 104 spectrum 1 weight 0.10000E+01 volume 0.21212E-02 ppm1 6.890 ppm2 1.349 CV 1
ASSI { 105}
( segid " " and resid 38 and name HE% )
( segid " " and resid 85 and name HG1%)
3.200 1.300 1.300 peak 105 spectrum 1 weight 0.10000E+01 volume 0.12940E-02 ppm1 6.890 ppm2 0.606 CV 1
ASSI { 107}
(( segid " " and resid 36 and name HD1 ))
(( segid " " and resid 36 and name HE1 ))
2.500 0.800 0.800 peak 107 spectrum 1 weight 0.10000E+01 volume 0.21818E-02 ppm1 7.419 ppm2 10.277 CV 1
ASSI { 109}
(( segid " " and resid 36 and name HD1 ))
(( segid " " and resid 36 and name HZ2 ))
3.900 1.900 1.900 peak 109 spectrum 1 weight 0.10000E+01 volume 0.77122E-03 ppm1 7.418 ppm2 6.909 CV 1
ASSI { 112}
(( segid " " and resid 36 and name HD1 ))
(( segid " " and resid 28 and name HA ))
5.600 5.600 0.400 peak 112 spectrum 1 weight 0.10000E+01 volume 0.84394E-05 ppm1 7.417 ppm2 4.810 CV 1
ASSI { 113}
(( segid " " and resid 36 and name HD1 ))
(( segid " " and resid 28 and name HB1 ))
3.200 1.300 1.300 peak 113 spectrum 1 weight 0.10000E+01 volume 0.23333E-02 ppm1 7.418 ppm2 4.111 CV 1
ASSI { 115}
(( segid " " and resid 36 and name HD1 ))
(( segid " " and resid 57 and name HB2 ))
6.000 5.200 0.000 peak 115 spectrum 1 weight 0.10000E+01 volume 0.69697E-04 ppm1 7.419 ppm2 2.585 CV 1
ASSI { 116}
(( segid " " and resid 36 and name HD1 ))
(( segid " " and resid 71 and name HB1 ))
3.900 1.900 1.900 peak 116 spectrum 1 weight 0.10000E+01 volume 0.74697E-03 ppm1 7.418 ppm2 2.004 CV 1
ASSI { 119}
(( segid " " and resid 93 and name HH2 ))
(( segid " " and resid 33 and name HA1 ))
3.400 1.400 1.400 peak 119 spectrum 1 weight 0.10000E+01 volume 0.82425E-03 ppm1 7.205 ppm2 4.327 CV 1
ASSI { 120}
(( segid " " and resid 93 and name HH2 ))
(( segid " " and resid 33 and name HA2 ))
3.200 1.300 1.300 peak 120 spectrum 1 weight 0.10000E+01 volume 0.74849E-03 ppm1 7.204 ppm2 3.683 CV 1
ASSI { 121}
(( segid " " and resid 93 and name HH2 ))
(( segid " " and resid 91 and name HD1 ))
3.800 1.800 1.800 peak 121 spectrum 1 weight 0.10000E+01 volume 0.55000E-03 ppm1 7.209 ppm2 2.619 CV 1
ASSI { 122}
(( segid " " and resid 93 and name HH2 ))
(( segid " " and resid 91 and name HG1 ))
4.200 2.200 1.800 peak 122 spectrum 1 weight 0.10000E+01 volume 0.47273E-03 ppm1 7.204 ppm2 0.347 CV 1
ASSI { 129}
(( segid " " and resid 36 and name HZ3 ))
(( segid " " and resid 103 and name HB2 ))
2.700 0.900 0.900 peak 129 spectrum 1 weight 0.10000E+01 volume 0.20303E-02 ppm1 6.760 ppm2 2.282 CV 1
OR { 129}
(( segid " " and resid 36 and name HH2 ))
(( segid " " and resid 103 and name HB2 ))
ASSI { 133}
(( segid " " and resid 36 and name HH2 ))
( segid " " and resid 26 and name HD1%)
4.300 2.300 1.700 peak 133 spectrum 1 weight 0.10000E+01 volume 0.21667E-03 ppm1 6.764 ppm2 -0.622 CV 1
ASSI { 135}
(( segid " " and resid 93 and name HZ3 ))
(( segid " " and resid 93 and name HE3 ))
2.200 0.600 0.600 peak 135 spectrum 1 weight 0.10000E+01 volume 0.70606E-02 ppm1 7.175 ppm2 7.567 CV 1
ASSI { 137}
(( segid " " and resid 93 and name HZ3 ))
(( segid " " and resid 91 and name HA ))
6.000 5.100 0.000 peak 137 spectrum 1 weight 0.10000E+01 volume 0.44242E-04 ppm1 7.181 ppm2 4.324 CV 1
ASSI { 138}
(( segid " " and resid 93 and name HZ3 ))
(( segid " " and resid 92 and name HD1 ))
3.900 1.900 1.900 peak 138 spectrum 1 weight 0.10000E+01 volume 0.14394E-02 ppm1 7.178 ppm2 3.552 CV 1
ASSI { 139}
(( segid " " and resid 93 and name HZ3 ))
(( segid " " and resid 92 and name HG1 ))
4.300 2.300 1.700 peak 139 spectrum 1 weight 0.10000E+01 volume 0.53333E-03 ppm1 7.174 ppm2 1.813 CV 1
ASSI { 140}
(( segid " " and resid 36 and name HE3 ))
(( segid " " and resid 87 and name HN ))
3.600 1.600 1.600 peak 140 spectrum 1 weight 0.10000E+01 volume 0.11636E-02 ppm1 7.076 ppm2 9.336 CV 1
ASSI { 141}
(( segid " " and resid 36 and name HE3 ))
(( segid " " and resid 36 and name HA ))
2.800 1.000 1.000 peak 141 spectrum 1 weight 0.10000E+01 volume 0.12621E-02 ppm1 7.080 ppm2 4.987 CV 1
ASSI { 146}
(( segid " " and resid 36 and name HE3 ))
(( segid " " and resid 87 and name HB2 ))
2.400 0.700 0.700 peak 146 spectrum 1 weight 0.10000E+01 volume 0.26818E-02 ppm1 7.076 ppm2 1.273 CV 1
ASSI { 152}
(( segid " " and resid 93 and name HE3 ))
(( segid " " and resid 93 and name HA ))
4.300 2.300 1.700 peak 152 spectrum 1 weight 0.10000E+01 volume 0.49697E-03 ppm1 7.573 ppm2 4.532 CV 1
ASSI { 153}
(( segid " " and resid 93 and name HE3 ))
(( segid " " and resid 93 and name HB1 ))
2.400 0.700 0.700 peak 153 spectrum 1 weight 0.10000E+01 volume 0.32121E-02 ppm1 7.570 ppm2 3.296 CV 1
ASSI { 154}
(( segid " " and resid 93 and name HE3 ))
(( segid " " and resid 92 and name HG1 ))
3.700 1.700 1.700 peak 154 spectrum 1 weight 0.10000E+01 volume 0.23485E-02 ppm1 7.571 ppm2 1.809 CV 1
ASSI { 162}
(( segid " " and resid 9 and name HD2 ))
(( segid " " and resid 105 and name HA ))
5.100 3.300 0.900 peak 162 spectrum 1 weight 0.10000E+01 volume 0.27576E-03 ppm1 7.005 ppm2 4.325 CV 1
ASSI { 165}
(( segid " " and resid 3 and name HD2 ))
(( segid " " and resid 24 and name HA ))
5.000 3.100 1.000 peak 165 spectrum 1 weight 0.10000E+01 volume 0.10894E-03 ppm1 6.909 ppm2 4.446 CV 1
ASSI { 167}
(( segid " " and resid 3 and name HD2 ))
(( segid " " and resid 16 and name HB ))
3.000 1.100 1.100 peak 167 spectrum 1 weight 0.10000E+01 volume 0.17273E-02 ppm1 6.909 ppm2 2.058 CV 1
ASSI { 168}
(( segid " " and resid 3 and name HD2 ))
( segid " " and resid 109 and name HB% )
5.600 4.000 0.400 peak 168 spectrum 1 weight 0.10000E+01 volume 0.81970E-04 ppm1 6.907 ppm2 1.335 CV 1
ASSI { 172}
( segid " " and resid 37 and name HE% )
(( segid " " and resid 37 and name HN ))
3.400 3.400 2.600 peak 172 spectrum 1 weight 0.10000E+01 volume 0.16061E-02 ppm1 6.698 ppm2 9.091 CV 1
ASSI { 174}
( segid " " and resid 37 and name HE% )
(( segid " " and resid 35 and name HN ))
3.500 3.500 2.500 peak 174 spectrum 1 weight 0.10000E+01 volume 0.10333E-02 ppm1 6.704 ppm2 7.857 CV 1
ASSI { 179}
( segid " " and resid 37 and name HE% )
(( segid " " and resid 41 and name HA1 ))
3.200 3.200 2.800 peak 179 spectrum 1 weight 0.10000E+01 volume 0.35455E-02 ppm1 6.707 ppm2 3.885 CV 1
ASSI { 205}
( segid " " and resid 89 and name HE% )
(( segid " " and resid 34 and name HB1 ))
3.600 1.600 1.600 peak 205 spectrum 1 weight 0.10000E+01 volume 0.97273E-03 ppm1 6.442 ppm2 2.331 CV 1
ASSI { 206}
( segid " " and resid 89 and name HE% )
(( segid " " and resid 101 and name HB1 ))
2.100 2.100 3.900 peak 206 spectrum 1 weight 0.10000E+01 volume 0.61364E-03 ppm1 6.449 ppm2 1.950 CV 1
ASSI { 207}
( segid " " and resid 89 and name HE% )
( segid " " and resid 31 and name HG2%)
2.800 1.000 1.000 peak 207 spectrum 1 weight 0.10000E+01 volume 0.15455E-02 ppm1 6.454 ppm2 1.303 CV 1
ASSI { 208}
( segid " " and resid 89 and name HE% )
(( segid " " and resid 34 and name HB2 ))
3.100 3.100 2.900 peak 208 spectrum 1 weight 0.10000E+01 volume 0.59243E-03 ppm1 6.457 ppm2 0.780 CV 1
ASSI { 217}
(( segid " " and resid 93 and name HZ2 ))
(( segid " " and resid 33 and name HA1 ))
3.300 1.400 1.400 peak 217 spectrum 1 weight 0.10000E+01 volume 0.56819E-03 ppm1 7.378 ppm2 4.324 CV 1
ASSI { 218}
(( segid " " and resid 93 and name HZ2 ))
(( segid " " and resid 91 and name HD1 ))
2.700 0.900 0.900 peak 218 spectrum 1 weight 0.10000E+01 volume 0.21515E-02 ppm1 7.370 ppm2 2.603 CV 1
ASSI { 220}
(( segid " " and resid 36 and name HZ2 ))
(( segid " " and resid 36 and name HE1 ))
2.800 1.000 1.000 peak 220 spectrum 1 weight 0.10000E+01 volume 0.16061E-02 ppm1 6.931 ppm2 10.275 CV 1
ASSI { 229}
(( segid " " and resid 36 and name HZ2 ))
(( segid " " and resid 26 and name HB2 ))
3.700 3.700 2.300 peak 229 spectrum 1 weight 0.10000E+01 volume 0.14591E-02 ppm1 6.935 ppm2 0.449 CV 1
ASSI { 234}
(( segid " " and resid 36 and name HZ2 ))
(( segid " " and resid 103 and name HB2 ))
5.800 4.200 0.200 peak 234 spectrum 1 weight 0.10000E+01 volume 0.40909E-04 ppm1 6.926 ppm2 2.249 CV 1
ASSI { 236}
(( segid " " and resid 36 and name HH2 ))
( segid " " and resid 26 and name HD2%)
4.700 2.700 1.300 peak 236 spectrum 1 weight 0.11000E+01 volume 0.28636E-03 ppm1 6.764 ppm2 -1.279 CV 1
ASSI { 3}
(( segid " " and resid 110 and name HD22))
(( segid " " and resid 110 and name HD21))
1.700 0.300 0.500 peak 3 spectrum 1 weight 0.11000E+01 volume 0.20698E-01 ppm1 6.670 ppm2 7.506 CV 1
ASSI { 6}
(( segid " " and resid 84 and name HN ))
(( segid " " and resid 83 and name HA ))
2.000 0.500 0.500 peak 6 spectrum 1 weight 0.10000E+01 volume 0.15437E-01 ppm1 9.060 ppm2 4.910 CV 1
ASSI { 11}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HA ))
1.900 0.500 0.500 peak 11 spectrum 1 weight 0.10000E+01 volume 0.13406E-01 ppm1 9.022 ppm2 4.889 CV 1
ASSI { 12}
(( segid " " and resid 10 and name HD21))
(( segid " " and resid 10 and name HD22))
1.700 0.400 0.500 peak 12 spectrum 1 weight 0.11000E+01 volume 0.13337E-01 ppm1 7.805 ppm2 6.979 CV 1
ASSI { 13}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 73 and name HA ))
2.000 0.500 0.500 peak 13 spectrum 1 weight 0.10000E+01 volume 0.12184E-01 ppm1 9.587 ppm2 5.068 CV 1
ASSI { 15}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HA ))
2.200 0.600 0.600 peak 15 spectrum 1 weight 0.11000E+01 volume 0.93684E-02 ppm1 8.433 ppm2 4.298 CV 1
ASSI { 16}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 107 and name HA ))
2.900 2.900 3.100 peak 16 spectrum 1 weight 0.10000E+01 volume 0.92530E-02 ppm1 8.641 ppm2 4.932 CV 1
ASSI { 17}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 28 and name HB1 ))
2.700 2.700 3.300 peak 17 spectrum 1 weight 0.10000E+01 volume 0.84684E-02 ppm1 8.223 ppm2 4.158 CV 1
ASSI { 18}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 69 and name HA2 ))
2.700 2.700 3.300 peak 18 spectrum 1 weight 0.10000E+01 volume 0.84684E-02 ppm1 8.338 ppm2 4.210 CV 1
ASSI { 21}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 101 and name HA ))
2.300 0.700 0.700 peak 21 spectrum 1 weight 0.10000E+01 volume 0.77762E-02 ppm1 8.491 ppm2 4.318 CV 1
ASSI { 23}
(( segid " " and resid 78 and name HN ))
(( segid " " and resid 78 and name HD1 ))
2.200 0.600 0.600 peak 23 spectrum 1 weight 0.10000E+01 volume 0.77301E-02 ppm1 8.546 ppm2 1.544 CV 1
ASSI { 24}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 68 and name HA1 ))
2.900 2.900 3.100 peak 24 spectrum 1 weight 0.10000E+01 volume 0.77070E-02 ppm1 8.657 ppm2 4.059 CV 1
ASSI { 25}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HA ))
1.900 0.500 0.500 peak 25 spectrum 1 weight 0.10000E+01 volume 0.75685E-02 ppm1 8.540 ppm2 4.901 CV 1
ASSI { 28}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 76 and name HA ))
2.200 0.600 0.600 peak 28 spectrum 1 weight 0.10000E+01 volume 0.74301E-02 ppm1 8.653 ppm2 4.846 CV 1
ASSI { 29}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 21 and name HA ))
2.200 0.600 0.600 peak 29 spectrum 1 weight 0.10000E+01 volume 0.73839E-02 ppm1 9.384 ppm2 4.840 CV 1
ASSI { 32}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 3 and name HA ))
2.400 0.700 0.700 peak 32 spectrum 1 weight 0.10000E+01 volume 0.71994E-02 ppm1 8.609 ppm2 4.678 CV 1
ASSI { 33}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 80 and name HA ))
2.200 0.600 0.600 peak 33 spectrum 1 weight 0.10000E+01 volume 0.71994E-02 ppm1 8.447 ppm2 3.975 CV 1
ASSI { 35}
(( segid " " and resid 4 and name HN ))
(( segid " " and resid 3 and name HA ))
2.400 0.700 0.700 peak 35 spectrum 1 weight 0.10000E+01 volume 0.67840E-02 ppm1 8.542 ppm2 4.695 CV 1
ASSI { 37}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HA ))
2.500 0.800 0.800 peak 37 spectrum 1 weight 0.11000E+01 volume 0.67609E-02 ppm1 8.912 ppm2 4.020 CV 1
ASSI { 41}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 108 and name HA ))
2.100 0.600 0.600 peak 41 spectrum 1 weight 0.10000E+01 volume 0.65764E-02 ppm1 9.065 ppm2 4.780 CV 1
ASSI { 43}
(( segid " " and resid 84 and name HN ))
( segid " " and resid 84 and name HB% )
2.400 0.700 0.700 peak 43 spectrum 1 weight 0.10000E+01 volume 0.64609E-02 ppm1 9.062 ppm2 1.352 CV 1
ASSI { 44}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HB ))
2.200 0.600 0.600 peak 44 spectrum 1 weight 0.10000E+01 volume 0.64379E-02 ppm1 9.053 ppm2 1.736 CV 1
ASSI { 47}
(( segid " " and resid 48 and name HN ))
(( segid " " and resid 48 and name HB1 ))
2.400 0.700 0.700 peak 47 spectrum 1 weight 0.10000E+01 volume 0.61379E-02 ppm1 9.016 ppm2 1.955 CV 1
ASSI { 50}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HA ))
2.500 0.800 0.800 peak 50 spectrum 1 weight 0.10000E+01 volume 0.59302E-02 ppm1 8.382 ppm2 4.437 CV 1
ASSI { 52}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HB1 ))
2.500 0.800 0.800 peak 52 spectrum 1 weight 0.10000E+01 volume 0.58379E-02 ppm1 7.779 ppm2 1.549 CV 1
ASSI { 54}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 85 and name HB ))
2.400 0.700 0.700 peak 54 spectrum 1 weight 0.10000E+01 volume 0.57456E-02 ppm1 8.595 ppm2 2.050 CV 1
ASSI { 57}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 54 and name HB1 ))
2.700 0.900 0.900 peak 57 spectrum 1 weight 0.10000E+01 volume 0.56764E-02 ppm1 9.057 ppm2 2.173 CV 1
ASSI { 58}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 95 and name HN ))
2.200 0.600 0.600 peak 58 spectrum 1 weight 0.11000E+01 volume 0.56302E-02 ppm1 6.749 ppm2 7.581 CV 1
ASSI { 59}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HG2 ))
2.500 0.800 0.800 peak 59 spectrum 1 weight 0.10000E+01 volume 0.56072E-02 ppm1 7.859 ppm2 2.237 CV 1
ASSI { 63}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 4 and name HA ))
2.200 0.600 0.600 peak 63 spectrum 1 weight 0.10000E+01 volume 0.55149E-02 ppm1 8.941 ppm2 4.846 CV 1
ASSI { 64}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HA ))
2.300 0.700 0.700 peak 64 spectrum 1 weight 0.11000E+01 volume 0.55149E-02 ppm1 8.266 ppm2 3.571 CV 1
ASSI { 66}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 87 and name HA ))
2.300 0.700 0.700 peak 66 spectrum 1 weight 0.10000E+01 volume 0.54687E-02 ppm1 9.396 ppm2 4.890 CV 1
ASSI { 67}
(( segid " " and resid 105 and name HN ))
( segid " " and resid 5 and name HG2%)
3.300 3.300 2.700 peak 67 spectrum 1 weight 0.10000E+01 volume 0.53533E-02 ppm1 7.823 ppm2 0.543 CV 1
ASSI { 70}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HG1 ))
2.400 0.700 0.700 peak 70 spectrum 1 weight 0.10000E+01 volume 0.51918E-02 ppm1 8.715 ppm2 1.835 CV 1
ASSI { 71}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 62 and name HA ))
1.600 1.600 4.400 peak 71 spectrum 1 weight 0.10000E+01 volume 0.51688E-02 ppm1 8.116 ppm2 4.294 CV 1
ASSI { 80}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 12 and name HB% )
2.400 0.700 0.700 peak 80 spectrum 1 weight 0.10000E+01 volume 0.48457E-02 ppm1 8.498 ppm2 1.523 CV 1
ASSI { 81}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 91 and name HA ))
3.200 3.200 2.800 peak 81 spectrum 1 weight 0.10000E+01 volume 0.48227E-02 ppm1 7.824 ppm2 4.357 CV 1
ASSI { 83}
(( segid " " and resid 108 and name HN ))
(( segid " " and resid 107 and name HA ))
2.400 0.700 0.700 peak 83 spectrum 1 weight 0.10000E+01 volume 0.48227E-02 ppm1 9.143 ppm2 4.927 CV 1
ASSI { 84}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 44 and name HB2 ))
3.000 3.000 3.000 peak 84 spectrum 1 weight 0.10000E+01 volume 0.48227E-02 ppm1 9.138 ppm2 1.824 CV 1
ASSI { 85}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 57 and name HA ))
2.300 0.600 0.600 peak 85 spectrum 1 weight 0.11000E+01 volume 0.48227E-02 ppm1 8.480 ppm2 5.033 CV 1
ASSI { 86}
(( segid " " and resid 99 and name HN ))
(( segid " " and resid 95 and name HA2 ))
2.600 2.600 3.400 peak 86 spectrum 1 weight 0.10000E+01 volume 0.47534E-02 ppm1 8.122 ppm2 3.774 CV 1
ASSI { 87}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 67 and name HB% )
2.600 0.900 0.900 peak 87 spectrum 1 weight 0.10000E+01 volume 0.47534E-02 ppm1 7.676 ppm2 1.432 CV 1
ASSI { 89}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HA ))
2.400 2.400 3.600 peak 89 spectrum 1 weight 0.11000E+01 volume 0.47072E-02 ppm1 9.162 ppm2 4.882 CV 1
ASSI { 90}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 7 and name HB2 ))
2.100 0.500 0.500 peak 90 spectrum 1 weight 0.10000E+01 volume 0.46842E-02 ppm1 8.863 ppm2 1.729 CV 1
ASSI { 92}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HA ))
2.300 0.600 0.600 peak 92 spectrum 1 weight 0.10000E+01 volume 0.46380E-02 ppm1 8.414 ppm2 4.476 CV 1
ASSI { 93}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA ))
2.500 0.800 0.800 peak 93 spectrum 1 weight 0.10000E+01 volume 0.46150E-02 ppm1 8.207 ppm2 4.743 CV 1
ASSI { 94}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 108 and name HG1 ))
2.800 1.000 1.000 peak 94 spectrum 1 weight 0.10000E+01 volume 0.45227E-02 ppm1 9.065 ppm2 1.271 CV 1
ASSI { 97}
(( segid " " and resid 108 and name HN ))
( segid " " and resid 15 and name HG2%)
3.200 1.300 1.300 peak 97 spectrum 1 weight 0.10000E+01 volume 0.44996E-02 ppm1 9.143 ppm2 1.180 CV 1
ASSI { 98}
(( segid " " and resid 93 and name HE1 ))
(( segid " " and resid 93 and name HD1 ))
2.600 0.900 0.900 peak 98 spectrum 1 weight 0.10000E+01 volume 0.44534E-02 ppm1 10.252 ppm2 7.138 CV 1
ASSI { 99}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 84 and name HB% )
2.900 1.100 1.100 peak 99 spectrum 1 weight 0.10000E+01 volume 0.43842E-02 ppm1 8.597 ppm2 1.341 CV 1
ASSI { 100}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HB2 ))
2.700 0.900 0.900 peak 100 spectrum 1 weight 0.10000E+01 volume 0.43842E-02 ppm1 8.210 ppm2 1.550 CV 1
ASSI { 101}
(( segid " " and resid 8 and name HN ))
( segid " " and resid 8 and name HB% )
2.600 0.800 0.800 peak 101 spectrum 1 weight 0.10000E+01 volume 0.43611E-02 ppm1 7.882 ppm2 1.049 CV 1
ASSI { 102}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
2.100 0.600 0.600 peak 102 spectrum 1 weight 0.10000E+01 volume 0.43611E-02 ppm1 8.540 ppm2 0.435 CV 1
ASSI { 105}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 18 and name HG1%)
3.300 1.400 1.400 peak 105 spectrum 1 weight 0.10000E+01 volume 0.43381E-02 ppm1 8.613 ppm2 0.786 CV 1
ASSI { 106}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HN ))
2.500 0.800 0.800 peak 106 spectrum 1 weight 0.11000E+01 volume 0.43150E-02 ppm1 7.857 ppm2 8.587 CV 1
ASSI { 108}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 78 and name HN ))
2.900 1.000 1.000 peak 108 spectrum 1 weight 0.11000E+01 volume 0.42689E-02 ppm1 7.318 ppm2 8.559 CV 1
ASSI { 110}
(( segid " " and resid 2 and name HN ))
(( segid " " and resid 2 and name HA ))
2.600 0.900 0.900 peak 110 spectrum 1 weight 0.10000E+01 volume 0.42689E-02 ppm1 8.328 ppm2 4.617 CV 1
ASSI { 111}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HB1 ))
3.500 1.500 1.500 peak 111 spectrum 1 weight 0.10000E+01 volume 0.42227E-02 ppm1 8.266 ppm2 2.102 CV 1
ASSI { 112}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HA ))
2.400 0.700 0.700 peak 112 spectrum 1 weight 0.10000E+01 volume 0.42227E-02 ppm1 7.857 ppm2 3.869 CV 1
ASSI { 113}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 89 and name HA ))
2.300 0.700 0.700 peak 113 spectrum 1 weight 0.10000E+01 volume 0.42227E-02 ppm1 8.966 ppm2 4.446 CV 1
ASSI { 114}
(( segid " " and resid 77 and name HN ))
(( segid " " and resid 77 and name HB ))
2.700 0.900 0.900 peak 114 spectrum 1 weight 0.10000E+01 volume 0.41765E-02 ppm1 8.653 ppm2 2.026 CV 1
ASSI { 115}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 35 and name HB% )
2.700 0.900 0.900 peak 115 spectrum 1 weight 0.10000E+01 volume 0.41073E-02 ppm1 8.914 ppm2 1.261 CV 1
ASSI { 116}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HB ))
2.600 0.800 0.800 peak 116 spectrum 1 weight 0.10000E+01 volume 0.41073E-02 ppm1 8.375 ppm2 2.066 CV 1
ASSI { 119}
(( segid " " and resid 76 and name HN ))
( segid " " and resid 21 and name HD1%)
2.700 0.900 0.900 peak 119 spectrum 1 weight 0.10000E+01 volume 0.39228E-02 ppm1 8.710 ppm2 0.687 CV 1
ASSI { 120}
(( segid " " and resid 5 and name HN ))
( segid " " and resid 24 and name HD1%)
2.800 1.000 1.000 peak 120 spectrum 1 weight 0.10000E+01 volume 0.39228E-02 ppm1 8.941 ppm2 0.589 CV 1
ASSI { 121}
(( segid " " and resid 13 and name HN ))
( segid " " and resid 12 and name HB% )
2.600 0.900 0.900 peak 121 spectrum 1 weight 0.10000E+01 volume 0.38996E-02 ppm1 8.266 ppm2 1.525 CV 1
ASSI { 123}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 6 and name HB ))
2.400 0.700 0.700 peak 123 spectrum 1 weight 0.10000E+01 volume 0.38535E-02 ppm1 8.863 ppm2 4.752 CV 1
ASSI { 126}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 46 and name HD2 ))
2.800 2.800 3.200 peak 126 spectrum 1 weight 0.10000E+01 volume 0.36689E-02 ppm1 7.563 ppm2 2.652 CV 1
ASSI { 127}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HA ))
2.600 0.800 0.800 peak 127 spectrum 1 weight 0.11000E+01 volume 0.36228E-02 ppm1 8.266 ppm2 4.307 CV 1
ASSI { 128}
(( segid " " and resid 33 and name HN ))
( segid " " and resid 32 and name HG2%)
2.600 0.800 0.800 peak 128 spectrum 1 weight 0.10000E+01 volume 0.35996E-02 ppm1 7.818 ppm2 1.292 CV 1
ASSI { 131}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HA ))
2.400 0.700 0.700 peak 131 spectrum 1 weight 0.10000E+01 volume 0.35304E-02 ppm1 8.962 ppm2 4.793 CV 1
ASSI { 132}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HA ))
2.700 0.900 0.900 peak 132 spectrum 1 weight 0.10000E+01 volume 0.34843E-02 ppm1 7.860 ppm2 4.298 CV 1
ASSI { 136}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 62 and name HA ))
3.200 3.200 2.800 peak 136 spectrum 1 weight 0.10000E+01 volume 0.34382E-02 ppm1 7.781 ppm2 4.300 CV 1
ASSI { 138}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA1 ))
2.800 1.000 1.000 peak 138 spectrum 1 weight 0.10000E+01 volume 0.34151E-02 ppm1 8.614 ppm2 4.348 CV 1
ASSI { 140}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 75 and name HB ))
2.900 1.100 1.100 peak 140 spectrum 1 weight 0.10000E+01 volume 0.33459E-02 ppm1 9.788 ppm2 1.981 CV 1
ASSI { 141}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 25 and name HG2 ))
3.300 3.300 2.700 peak 141 spectrum 1 weight 0.10000E+01 volume 0.32997E-02 ppm1 8.874 ppm2 1.166 CV 1
ASSI { 142}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 58 and name HB2 ))
2.500 0.800 0.800 peak 142 spectrum 1 weight 0.10000E+01 volume 0.32766E-02 ppm1 8.480 ppm2 2.649 CV 1
ASSI { 148}
(( segid " " and resid 100 and name HN ))
(( segid " " and resid 95 and name HA2 ))
2.600 2.600 3.400 peak 148 spectrum 1 weight 0.10000E+01 volume 0.31382E-02 ppm1 7.542 ppm2 3.777 CV 1
ASSI { 150}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HB1 ))
2.800 1.000 1.000 peak 150 spectrum 1 weight 0.10000E+01 volume 0.30690E-02 ppm1 8.327 ppm2 1.470 CV 1
ASSI { 153}
(( segid " " and resid 77 and name HN ))
( segid " " and resid 77 and name HG2%)
3.200 1.300 1.300 peak 153 spectrum 1 weight 0.10000E+01 volume 0.30459E-02 ppm1 8.654 ppm2 0.836 CV 1
ASSI { 158}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HB1 ))
2.800 1.000 1.000 peak 158 spectrum 1 weight 0.10000E+01 volume 0.29536E-02 ppm1 7.329 ppm2 1.926 CV 1
ASSI { 159}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HA ))
2.700 0.900 0.900 peak 159 spectrum 1 weight 0.10000E+01 volume 0.28844E-02 ppm1 8.489 ppm2 4.283 CV 1
ASSI { 160}
(( segid " " and resid 47 and name HD21))
(( segid " " and resid 47 and name HB1 ))
2.900 1.100 1.100 peak 160 spectrum 1 weight 0.11000E+01 volume 0.28844E-02 ppm1 7.632 ppm2 2.589 CV 1
ASSI { 164}
(( segid " " and resid 85 and name HN ))
( segid " " and resid 104 and name HG2%)
2.800 1.000 1.000 peak 164 spectrum 1 weight 0.10000E+01 volume 0.28613E-02 ppm1 8.588 ppm2 0.406 CV 1
ASSI { 166}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HG2 ))
3.100 1.200 1.200 peak 166 spectrum 1 weight 0.10000E+01 volume 0.27921E-02 ppm1 8.408 ppm2 1.865 CV 1
ASSI { 167}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HA ))
2.700 0.900 0.900 peak 167 spectrum 1 weight 0.11000E+01 volume 0.27459E-02 ppm1 7.956 ppm2 4.348 CV 1
ASSI { 168}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 102 and name HB1 ))
3.000 1.100 1.100 peak 168 spectrum 1 weight 0.10000E+01 volume 0.27228E-02 ppm1 9.218 ppm2 1.974 CV 1
ASSI { 172}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HN ))
2.400 0.700 0.700 peak 172 spectrum 1 weight 0.11000E+01 volume 0.26305E-02 ppm1 7.781 ppm2 8.491 CV 1
ASSI { 174}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 56 and name HB1 ))
3.500 1.500 1.500 peak 174 spectrum 1 weight 0.10000E+01 volume 0.26075E-02 ppm1 8.435 ppm2 1.467 CV 1
ASSI { 175}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HA1 ))
3.000 1.100 1.100 peak 175 spectrum 1 weight 0.11000E+01 volume 0.25844E-02 ppm1 8.642 ppm2 3.921 CV 1
ASSI { 176}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HA2 ))
2.600 0.800 0.800 peak 176 spectrum 1 weight 0.11000E+01 volume 0.25844E-02 ppm1 8.642 ppm2 3.182 CV 1
ASSI { 179}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HB1 ))
3.300 1.400 1.400 peak 179 spectrum 1 weight 0.10000E+01 volume 0.25152E-02 ppm1 7.417 ppm2 1.888 CV 1
ASSI { 180}
(( segid " " and resid 83 and name HN ))
( segid " " and resid 82 and name HG2%)
3.200 1.200 1.200 peak 180 spectrum 1 weight 0.10000E+01 volume 0.24921E-02 ppm1 9.020 ppm2 0.957 CV 1
ASSI { 192}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 50 and name HG1 ))
3.600 3.600 2.400 peak 192 spectrum 1 weight 0.10000E+01 volume 0.23306E-02 ppm1 8.823 ppm2 2.776 CV 1
ASSI { 196}
(( segid " " and resid 58 and name HN ))
( segid " " and resid 58 and name HD% )
3.000 1.100 1.100 peak 196 spectrum 1 weight 0.10000E+01 volume 0.23075E-02 ppm1 8.479 ppm2 6.799 CV 1
ASSI { 197}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 71 and name HB1 ))
3.400 1.400 1.400 peak 197 spectrum 1 weight 0.10000E+01 volume 0.22936E-02 ppm1 9.582 ppm2 1.994 CV 1
ASSI { 203}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HB1 ))
3.500 1.500 1.500 peak 203 spectrum 1 weight 0.10000E+01 volume 0.22175E-02 ppm1 8.917 ppm2 3.089 CV 1
ASSI { 204}
(( segid " " and resid 110 and name HN ))
(( segid " " and resid 110 and name HB2 ))
3.000 1.100 1.100 peak 204 spectrum 1 weight 0.10000E+01 volume 0.22082E-02 ppm1 8.122 ppm2 2.649 CV 1
ASSI { 208}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB ))
3.000 1.100 1.100 peak 208 spectrum 1 weight 0.10000E+01 volume 0.21598E-02 ppm1 8.892 ppm2 2.157 CV 1
ASSI { 209}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HN ))
2.900 1.000 1.000 peak 209 spectrum 1 weight 0.11000E+01 volume 0.21529E-02 ppm1 8.498 ppm2 9.666 CV 1
ASSI { 210}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 42 and name HN ))
2.800 1.000 1.000 peak 210 spectrum 1 weight 0.11000E+01 volume 0.21160E-02 ppm1 8.642 ppm2 7.289 CV 1
ASSI { 211}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 6 and name HG2%)
3.900 1.900 1.900 peak 211 spectrum 1 weight 0.10000E+01 volume 0.21136E-02 ppm1 8.540 ppm2 1.093 CV 1
ASSI { 214}
(( segid " " and resid 103 and name HN ))
(( segid " " and resid 36 and name HZ3 ))
2.400 0.700 0.700 peak 214 spectrum 1 weight 0.10000E+01 volume 0.20975E-02 ppm1 9.218 ppm2 6.757 CV 1
ASSI { 215}
(( segid " " and resid 68 and name HN ))
( segid " " and resid 67 and name HB% )
3.000 1.100 1.100 peak 215 spectrum 1 weight 0.10000E+01 volume 0.20883E-02 ppm1 8.337 ppm2 1.423 CV 1
ASSI { 216}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 31 and name HA ))
2.900 1.000 1.000 peak 216 spectrum 1 weight 0.10000E+01 volume 0.20790E-02 ppm1 7.905 ppm2 4.179 CV 1
ASSI { 217}
(( segid " " and resid 107 and name HN ))
( segid " " and resid 105 and name HG1%)
2.900 1.000 1.000 peak 217 spectrum 1 weight 0.10000E+01 volume 0.20767E-02 ppm1 9.182 ppm2 0.812 CV 1
ASSI { 219}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 65 and name HA ))
3.000 1.200 1.200 peak 219 spectrum 1 weight 0.10000E+01 volume 0.20513E-02 ppm1 7.677 ppm2 4.173 CV 1
ASSI { 221}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 105 and name HG2%)
3.200 1.300 1.300 peak 221 spectrum 1 weight 0.10000E+01 volume 0.20490E-02 ppm1 8.500 ppm2 0.708 CV 1
ASSI { 223}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HB2 ))
3.200 1.300 1.300 peak 223 spectrum 1 weight 0.10000E+01 volume 0.20306E-02 ppm1 8.469 ppm2 1.227 CV 1
ASSI { 226}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HN ))
3.000 1.100 1.100 peak 226 spectrum 1 weight 0.11000E+01 volume 0.19937E-02 ppm1 8.657 ppm2 7.701 CV 1
ASSI { 228}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 81 and name HN ))
2.900 2.900 3.100 peak 228 spectrum 1 weight 0.11000E+01 volume 0.19152E-02 ppm1 9.065 ppm2 8.380 CV 1
ASSI { 232}
(( segid " " and resid 25 and name HE21))
(( segid " " and resid 7 and name HB2 ))
3.600 1.600 1.600 peak 232 spectrum 1 weight 0.10000E+01 volume 0.18160E-02 ppm1 7.237 ppm2 1.769 CV 1
ASSI { 233}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 22 and name HB ))
3.500 1.500 1.500 peak 233 spectrum 1 weight 0.10000E+01 volume 0.17860E-02 ppm1 8.613 ppm2 1.992 CV 1
ASSI { 234}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 56 and name HA ))
2.900 1.100 1.100 peak 234 spectrum 1 weight 0.11000E+01 volume 0.17768E-02 ppm1 8.331 ppm2 4.314 CV 1
ASSI { 236}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HB1 ))
2.800 1.000 1.000 peak 236 spectrum 1 weight 0.10000E+01 volume 0.17468E-02 ppm1 8.413 ppm2 1.602 CV 1
ASSI { 238}
(( segid " " and resid 86 and name HN ))
(( segid " " and resid 86 and name HA ))
2.800 1.000 1.000 peak 238 spectrum 1 weight 0.10000E+01 volume 0.17306E-02 ppm1 8.767 ppm2 5.378 CV 1
ASSI { 240}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 90 and name HB1 ))
3.500 1.500 1.500 peak 240 spectrum 1 weight 0.10000E+01 volume 0.17006E-02 ppm1 8.966 ppm2 1.705 CV 1
ASSI { 241}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HA ))
2.900 1.000 1.000 peak 241 spectrum 1 weight 0.11000E+01 volume 0.16983E-02 ppm1 9.163 ppm2 4.061 CV 1
ASSI { 242}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 52 and name HB ))
3.400 3.400 2.600 peak 242 spectrum 1 weight 0.10000E+01 volume 0.16960E-02 ppm1 7.330 ppm2 4.359 CV 1
ASSI { 244}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HA ))
2.800 1.000 1.000 peak 244 spectrum 1 weight 0.10000E+01 volume 0.16499E-02 ppm1 7.905 ppm2 4.707 CV 1
ASSI { 247}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HB2 ))
3.000 1.200 1.200 peak 247 spectrum 1 weight 0.10000E+01 volume 0.16060E-02 ppm1 8.433 ppm2 2.582 CV 1
ASSI { 249}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 2 and name HA ))
3.600 3.600 2.400 peak 249 spectrum 1 weight 0.10000E+01 volume 0.15876E-02 ppm1 7.879 ppm2 4.611 CV 1
ASSI { 253}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 31 and name HG2%)
3.000 1.100 1.100 peak 253 spectrum 1 weight 0.10000E+01 volume 0.15622E-02 ppm1 7.905 ppm2 1.320 CV 1
ASSI { 254}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 96 and name HG1 ))
3.800 1.800 1.800 peak 254 spectrum 1 weight 0.10000E+01 volume 0.15553E-02 ppm1 8.801 ppm2 1.989 CV 1
ASSI { 258}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 71 and name HA ))
3.400 1.400 1.400 peak 258 spectrum 1 weight 0.10000E+01 volume 0.15391E-02 ppm1 8.389 ppm2 5.044 CV 1
ASSI { 259}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 48 and name HN ))
3.200 1.300 1.300 peak 259 spectrum 1 weight 0.11000E+01 volume 0.15345E-02 ppm1 7.988 ppm2 9.024 CV 1
ASSI { 261}
(( segid " " and resid 57 and name HN ))
(( segid " " and resid 57 and name HA ))
2.800 1.000 1.000 peak 261 spectrum 1 weight 0.10000E+01 volume 0.15229E-02 ppm1 8.434 ppm2 5.021 CV 1
ASSI { 263}
(( segid " " and resid 49 and name HN ))
( segid " " and resid 50 and name HE% )
3.600 3.600 2.400 peak 263 spectrum 1 weight 0.10000E+01 volume 0.15022E-02 ppm1 7.989 ppm2 1.982 CV 1
ASSI { 273}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 71 and name HB1 ))
3.300 1.400 1.400 peak 273 spectrum 1 weight 0.10000E+01 volume 0.14445E-02 ppm1 9.299 ppm2 1.958 CV 1
ASSI { 276}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 95 and name HA1 ))
3.400 1.500 1.500 peak 276 spectrum 1 weight 0.10000E+01 volume 0.14076E-02 ppm1 6.751 ppm2 4.239 CV 1
ASSI { 279}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
2.800 1.000 1.000 peak 279 spectrum 1 weight 0.10000E+01 volume 0.13753E-02 ppm1 9.102 ppm2 2.547 CV 1
ASSI { 280}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 53 and name HG1%)
3.200 1.300 1.300 peak 280 spectrum 1 weight 0.10000E+01 volume 0.13730E-02 ppm1 8.266 ppm2 1.316 CV 1
ASSI { 290}
(( segid " " and resid 86 and name HD22))
( segid " " and resid 84 and name HB% )
3.200 1.200 1.200 peak 290 spectrum 1 weight 0.10000E+01 volume 0.12691E-02 ppm1 6.628 ppm2 1.338 CV 1
ASSI { 292}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 92 and name HB1 ))
3.900 1.900 1.900 peak 292 spectrum 1 weight 0.10000E+01 volume 0.12391E-02 ppm1 6.881 ppm2 1.698 CV 1
ASSI { 294}
(( segid " " and resid 14 and name HN ))
(( segid " " and resid 15 and name HN ))
3.600 1.600 1.600 peak 294 spectrum 1 weight 0.11000E+01 volume 0.12345E-02 ppm1 9.242 ppm2 8.506 CV 1
ASSI { 296}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HB1 ))
3.300 1.300 1.300 peak 296 spectrum 1 weight 0.10000E+01 volume 0.12114E-02 ppm1 8.657 ppm2 1.576 CV 1
ASSI { 297}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 72 and name HD2 ))
3.500 1.500 1.500 peak 297 spectrum 1 weight 0.10000E+01 volume 0.12091E-02 ppm1 8.389 ppm2 6.750 CV 1
ASSI { 298}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 43 and name HB1 ))
3.800 3.800 2.200 peak 298 spectrum 1 weight 0.10000E+01 volume 0.11722E-02 ppm1 8.912 ppm2 2.169 CV 1
ASSI { 299}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HD2 ))
2.800 1.000 1.000 peak 299 spectrum 1 weight 0.10000E+01 volume 0.11699E-02 ppm1 9.304 ppm2 6.744 CV 1
ASSI { 300}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HA ))
3.100 1.200 1.200 peak 300 spectrum 1 weight 0.11000E+01 volume 0.11630E-02 ppm1 8.894 ppm2 5.370 CV 1
ASSI { 302}
(( segid " " and resid 3 and name HN ))
(( segid " " and resid 2 and name HB1 ))
3.200 1.200 1.200 peak 302 spectrum 1 weight 0.10000E+01 volume 0.11561E-02 ppm1 8.604 ppm2 3.727 CV 1
ASSI { 303}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 90 and name HE% )
4.300 2.400 1.700 peak 303 spectrum 1 weight 0.10000E+01 volume 0.11491E-02 ppm1 8.642 ppm2 1.847 CV 1
ASSI { 307}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 73 and name HN ))
3.100 3.100 2.900 peak 307 spectrum 1 weight 0.11000E+01 volume 0.10891E-02 ppm1 9.058 ppm2 9.716 CV 1
ASSI { 309}
(( segid " " and resid 110 and name HD21))
(( segid " " and resid 110 and name HB2 ))
3.300 1.400 1.400 peak 309 spectrum 1 weight 0.11000E+01 volume 0.10776E-02 ppm1 7.516 ppm2 2.632 CV 1
ASSI { 310}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 64 and name HN ))
3.700 3.700 2.300 peak 310 spectrum 1 weight 0.10000E+01 volume 0.10637E-02 ppm1 8.393 ppm2 7.745 CV 1
ASSI { 311}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 10 and name HB2 ))
4.000 4.000 2.000 peak 311 spectrum 1 weight 0.11000E+01 volume 0.10568E-02 ppm1 6.980 ppm2 2.942 CV 1
ASSI { 313}
(( segid " " and resid 86 and name HD22))
(( segid " " and resid 86 and name HB1 ))
3.800 1.800 1.800 peak 313 spectrum 1 weight 0.10000E+01 volume 0.10453E-02 ppm1 6.627 ppm2 2.698 CV 1
ASSI { 314}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 91 and name HB2 ))
2.600 0.800 0.800 peak 314 spectrum 1 weight 0.10000E+01 volume 0.10430E-02 ppm1 7.630 ppm2 0.017 CV 1
ASSI { 317}
(( segid " " and resid 72 and name HN ))
(( segid " " and resid 72 and name HA ))
2.800 1.000 1.000 peak 317 spectrum 1 weight 0.11000E+01 volume 0.10176E-02 ppm1 9.306 ppm2 5.688 CV 1
ASSI { 318}
(( segid " " and resid 36 and name HE1 ))
(( segid " " and resid 27 and name HD1 ))
2.100 2.100 3.900 peak 318 spectrum 1 weight 0.10000E+01 volume 0.10130E-02 ppm1 10.267 ppm2 4.048 CV 1
ASSI { 320}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 5 and name HA ))
4.400 2.400 1.600 peak 320 spectrum 1 weight 0.10000E+01 volume 0.10037E-02 ppm1 8.171 ppm2 4.410 CV 1
ASSI { 322}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.900 1.900 1.900 peak 322 spectrum 1 weight 0.10000E+01 volume 0.99450E-03 ppm1 8.959 ppm2 2.505 CV 1
ASSI { 324}
(( segid " " and resid 71 and name HN ))
(( segid " " and resid 28 and name HB2 ))
3.000 1.100 1.100 peak 324 spectrum 1 weight 0.10000E+01 volume 0.98297E-03 ppm1 9.583 ppm2 3.861 CV 1
ASSI { 325}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 95 and name HA2 ))
4.200 2.300 1.800 peak 325 spectrum 1 weight 0.10000E+01 volume 0.98297E-03 ppm1 7.549 ppm2 3.793 CV 1
ASSI { 331}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 74 and name HD2 ))
3.200 1.300 1.300 peak 331 spectrum 1 weight 0.10000E+01 volume 0.93219E-03 ppm1 9.590 ppm2 6.810 CV 1
ASSI { 334}
(( segid " " and resid 81 and name HN ))
( segid " " and resid 18 and name HG1%)
3.700 1.800 1.800 peak 334 spectrum 1 weight 0.10000E+01 volume 0.91377E-03 ppm1 8.446 ppm2 0.759 CV 1
ASSI { 340}
(( segid " " and resid 87 and name HN ))
( segid " " and resid 85 and name HG1%)
3.800 1.800 1.800 peak 340 spectrum 1 weight 0.10000E+01 volume 0.80070E-03 ppm1 9.336 ppm2 0.603 CV 1
ASSI { 343}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 36 and name HZ3 ))
2.100 2.100 3.900 peak 343 spectrum 1 weight 0.10000E+01 volume 0.76608E-03 ppm1 7.558 ppm2 6.774 CV 1
ASSI { 347}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 105 and name HB ))
4.400 2.400 1.600 peak 347 spectrum 1 weight 0.10000E+01 volume 0.71302E-03 ppm1 10.246 ppm2 1.816 CV 1
ASSI { 350}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 66 and name HN ))
3.700 1.700 1.700 peak 350 spectrum 1 weight 0.10000E+01 volume 0.69225E-03 ppm1 8.056 ppm2 8.693 CV 1
ASSI { 351}
(( segid " " and resid 29 and name HD21))
( segid " " and resid 31 and name HG2%)
3.800 1.800 1.800 peak 351 spectrum 1 weight 0.10000E+01 volume 0.69225E-03 ppm1 7.744 ppm2 1.279 CV 1
ASSI { 352}
(( segid " " and resid 47 and name HN ))
(( segid " " and resid 48 and name HB1 ))
3.900 1.900 1.900 peak 352 spectrum 1 weight 0.10000E+01 volume 0.68533E-03 ppm1 7.562 ppm2 1.910 CV 1
ASSI { 353}
(( segid " " and resid 90 and name HN ))
( segid " " and resid 37 and name HE% )
4.100 2.100 1.900 peak 353 spectrum 1 weight 0.10000E+01 volume 0.68302E-03 ppm1 8.966 ppm2 6.751 CV 1
ASSI { 359}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 71 and name HG2 ))
4.700 2.800 1.300 peak 359 spectrum 1 weight 0.10000E+01 volume 0.65071E-03 ppm1 8.334 ppm2 2.334 CV 1
ASSI { 360}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 45 and name HB1 ))
3.900 3.900 2.100 peak 360 spectrum 1 weight 0.10000E+01 volume 0.64148E-03 ppm1 8.823 ppm2 3.987 CV 1
ASSI { 361}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 35 and name HB% )
4.900 3.000 1.100 peak 361 spectrum 1 weight 0.10000E+01 volume 0.63225E-03 ppm1 8.640 ppm2 1.278 CV 1
ASSI { 362}
(( segid " " and resid 35 and name HN ))
( segid " " and resid 35 and name HB% )
3.600 1.600 1.600 peak 362 spectrum 1 weight 0.10000E+01 volume 0.62764E-03 ppm1 7.858 ppm2 1.260 CV 1
ASSI { 367}
(( segid " " and resid 93 and name HE1 ))
(( segid " " and resid 91 and name HD1 ))
3.500 1.500 1.500 peak 367 spectrum 1 weight 0.10000E+01 volume 0.58610E-03 ppm1 10.250 ppm2 2.589 CV 1
ASSI { 369}
(( segid " " and resid 82 and name HN ))
( segid " " and resid 82 and name HG2%)
4.300 2.300 1.700 peak 369 spectrum 1 weight 0.10000E+01 volume 0.58379E-03 ppm1 8.123 ppm2 0.958 CV 1
ASSI { 371}
(( segid " " and resid 25 and name HE22))
(( segid " " and resid 7 and name HD1 ))
4.700 2.700 1.300 peak 371 spectrum 1 weight 0.10000E+01 volume 0.57456E-03 ppm1 6.641 ppm2 1.686 CV 1
ASSI { 372}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 3 and name HE1 ))
3.900 1.900 1.900 peak 372 spectrum 1 weight 0.10000E+01 volume 0.56534E-03 ppm1 8.941 ppm2 8.296 CV 1
ASSI { 374}
(( segid " " and resid 29 and name HD22))
( segid " " and resid 31 and name HG2%)
4.200 2.200 1.800 peak 374 spectrum 1 weight 0.10000E+01 volume 0.55149E-03 ppm1 6.972 ppm2 1.325 CV 1
ASSI { 376}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 106 and name HB1 ))
4.700 2.700 1.300 peak 376 spectrum 1 weight 0.10000E+01 volume 0.54457E-03 ppm1 8.603 ppm2 3.153 CV 1
ASSI { 378}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HB2 ))
3.500 1.500 1.500 peak 378 spectrum 1 weight 0.10000E+01 volume 0.52610E-03 ppm1 7.549 ppm2 0.738 CV 1
ASSI { 383}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 80 and name HA ))
4.200 2.200 1.800 peak 383 spectrum 1 weight 0.10000E+01 volume 0.50072E-03 ppm1 9.069 ppm2 4.009 CV 1
ASSI { 385}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 83 and name HD2 ))
4.800 2.900 1.200 peak 385 spectrum 1 weight 0.10000E+01 volume 0.48688E-03 ppm1 9.020 ppm2 6.735 CV 1
ASSI { 388}
(( segid " " and resid 9 and name HN ))
(( segid " " and resid 6 and name HN ))
3.800 1.800 1.800 peak 388 spectrum 1 weight 0.11000E+01 volume 0.47534E-03 ppm1 8.172 ppm2 10.245 CV 1
ASSI { 389}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HA2 ))
3.500 1.500 1.500 peak 389 spectrum 1 weight 0.10000E+01 volume 0.47534E-03 ppm1 8.498 ppm2 3.330 CV 1
ASSI { 392}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 58 and name HB2 ))
3.700 1.700 1.700 peak 392 spectrum 1 weight 0.10000E+01 volume 0.45688E-03 ppm1 8.388 ppm2 2.648 CV 1
ASSI { 400}
(( segid " " and resid 97 and name HN ))
(( segid " " and resid 100 and name HN ))
4.000 2.000 2.000 peak 400 spectrum 1 weight 0.10000E+01 volume 0.40612E-03 ppm1 8.802 ppm2 7.559 CV 1
ASSI { 401}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 70 and name HG2%)
4.600 2.600 1.400 peak 401 spectrum 1 weight 0.10000E+01 volume 0.40612E-03 ppm1 8.332 ppm2 1.010 CV 1
ASSI { 407}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 60 and name HG1 ))
3.900 1.900 1.900 peak 407 spectrum 1 weight 0.10000E+01 volume 0.38304E-03 ppm1 8.337 ppm2 1.993 CV 1
ASSI { 409}
(( segid " " and resid 110 and name HD22))
(( segid " " and resid 108 and name HG1 ))
4.600 2.700 1.400 peak 409 spectrum 1 weight 0.10000E+01 volume 0.38073E-03 ppm1 6.667 ppm2 1.225 CV 1
ASSI { 410}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 29 and name HA ))
2.400 2.400 3.600 peak 410 spectrum 1 weight 0.10000E+01 volume 0.37612E-03 ppm1 8.222 ppm2 5.571 CV 1
ASSI { 412}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 60 and name HG1 ))
3.700 1.700 1.700 peak 412 spectrum 1 weight 0.10000E+01 volume 0.37381E-03 ppm1 8.218 ppm2 1.969 CV 1
ASSI { 414}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 59 and name HD1 ))
4.100 2.100 1.900 peak 414 spectrum 1 weight 0.10000E+01 volume 0.36689E-03 ppm1 8.487 ppm2 3.686 CV 1
ASSI { 415}
(( segid " " and resid 91 and name HN ))
(( segid " " and resid 99 and name HB2 ))
4.400 2.400 1.600 peak 415 spectrum 1 weight 0.10000E+01 volume 0.36459E-03 ppm1 7.628 ppm2 2.549 CV 1
ASSI { 431}
(( segid " " and resid 75 and name HN ))
(( segid " " and resid 77 and name HN ))
4.500 2.600 1.500 peak 431 spectrum 1 weight 0.10000E+01 volume 0.30690E-03 ppm1 9.783 ppm2 8.669 CV 1
ASSI { 432}
(( segid " " and resid 101 and name HN ))
(( segid " " and resid 89 and name HB2 ))
5.300 3.500 0.700 peak 432 spectrum 1 weight 0.11000E+01 volume 0.30228E-03 ppm1 8.669 ppm2 0.044 CV 1
ASSI { 433}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 27 and name HD1 ))
5.000 3.200 1.000 peak 433 spectrum 1 weight 0.10000E+01 volume 0.30228E-03 ppm1 8.206 ppm2 4.004 CV 1
ASSI { 437}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 14 and name HN ))
4.400 4.400 1.600 peak 437 spectrum 1 weight 0.11000E+01 volume 0.29074E-03 ppm1 8.266 ppm2 9.327 CV 1
ASSI { 440}
(( segid " " and resid 25 and name HE21))
(( segid " " and resid 26 and name HA ))
3.500 1.500 1.500 peak 440 spectrum 1 weight 0.10000E+01 volume 0.28152E-03 ppm1 7.238 ppm2 4.753 CV 1
ASSI { 441}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 51 and name HD% )
4.700 2.800 1.300 peak 441 spectrum 1 weight 0.10000E+01 volume 0.28152E-03 ppm1 8.825 ppm2 6.652 CV 1
ASSI { 443}
(( segid " " and resid 90 and name HN ))
(( segid " " and resid 89 and name HB2 ))
5.200 3.300 0.800 peak 443 spectrum 1 weight 0.11000E+01 volume 0.27921E-03 ppm1 8.962 ppm2 0.020 CV 1
ASSI { 445}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 77 and name HN ))
4.500 2.500 1.500 peak 445 spectrum 1 weight 0.10000E+01 volume 0.27228E-03 ppm1 9.385 ppm2 8.639 CV 1
ASSI { 449}
(( segid " " and resid 7 and name HN ))
(( segid " " and resid 8 and name HN ))
4.100 2.100 1.900 peak 449 spectrum 1 weight 0.10000E+01 volume 0.26536E-03 ppm1 8.863 ppm2 7.880 CV 1
ASSI { 450}
(( segid " " and resid 11 and name HN ))
( segid " " and resid 5 and name HG2%)
5.300 3.500 0.700 peak 450 spectrum 1 weight 0.10000E+01 volume 0.25844E-03 ppm1 9.672 ppm2 0.573 CV 1
ASSI { 452}
(( segid " " and resid 79 and name HN ))
(( segid " " and resid 77 and name HA ))
2.600 2.600 3.400 peak 452 spectrum 1 weight 0.10000E+01 volume 0.25613E-03 ppm1 7.316 ppm2 3.817 CV 1
ASSI { 459}
(( segid " " and resid 110 and name HN ))
( segid " " and resid 22 and name HG2%)
2.600 2.600 3.400 peak 459 spectrum 1 weight 0.10000E+01 volume 0.23028E-03 ppm1 8.122 ppm2 0.652 CV 1
ASSI { 460}
(( segid " " and resid 36 and name HE1 ))
(( segid " " and resid 27 and name HG2 ))
4.600 2.700 1.400 peak 460 spectrum 1 weight 0.10000E+01 volume 0.21482E-03 ppm1 10.265 ppm2 2.048 CV 1
ASSI { 461}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 1 and name HB1 ))
4.200 2.200 1.800 peak 461 spectrum 1 weight 0.10000E+01 volume 0.21414E-03 ppm1 8.715 ppm2 3.713 CV 1
ASSI { 463}
(( segid " " and resid 87 and name HN ))
(( segid " " and resid 36 and name HZ3 ))
5.400 3.700 0.600 peak 463 spectrum 1 weight 0.10000E+01 volume 0.20952E-03 ppm1 9.336 ppm2 6.788 CV 1
ASSI { 464}
(( segid " " and resid 109 and name HN ))
(( segid " " and resid 83 and name HD2 ))
5.000 3.100 1.000 peak 464 spectrum 1 weight 0.10000E+01 volume 0.20421E-03 ppm1 9.063 ppm2 6.717 CV 1
ASSI { 468}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 102 and name HD1 ))
5.400 3.600 0.600 peak 468 spectrum 1 weight 0.10000E+01 volume 0.20029E-03 ppm1 8.491 ppm2 3.133 CV 1
ASSI { 470}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 61 and name HB1 ))
4.300 2.300 1.700 peak 470 spectrum 1 weight 0.10000E+01 volume 0.19868E-03 ppm1 7.780 ppm2 2.651 CV 1
ASSI { 473}
(( segid " " and resid 6 and name HN ))
(( segid " " and resid 5 and name HN ))
4.500 2.600 1.500 peak 473 spectrum 1 weight 0.11000E+01 volume 0.19591E-03 ppm1 10.242 ppm2 8.911 CV 1
ASSI { 479}
(( segid " " and resid 88 and name HN ))
(( segid " " and resid 37 and name HB2 ))
4.600 2.700 1.400 peak 479 spectrum 1 weight 0.10000E+01 volume 0.18391E-03 ppm1 9.395 ppm2 2.534 CV 1
ASSI { 482}
(( segid " " and resid 100 and name HN ))
( segid " " and resid 88 and name HG2%)
5.500 3.800 0.500 peak 482 spectrum 1 weight 0.10000E+01 volume 0.18114E-03 ppm1 7.540 ppm2 1.096 CV 1
ASSI { 486}
(( segid " " and resid 8 and name HN ))
(( segid " " and resid 9 and name HB2 ))
5.000 3.200 1.000 peak 486 spectrum 1 weight 0.10000E+01 volume 0.17837E-03 ppm1 7.872 ppm2 3.315 CV 1
ASSI { 489}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 4 and name HA ))
4.300 2.300 1.700 peak 489 spectrum 1 weight 0.10000E+01 volume 0.17445E-03 ppm1 8.712 ppm2 4.852 CV 1
ASSI { 490}
(( segid " " and resid 55 and name HN ))
(( segid " " and resid 55 and name HD21))
4.400 2.400 1.600 peak 490 spectrum 1 weight 0.10000E+01 volume 0.17398E-03 ppm1 9.064 ppm2 7.499 CV 1
ASSI { 491}
(( segid " " and resid 86 and name HN ))
( segid " " and resid 84 and name HB% )
5.200 3.400 0.800 peak 491 spectrum 1 weight 0.10000E+01 volume 0.16868E-03 ppm1 8.764 ppm2 1.369 CV 1
ASSI { 492}
(( segid " " and resid 83 and name HN ))
(( segid " " and resid 82 and name HB ))
4.800 2.900 1.200 peak 492 spectrum 1 weight 0.10000E+01 volume 0.16798E-03 ppm1 9.013 ppm2 3.849 CV 1
ASSI { 494}
(( segid " " and resid 102 and name HN ))
(( segid " " and resid 36 and name HH2 ))
4.600 2.700 1.400 peak 494 spectrum 1 weight 0.10000E+01 volume 0.16314E-03 ppm1 8.487 ppm2 6.792 CV 1
ASSI { 496}
(( segid " " and resid 76 and name HN ))
(( segid " " and resid 22 and name HB ))
4.400 2.400 1.600 peak 496 spectrum 1 weight 0.10000E+01 volume 0.15829E-03 ppm1 8.711 ppm2 1.960 CV 1
ASSI { 497}
(( segid " " and resid 31 and name HN ))
( segid " " and resid 89 and name HD% )
5.200 3.300 0.800 peak 497 spectrum 1 weight 0.10000E+01 volume 0.15252E-03 ppm1 7.904 ppm2 5.557 CV 1
ASSI { 500}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HG12))
4.600 2.700 1.400 peak 500 spectrum 1 weight 0.10000E+01 volume 0.14537E-03 ppm1 9.056 ppm2 0.611 CV 1
OR { 500}
(( segid " " and resid 24 and name HN ))
( segid " " and resid 24 and name HD1%)
ASSI { 507}
(( segid " " and resid 90 and name HN ))
( segid " " and resid 89 and name HD% )
5.500 3.800 0.500 peak 507 spectrum 1 weight 0.10000E+01 volume 0.13545E-03 ppm1 8.970 ppm2 5.566 CV 1
ASSI { 509}
(( segid " " and resid 25 and name HE22))
(( segid " " and resid 26 and name HA ))
5.200 3.400 0.800 peak 509 spectrum 1 weight 0.10000E+01 volume 0.13360E-03 ppm1 6.642 ppm2 4.743 CV 1
ASSI { 512}
(( segid " " and resid 53 and name HN ))
( segid " " and resid 75 and name HG2%)
5.400 3.600 0.600 peak 512 spectrum 1 weight 0.10000E+01 volume 0.12876E-03 ppm1 8.896 ppm2 0.617 CV 1
ASSI { 514}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HA1 ))
4.900 4.900 1.100 peak 514 spectrum 1 weight 0.11000E+01 volume 0.12622E-03 ppm1 7.291 ppm2 3.859 CV 1
ASSI { 515}
(( segid " " and resid 58 and name HN ))
(( segid " " and resid 71 and name HB1 ))
5.700 4.100 0.300 peak 515 spectrum 1 weight 0.10000E+01 volume 0.12507E-03 ppm1 8.489 ppm2 1.952 CV 1
ASSI { 518}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 28 and name HB1 ))
5.500 3.800 0.500 peak 518 spectrum 1 weight 0.10000E+01 volume 0.11815E-03 ppm1 6.976 ppm2 4.119 CV 1
ASSI { 519}
(( segid " " and resid 93 and name HE1 ))
(( segid " " and resid 91 and name HB2 ))
5.900 4.400 0.100 peak 519 spectrum 1 weight 0.10000E+01 volume 0.11699E-03 ppm1 10.252 ppm2 0.048 CV 1
ASSI { 520}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 10 and name HN ))
5.400 3.700 0.600 peak 520 spectrum 1 weight 0.10000E+01 volume 0.11422E-03 ppm1 8.499 ppm2 7.290 CV 1
ASSI { 522}
(( segid " " and resid 101 and name HN ))
( segid " " and resid 89 and name HD% )
4.800 2.900 1.200 peak 522 spectrum 1 weight 0.10000E+01 volume 0.11307E-03 ppm1 8.670 ppm2 5.560 CV 1
ASSI { 523}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 31 and name HG2%)
5.400 3.600 0.600 peak 523 spectrum 1 weight 0.10000E+01 volume 0.10891E-03 ppm1 8.207 ppm2 1.316 CV 1
ASSI { 525}
(( segid " " and resid 29 and name HD21))
(( segid " " and resid 28 and name HB1 ))
5.400 3.600 0.600 peak 525 spectrum 1 weight 0.10000E+01 volume 0.10615E-03 ppm1 7.744 ppm2 4.082 CV 1
ASSI { 526}
(( segid " " and resid 110 and name HN ))
(( segid " " and resid 22 and name HB ))
3.000 3.000 3.000 peak 526 spectrum 1 weight 0.10000E+01 volume 0.10591E-03 ppm1 8.125 ppm2 1.938 CV 1
ASSI { 531}
(( segid " " and resid 95 and name HN ))
(( segid " " and resid 90 and name HB1 ))
6.000 4.700 0.000 peak 531 spectrum 1 weight 0.10000E+01 volume 0.89991E-04 ppm1 7.584 ppm2 1.754 CV 1
ASSI { 534}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HN ))
5.600 3.900 0.400 peak 534 spectrum 1 weight 0.11000E+01 volume 0.84454E-04 ppm1 7.419 ppm2 8.795 CV 1
ASSI { 535}
(( segid " " and resid 56 and name HN ))
(( segid " " and resid 74 and name HD2 ))
5.700 4.100 0.300 peak 535 spectrum 1 weight 0.10000E+01 volume 0.81915E-04 ppm1 8.329 ppm2 6.787 CV 1
ASSI { 538}
(( segid " " and resid 73 and name HN ))
( segid " " and resid 85 and name HG1%)
6.000 4.700 0.000 peak 538 spectrum 1 weight 0.10000E+01 volume 0.68533E-04 ppm1 9.603 ppm2 0.559 CV 1
ASSI { 540}
(( segid " " and resid 93 and name HE1 ))
( segid " " and resid 94 and name HG2%)
5.200 3.400 0.800 peak 540 spectrum 1 weight 0.10000E+01 volume 0.65071E-04 ppm1 10.252 ppm2 0.828 CV 1
ASSI { 543}
(( segid " " and resid 10 and name HN ))
( segid " " and resid 5 and name HG1%)
6.000 4.700 0.000 peak 543 spectrum 1 weight 0.10000E+01 volume 0.61379E-04 ppm1 7.255 ppm2 0.839 CV 1
ASSI { 545}
(( segid " " and resid 47 and name HD21))
(( segid " " and resid 110 and name HA ))
5.600 3.900 0.400 peak 545 spectrum 1 weight 0.10000E+01 volume 0.55149E-04 ppm1 7.633 ppm2 4.525 CV 1
ASSI { 546}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 48 and name HN ))
6.000 6.000 0.000 peak 546 spectrum 1 weight 0.11000E+01 volume 0.54226E-04 ppm1 7.336 ppm2 8.925 CV 1
ASSI { 547}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 90 and name HG2 ))
6.000 5.600 0.000 peak 547 spectrum 1 weight 0.10000E+01 volume 0.48457E-04 ppm1 9.107 ppm2 1.765 CV 1
ASSI { 548}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 30 and name HG2 ))
5.500 3.800 0.500 peak 548 spectrum 1 weight 0.10000E+01 volume 0.48227E-04 ppm1 8.220 ppm2 1.281 CV 1
ASSI { 551}
(( segid " " and resid 66 and name HN ))
( segid " " and resid 65 and name HD1%)
5.700 4.100 0.300 peak 551 spectrum 1 weight 0.10000E+01 volume 0.37151E-04 ppm1 8.656 ppm2 0.876 CV 1
ASSI { 553}
(( segid " " and resid 94 and name HN ))
(( segid " " and resid 90 and name HB1 ))
6.000 4.600 0.000 peak 553 spectrum 1 weight 0.10000E+01 volume 0.35535E-04 ppm1 6.750 ppm2 1.710 CV 1
ASSI { 554}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 59 and name HG1 ))
6.000 4.700 0.000 peak 554 spectrum 1 weight 0.10000E+01 volume 0.32074E-04 ppm1 8.384 ppm2 2.040 CV 1
ASSI { 557}
(( segid " " and resid 93 and name HN ))
(( segid " " and resid 91 and name HB1 ))
5.700 4.100 0.300 peak 557 spectrum 1 weight 0.10000E+01 volume 0.18713E-04 ppm1 6.880 ppm2 0.742 CV 1
ASSI { 558}
(( segid " " and resid 2 and name HN ))
(( segid " " and resid 21 and name HB1 ))
6.000 5.300 0.000 peak 558 spectrum 1 weight 0.10000E+01 volume 0.14029E-04 ppm1 8.337 ppm2 1.586 CV 1
!ambiguous restraints
ASSI { 2}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 85 and name HN ))
5.700 4.100 0.300 peak 2 spectrum 1 weight 0.10000E+01 volume 0.41505E-04 ppm1 0.822 ppm2 8.613 CV 1
OR { 2}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 106 and name HN ))
ASSI { 14}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 24 and name HN ))
6.000 5.300 0.000 peak 14 spectrum 1 weight 0.10000E+01 volume 0.45787E-04 ppm1 0.660 ppm2 9.085 CV 1
OR { 14}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 109 and name HN ))
ASSI { 16}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 87 and name HN ))
4.700 2.800 1.300 peak 16 spectrum 1 weight 0.10000E+01 volume 0.96662E-04 ppm1 0.652 ppm2 9.342 CV 1
OR { 16}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 22 and name HN ))
ASSI { 77}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 24 and name HN ))
2.600 0.800 0.800 peak 77 spectrum 1 weight 0.10000E+01 volume 0.26497E-02 ppm1 1.777 ppm2 9.082 CV 1
OR { 77}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 24 and name HN ))
ASSI { 90}
(( segid " " and resid 14 and name HG ))
(( segid " " and resid 14 and name HN ))
4.600 2.600 1.400 peak 90 spectrum 1 weight 0.10000E+01 volume 0.23402E-03 ppm1 1.350 ppm2 9.208 CV 1
OR { 90}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 107 and name HN ))
ASSI { 93}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 16 and name HN ))
5.200 3.300 0.800 peak 93 spectrum 1 weight 0.10000E+01 volume 0.18781E-03 ppm1 1.323 ppm2 8.660 CV 1
OR { 93}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 106 and name HN ))
ASSI { 106}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 107 and name HN ))
6.000 4.500 0.000 peak 106 spectrum 1 weight 0.10000E+01 volume 0.65289E-04 ppm1 3.147 ppm2 9.206 CV 1
OR { 106}
(( segid " " and resid 106 and name HB1 ))
(( segid " " and resid 14 and name HN ))
ASSI { 115}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 90 and name HA ))
4.400 2.400 1.600 peak 115 spectrum 1 weight 0.10000E+01 volume 0.30228E-03 ppm1 4.303 ppm2 4.644 CV 1
OR { 115}
(( segid " " and resid 40 and name HA1 ))
(( segid " " and resid 90 and name HA ))
ASSI { 116}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 90 and name HA ))
4.800 2.800 1.200 peak 116 spectrum 1 weight 0.10000E+01 volume 0.18357E-03 ppm1 4.411 ppm2 4.642 CV 1
OR { 116}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 3 and name HA ))
ASSI { 135}
(( segid " " and resid 107 and name HA ))
(( segid " " and resid 108 and name HN ))
2.200 0.600 0.600 peak 135 spectrum 1 weight 0.10000E+01 volume 0.55962E-02 ppm1 4.958 ppm2 9.158 CV 1
OR { 135}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 108 and name HN ))
ASSI { 140}
( segid " " and resid 26 and name HD2%)
( segid " " and resid 85 and name HG1%)
4.900 3.000 1.100 peak 140 spectrum 1 weight 0.10000E+01 volume 0.27726E-03 ppm1 -1.276 ppm2 0.597 CV 1
OR { 140}
( segid " " and resid 26 and name HD2%)
( segid " " and resid 24 and name HD1%)
ASSI { 147}
( segid " " and resid 26 and name HD1%)
( segid " " and resid 24 and name HD1%)
5.000 3.100 1.000 peak 147 spectrum 1 weight 0.10000E+01 volume 0.24802E-03 ppm1 -0.654 ppm2 0.601 CV 1
OR { 147}
( segid " " and resid 26 and name HD1%)
( segid " " and resid 85 and name HG1%)
ASSI { 171}
( segid " " and resid 73 and name HD% )
(( segid " " and resid 24 and name HN ))
4.300 2.300 1.700 peak 171 spectrum 1 weight 0.10000E+01 volume 0.37308E-03 ppm1 6.885 ppm2 9.090 CV 1
OR { 171}
( segid " " and resid 73 and name HD% )
(( segid " " and resid 37 and name HN ))
ASSI { 195}
(( segid " " and resid 74 and name HD2 ))
(( segid " " and resid 74 and name HE1 ))
4.000 2.000 2.000 peak 195 spectrum 1 weight 0.10000E+01 volume 0.66561E-03 ppm1 6.734 ppm2 7.791 CV 1
OR { 195}
(( segid " " and resid 83 and name HD2 ))
(( segid " " and resid 83 and name HE1 ))
ASSI { 236}
(( segid " " and resid 45 and name HB1 ))
(( segid " " and resid 83 and name HD2 ))
5.300 3.500 0.700 peak 236 spectrum 1 weight 0.10000E+01 volume 0.13651E-03 ppm1 3.997 ppm2 6.730 CV 1
OR { 236}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 36 and name HH2 ))
OR { 236}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 36 and name HZ3 ))
ASSI { 243}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 103 and name HE% )
2.800 2.800 3.200 peak 243 spectrum 1 weight 0.10000E+01 volume 0.31415E-02 ppm1 3.914 ppm2 6.921 CV 1
OR { 243}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 36 and name HZ2 ))
ASSI { 252}
(( segid " " and resid 77 and name HA ))
( segid " " and resid 51 and name HE% )
4.800 2.900 1.200 peak 252 spectrum 1 weight 0.10000E+01 volume 0.34765E-03 ppm1 3.829 ppm2 7.109 CV 1
OR { 252}
(( segid " " and resid 34 and name HA ))
( segid " " and resid 34 and name HE% )
ASSI { 287}
(( segid " " and resid 11 and name HA2 ))
( segid " " and resid 106 and name HD% )
3.500 1.500 1.500 peak 287 spectrum 1 weight 0.10000E+01 volume 0.12253E-02 ppm1 3.349 ppm2 6.693 CV 1
OR { 287}
(( segid " " and resid 27 and name HD2 ))
( segid " " and resid 103 and name HD% )
ASSI { 312}
(( segid " " and resid 38 and name HB2 ))
( segid " " and resid 38 and name HE% )
3.800 1.800 1.800 peak 312 spectrum 1 weight 0.10000E+01 volume 0.98779E-03 ppm1 3.119 ppm2 6.891 CV 1
OR { 312}
(( segid " " and resid 57 and name HB1 ))
( segid " " and resid 57 and name HE% )
ASSI { 314}
(( segid " " and resid 36 and name HB1 ))
( segid " " and resid 73 and name HD% )
2.900 2.900 3.100 peak 314 spectrum 1 weight 0.10000E+01 volume 0.30567E-02 ppm1 3.095 ppm2 6.842 CV 1
OR { 314}
(( segid " " and resid 57 and name HB1 ))
( segid " " and resid 58 and name HD% )
ASSI { 331}
(( segid " " and resid 55 and name HA ))
(( segid " " and resid 74 and name HD2 ))
3.900 1.900 1.900 peak 331 spectrum 1 weight 0.10000E+01 volume 0.77160E-03 ppm1 5.575 ppm2 6.721 CV 1
OR { 331}
( segid " " and resid 89 and name HD% )
(( segid " " and resid 36 and name HZ3 ))
ASSI { 341}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 74 and name HD2 ))
3.200 1.300 1.300 peak 341 spectrum 1 weight 0.10000E+01 volume 0.11192E-02 ppm1 5.328 ppm2 6.696 CV 1
OR { 341}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 106 and name HD% )
ASSI { 347}
(( segid " " and resid 51 and name HA ))
( segid " " and resid 51 and name HD% )
2.600 0.800 0.800 peak 347 spectrum 1 weight 0.10000E+01 volume 0.35061E-02 ppm1 5.096 ppm2 6.695 CV 1
OR { 347}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 72 and name HD2 ))
ASSI { 350}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 36 and name HD1 ))
5.100 3.300 0.900 peak 350 spectrum 1 weight 0.10000E+01 volume 0.29677E-03 ppm1 5.075 ppm2 7.416 CV 1
OR { 350}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 36 and name HD1 ))
ASSI { 355}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 83 and name HE1 ))
4.900 3.000 1.100 peak 355 spectrum 1 weight 0.10000E+01 volume 0.29762E-03 ppm1 4.910 ppm2 7.791 CV 1
OR { 355}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 74 and name HE1 ))
ASSI { 358}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 74 and name HD2 ))
3.200 1.300 1.300 peak 358 spectrum 1 weight 0.10000E+01 volume 0.28405E-02 ppm1 4.902 ppm2 6.733 CV 1
OR { 358}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 74 and name HD2 ))
ASSI { 360}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 38 and name HZ ))
3.600 1.700 1.700 peak 360 spectrum 1 weight 0.10000E+01 volume 0.14584E-02 ppm1 4.889 ppm2 7.276 CV 1
OR { 360}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HZ ))
ASSI { 362}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 38 and name HE% )
3.400 1.500 1.500 peak 362 spectrum 1 weight 0.10000E+01 volume 0.16364E-02 ppm1 4.890 ppm2 6.890 CV 1
OR { 362}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 73 and name HD% )
OR { 362}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 38 and name HE% )
OR { 362}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 73 and name HD% )
ASSI { 363}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 73 and name HD% )
4.300 2.300 1.700 peak 363 spectrum 1 weight 0.10000E+01 volume 0.50027E-03 ppm1 4.892 ppm2 6.839 CV 1
OR { 363}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 73 and name HD% )
ASSI { 366}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 51 and name HD% )
3.800 1.800 1.800 peak 366 spectrum 1 weight 0.10000E+01 volume 0.75464E-03 ppm1 4.888 ppm2 6.661 CV 1
OR { 366}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 72 and name HD2 ))
ASSI { 367}
(( segid " " and resid 52 and name HA ))
( segid " " and resid 51 and name HD% )
6.000 5.700 0.000 peak 367 spectrum 1 weight 0.10000E+01 volume 0.31458E-04 ppm1 4.813 ppm2 6.655 CV 1
OR { 367}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 72 and name HD2 ))
ASSI { 390}
(( segid " " and resid 100 and name HA ))
( segid " " and resid 34 and name HE% )
4.000 2.000 2.000 peak 390 spectrum 1 weight 0.10000E+01 volume 0.35612E-03 ppm1 4.488 ppm2 7.110 CV 1
OR { 390}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 51 and name HE% )
ASSI { 391}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 83 and name HE1 ))
3.700 1.700 1.700 peak 391 spectrum 1 weight 0.10000E+01 volume 0.13905E-02 ppm1 4.462 ppm2 7.791 CV 1
OR { 391}
(( segid " " and resid 84 and name HA ))
(( segid " " and resid 105 and name HN ))
ASSI { 392}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 51 and name HD% )
4.100 2.100 1.900 peak 392 spectrum 1 weight 0.10000E+01 volume 0.52147E-03 ppm1 4.455 ppm2 6.651 CV 1
OR { 392}
(( segid " " and resid 78 and name HA ))
( segid " " and resid 51 and name HD% )
ASSI { 398}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 3 and name HD2 ))
3.800 1.800 1.800 peak 398 spectrum 1 weight 0.10000E+01 volume 0.88183E-03 ppm1 4.413 ppm2 6.893 CV 1
OR { 398}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 103 and name HE% )
ASSI { 400}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 106 and name HD% )
5.000 3.200 1.000 peak 400 spectrum 1 weight 0.10000E+01 volume 0.16576E-03 ppm1 4.413 ppm2 6.719 CV 1
OR { 400}
(( segid " " and resid 9 and name HA ))
( segid " " and resid 103 and name HD% )
OR { 400}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 37 and name HE% )
ASSI { 421}
(( segid " " and resid 56 and name HE1 ))
(( segid " " and resid 74 and name HE1 ))
5.000 3.100 1.000 peak 421 spectrum 1 weight 0.10000E+01 volume 0.15559E-03 ppm1 2.643 ppm2 7.791 CV 1
OR { 421}
(( segid " " and resid 72 and name HB2 ))
(( segid " " and resid 74 and name HE1 ))
ASSI { 433}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 37 and name HD% )
2.100 0.500 0.500 peak 433 spectrum 1 weight 0.10000E+01 volume 0.10175E-01 ppm1 2.546 ppm2 6.841 CV 1
OR { 433}
(( segid " " and resid 73 and name HB2 ))
( segid " " and resid 73 and name HD% )
ASSI { 443}
(( segid " " and resid 71 and name HG2 ))
( segid " " and resid 58 and name HD% )
3.200 3.200 2.800 peak 443 spectrum 1 weight 0.10000E+01 volume 0.24335E-02 ppm1 2.317 ppm2 6.843 CV 1
OR { 443}
(( segid " " and resid 34 and name HB1 ))
( segid " " and resid 37 and name HD% )
ASSI { 444}
(( segid " " and resid 54 and name HG1 ))
(( segid " " and resid 74 and name HD2 ))
3.700 1.700 1.700 peak 444 spectrum 1 weight 0.10000E+01 volume 0.94544E-03 ppm1 2.318 ppm2 6.714 CV 1
OR { 444}
(( segid " " and resid 34 and name HB1 ))
( segid " " and resid 37 and name HE% )
ASSI { 457}
(( segid " " and resid 55 and name HB2 ))
( segid " " and resid 57 and name HE% )
3.200 1.300 1.300 peak 457 spectrum 1 weight 0.10000E+01 volume 0.17086E-02 ppm1 2.168 ppm2 6.891 CV 1
OR { 457}
(( segid " " and resid 43 and name HB1 ))
( segid " " and resid 73 and name HD% )
ASSI { 469}
( segid " " and resid 50 and name HE% )
( segid " " and resid 51 and name HD% )
4.000 2.000 2.000 peak 469 spectrum 1 weight 0.10000E+01 volume 0.55114E-03 ppm1 2.017 ppm2 6.656 CV 1
OR { 469}
(( segid " " and resid 77 and name HB ))
( segid " " and resid 51 and name HD% )
ASSI { 472}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 83 and name HD2 ))
4.800 2.900 1.200 peak 472 spectrum 1 weight 0.10000E+01 volume 0.26242E-03 ppm1 1.997 ppm2 6.755 CV 1
OR { 472}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 36 and name HZ3 ))
ASSI { 476}
(( segid " " and resid 43 and name HB2 ))
( segid " " and resid 73 and name HD% )
3.800 1.800 1.800 peak 476 spectrum 1 weight 0.10000E+01 volume 0.45787E-03 ppm1 1.888 ppm2 6.891 CV 1
OR { 476}
(( segid " " and resid 43 and name HB2 ))
( segid " " and resid 38 and name HE% )
ASSI { 483}
(( segid " " and resid 50 and name HB1 ))
( segid " " and resid 51 and name HD% )
3.400 1.500 1.500 peak 483 spectrum 1 weight 0.10000E+01 volume 0.20265E-02 ppm1 1.876 ppm2 6.656 CV 1
OR { 483}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 72 and name HD2 ))
ASSI { 499}
(( segid " " and resid 92 and name HB1 ))
( segid " " and resid 37 and name HE% )
2.800 1.000 1.000 peak 499 spectrum 1 weight 0.10000E+01 volume 0.50027E-02 ppm1 1.697 ppm2 6.756 CV 1
OR { 499}
(( segid " " and resid 102 and name HG1 ))
(( segid " " and resid 36 and name HZ3 ))
ASSI { 500}
(( segid " " and resid 102 and name HG1 ))
(( segid " " and resid 36 and name HE3 ))
4.800 2.900 1.200 peak 500 spectrum 1 weight 0.10000E+01 volume 0.22893E-03 ppm1 1.694 ppm2 7.093 CV 1
OR { 500}
(( segid " " and resid 90 and name HB1 ))
( segid " " and resid 34 and name HE% )
ASSI { 505}
(( segid " " and resid 43 and name HD1 ))
( segid " " and resid 73 and name HD% )
3.900 1.900 1.900 peak 505 spectrum 1 weight 0.10000E+01 volume 0.75888E-03 ppm1 1.662 ppm2 6.891 CV 1
OR { 505}
(( segid " " and resid 7 and name HD1 ))
( segid " " and resid 103 and name HE% )
OR { 505}
(( segid " " and resid 43 and name HD1 ))
( segid " " and resid 38 and name HE% )
ASSI { 510}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 83 and name HE1 ))
3.400 1.500 1.500 peak 510 spectrum 1 weight 0.10000E+01 volume 0.19417E-02 ppm1 1.572 ppm2 7.791 CV 1
OR { 510}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 105 and name HN ))
ASSI { 513}
(( segid " " and resid 78 and name HD1 ))
( segid " " and resid 51 and name HD% )
4.000 2.000 2.000 peak 513 spectrum 1 weight 0.10000E+01 volume 0.47483E-03 ppm1 1.560 ppm2 6.686 CV 1
OR { 513}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 74 and name HD2 ))
ASSI { 519}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 36 and name HZ3 ))
4.400 2.400 1.600 peak 519 spectrum 1 weight 0.10000E+01 volume 0.52570E-03 ppm1 1.521 ppm2 6.733 CV 1
OR { 519}
( segid " " and resid 12 and name HB% )
( segid " " and resid 106 and name HD% )
ASSI { 521}
(( segid " " and resid 87 and name HB1 ))
( segid " " and resid 103 and name HD% )
4.500 2.600 1.500 peak 521 spectrum 1 weight 0.10000E+01 volume 0.32433E-03 ppm1 1.490 ppm2 6.693 CV 1
OR { 521}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 74 and name HD2 ))
ASSI { 534}
( segid " " and resid 53 and name HG1%)
( segid " " and resid 38 and name HE% )
2.700 2.700 3.300 peak 534 spectrum 1 weight 0.10000E+01 volume 0.50451E-02 ppm1 1.376 ppm2 6.890 CV 1
OR { 534}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 73 and name HD% )
ASSI { 535}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 83 and name HE1 ))
5.100 3.300 0.900 peak 535 spectrum 1 weight 0.10000E+01 volume 0.17976E-03 ppm1 1.355 ppm2 7.825 CV 1
OR { 535}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 105 and name HN ))
ASSI { 541}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 74 and name HE1 ))
5.300 3.600 0.700 peak 541 spectrum 1 weight 0.10000E+01 volume 0.13270E-03 ppm1 1.321 ppm2 7.790 CV 1
OR { 541}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 83 and name HE1 ))
ASSI { 573}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 83 and name HE1 ))
4.700 2.800 1.300 peak 573 spectrum 1 weight 0.10000E+01 volume 0.27091E-03 ppm1 0.947 ppm2 7.791 CV 1
OR { 573}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 74 and name HE1 ))
ASSI { 574}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 83 and name HD2 ))
2.900 1.000 1.000 peak 574 spectrum 1 weight 0.10000E+01 volume 0.30822E-02 ppm1 0.947 ppm2 6.733 CV 1
OR { 574}
( segid " " and resid 13 and name HG2%)
( segid " " and resid 106 and name HD% )
ASSI { 589}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 93 and name HZ2 ))
3.000 3.000 3.000 peak 589 spectrum 1 weight 0.10000E+01 volume 0.18230E-03 ppm1 0.820 ppm2 7.391 CV 1
OR { 589}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 72 and name HE1 ))
ASSI { 594}
(( segid " " and resid 91 and name HB1 ))
( segid " " and resid 34 and name HE% )
4.400 2.500 1.600 peak 594 spectrum 1 weight 0.10000E+01 volume 0.48755E-03 ppm1 0.741 ppm2 7.111 CV 1
OR { 594}
(( segid " " and resid 34 and name HB2 ))
( segid " " and resid 34 and name HE% )
ASSI { 596}
(( segid " " and resid 34 and name HB2 ))
( segid " " and resid 34 and name HD% )
1.500 1.500 4.500 peak 596 spectrum 1 weight 0.10000E+01 volume 0.78432E-01 ppm1 0.746 ppm2 6.468 CV 1
OR { 596}
(( segid " " and resid 34 and name HB2 ))
( segid " " and resid 89 and name HE% )
ASSI { 602}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 3 and name HD2 ))
3.200 1.300 1.300 peak 602 spectrum 1 weight 0.10000E+01 volume 0.14244E-02 ppm1 0.677 ppm2 6.922 CV 1
OR { 602}
( segid " " and resid 105 and name HG2%)
( segid " " and resid 103 and name HE% )
ASSI { 617}
( segid " " and resid 85 and name HG1%)
( segid " " and resid 103 and name HE% )
3.000 1.100 1.100 peak 617 spectrum 1 weight 0.10000E+01 volume 0.18654E-02 ppm1 0.589 ppm2 6.890 CV 1
OR { 617}
( segid " " and resid 24 and name HD1%)
( segid " " and resid 103 and name HE% )
ASSI { 630}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 36 and name HZ2 ))
4.800 2.900 1.200 peak 630 spectrum 1 weight 0.10000E+01 volume 0.20689E-03 ppm1 0.390 ppm2 6.944 CV 1
OR { 630}
(( segid " " and resid 26 and name HG ))
( segid " " and resid 103 and name HE% )
ASSI { 631}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 36 and name HD1 ))
3.400 1.400 1.400 peak 631 spectrum 1 weight 0.10000E+01 volume 0.97514E-03 ppm1 0.386 ppm2 7.415 CV 1
OR { 631}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 93 and name HZ2 ))
ASSI { 632}
(( segid " " and resid 26 and name HG ))
( segid " " and resid 73 and name HD% )
5.300 3.500 0.700 peak 632 spectrum 1 weight 0.10000E+01 volume 0.11489E-03 ppm1 0.376 ppm2 6.891 CV 1
OR { 632}
(( segid " " and resid 26 and name HG ))
( segid " " and resid 103 and name HE% )
ASSI { 641}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 83 and name HD2 ))
6.000 4.700 0.000 peak 641 spectrum 1 weight 0.10000E+01 volume 0.39385E-04 ppm1 0.261 ppm2 6.733 CV 1
OR { 641}
( segid " " and resid 85 and name HG2%)
( segid " " and resid 106 and name HD% )
ASSI { 687}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 46 and name HA ))
4.900 3.000 1.100 peak 687 spectrum 1 weight 0.10000E+01 volume 0.15008E-03 ppm1 3.194 ppm2 4.320 CV 1
OR { 687}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 19 and name HA1 ))
ASSI { 702}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 26 and name HA ))
3.100 3.100 2.900 peak 702 spectrum 1 weight 0.10000E+01 volume 0.13270E-03 ppm1 3.002 ppm2 4.725 CV 1
OR { 702}
(( segid " " and resid 3 and name HB1 ))
(( segid " " and resid 79 and name HA ))
ASSI { 707}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 84 and name HA ))
4.300 2.400 1.700 peak 707 spectrum 1 weight 0.10000E+01 volume 0.23996E-03 ppm1 2.904 ppm2 4.465 CV 1
OR { 707}
(( segid " " and resid 10 and name HB2 ))
(( segid " " and resid 9 and name HA ))
ASSI { 712}
(( segid " " and resid 83 and name HB1 ))
(( segid " " and resid 84 and name HA ))
2.300 2.300 3.700 peak 712 spectrum 1 weight 0.10000E+01 volume 0.86062E-02 ppm1 2.864 ppm2 4.468 CV 1
OR { 712}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 78 and name HA ))
ASSI { 721}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 69 and name HA1 ))
4.900 3.000 1.100 peak 721 spectrum 1 weight 0.10000E+01 volume 0.10472E-03 ppm1 2.726 ppm2 4.422 CV 1
OR { 721}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 78 and name HA ))
ASSI { 723}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 69 and name HA1 ))
5.800 4.100 0.200 peak 723 spectrum 1 weight 0.10000E+01 volume 0.63594E-04 ppm1 2.716 ppm2 4.385 CV 1
OR { 723}
(( segid " " and resid 51 and name HB2 ))
(( segid " " and resid 52 and name HB ))
ASSI { 729}
(( segid " " and resid 99 and name HB1 ))
(( segid " " and resid 99 and name HA ))
2.900 1.000 1.000 peak 729 spectrum 1 weight 0.10000E+01 volume 0.19544E-02 ppm1 2.666 ppm2 4.563 CV 1
OR { 729}
(( segid " " and resid 110 and name HB1 ))
(( segid " " and resid 110 and name HA ))
ASSI { 731}
(( segid " " and resid 46 and name HD2 ))
(( segid " " and resid 46 and name HA ))
2.500 2.500 3.500 peak 731 spectrum 1 weight 0.10000E+01 volume 0.95810E-02 ppm1 2.662 ppm2 4.323 CV 1
OR { 731}
(( segid " " and resid 99 and name HB1 ))
(( segid " " and resid 96 and name HA ))
ASSI { 739}
(( segid " " and resid 91 and name HD1 ))
(( segid " " and resid 91 and name HA ))
3.400 1.400 1.400 peak 739 spectrum 1 weight 0.10000E+01 volume 0.10260E-02 ppm1 2.583 ppm2 4.317 CV 1
OR { 739}
(( segid " " and resid 91 and name HD1 ))
(( segid " " and resid 33 and name HA1 ))
ASSI { 746}
(( segid " " and resid 90 and name HG1 ))
(( segid " " and resid 40 and name HA1 ))
4.200 2.200 1.800 peak 746 spectrum 1 weight 0.10000E+01 volume 0.61897E-03 ppm1 2.487 ppm2 4.299 CV 1
OR { 746}
(( segid " " and resid 99 and name HB2 ))
(( segid " " and resid 96 and name HA ))
ASSI { 755}
(( segid " " and resid 39 and name HG1 ))
(( segid " " and resid 42 and name HB ))
4.500 2.500 1.500 peak 755 spectrum 1 weight 0.10000E+01 volume 0.14711E-03 ppm1 2.329 ppm2 4.408 CV 1
OR { 755}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 89 and name HA ))
ASSI { 763}
(( segid " " and resid 89 and name HB1 ))
(( segid " " and resid 102 and name HA ))
4.500 2.500 1.500 peak 763 spectrum 1 weight 0.10000E+01 volume 0.39513E-03 ppm1 2.266 ppm2 5.337 CV 1
OR { 763}
(( segid " " and resid 103 and name HB2 ))
(( segid " " and resid 102 and name HA ))
ASSI { 767}
(( segid " " and resid 48 and name HG1 ))
(( segid " " and resid 52 and name HA ))
3.900 1.900 1.900 peak 767 spectrum 1 weight 0.10000E+01 volume 0.67833E-03 ppm1 2.249 ppm2 4.853 CV 1
OR { 767}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 54 and name HA ))
ASSI { 768}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 50 and name HA ))
1.800 1.800 4.200 peak 768 spectrum 1 weight 0.10000E+01 volume 0.10599E+00 ppm1 2.233 ppm2 4.466 CV 1
OR { 768}
(( segid " " and resid 89 and name HB1 ))
(( segid " " and resid 100 and name HA ))
ASSI { 782}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 17 and name HA ))
3.500 1.600 1.600 peak 782 spectrum 1 weight 0.10000E+01 volume 0.10430E-02 ppm1 2.045 ppm2 5.100 CV 1
OR { 782}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 51 and name HA ))
ASSI { 788}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 26 and name HA ))
5.400 3.600 0.600 peak 788 spectrum 1 weight 0.10000E+01 volume 0.18654E-03 ppm1 2.013 ppm2 4.770 CV 1
OR { 788}
(( segid " " and resid 71 and name HB1 ))
(( segid " " and resid 28 and name HA ))
ASSI { 789}
(( segid " " and resid 85 and name HB ))
(( segid " " and resid 84 and name HA ))
5.200 3.300 0.800 peak 789 spectrum 1 weight 0.10000E+01 volume 0.20308E-03 ppm1 2.012 ppm2 4.460 CV 1
OR { 789}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 50 and name HA ))
OR { 789}
(( segid " " and resid 77 and name HB ))
(( segid " " and resid 78 and name HA ))
ASSI { 792}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 102 and name HA ))
2.900 1.000 1.000 peak 792 spectrum 1 weight 0.10000E+01 volume 0.24632E-02 ppm1 1.988 ppm2 5.340 CV 1
OR { 792}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 53 and name HA ))
ASSI { 793}
(( segid " " and resid 27 and name HB2 ))
(( segid " " and resid 27 and name HA ))
2.700 0.900 0.900 peak 793 spectrum 1 weight 0.10000E+01 volume 0.29549E-02 ppm1 1.963 ppm2 4.851 CV 1
OR { 793}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HA ))
ASSI { 794}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 60 and name HA ))
2.800 1.000 1.000 peak 794 spectrum 1 weight 0.10000E+01 volume 0.39089E-02 ppm1 1.954 ppm2 4.430 CV 1
OR { 794}
(( segid " " and resid 22 and name HB ))
(( segid " " and resid 22 and name HA ))
ASSI { 797}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 23 and name HA ))
2.900 1.100 1.100 peak 797 spectrum 1 weight 0.10000E+01 volume 0.11108E-02 ppm1 1.937 ppm2 4.896 CV 1
OR { 797}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HA ))
ASSI { 799}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 65 and name HA ))
4.300 2.300 1.700 peak 799 spectrum 1 weight 0.10000E+01 volume 0.30355E-03 ppm1 1.923 ppm2 4.159 CV 1
OR { 799}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 28 and name HB1 ))
ASSI { 800}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 23 and name HA ))
2.800 1.000 1.000 peak 800 spectrum 1 weight 0.10000E+01 volume 0.12973E-02 ppm1 1.918 ppm2 4.955 CV 1
OR { 800}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 107 and name HA ))
ASSI { 806}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 6 and name HB ))
4.500 2.500 1.500 peak 806 spectrum 1 weight 0.10000E+01 volume 0.34382E-03 ppm1 1.875 ppm2 4.712 CV 1
OR { 806}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 26 and name HA ))
ASSI { 807}
(( segid " " and resid 7 and name HB1 ))
(( segid " " and resid 6 and name HA ))
5.100 3.300 0.900 peak 807 spectrum 1 weight 0.10000E+01 volume 0.19417E-03 ppm1 1.869 ppm2 5.165 CV 1
OR { 807}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 6 and name HA ))
ASSI { 808}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 46 and name HA ))
2.500 0.800 0.800 peak 808 spectrum 1 weight 0.10000E+01 volume 0.63594E-02 ppm1 1.842 ppm2 4.321 CV 1
OR { 808}
(( segid " " and resid 44 and name HB2 ))
(( segid " " and resid 44 and name HA ))
ASSI { 810}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HA ))
2.700 0.900 0.900 peak 810 spectrum 1 weight 0.10000E+01 volume 0.33111E-02 ppm1 1.801 ppm2 4.896 CV 1
OR { 810}
(( segid " " and resid 23 and name HG1 ))
(( segid " " and resid 23 and name HA ))
OR { 810}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 25 and name HA ))
ASSI { 822}
(( segid " " and resid 63 and name HD1 ))
(( segid " " and resid 64 and name HA ))
3.400 1.400 1.400 peak 822 spectrum 1 weight 0.10000E+01 volume 0.13058E-02 ppm1 1.691 ppm2 4.323 CV 1
OR { 822}
(( segid " " and resid 92 and name HB1 ))
(( segid " " and resid 91 and name HA ))
ASSI { 836}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 106 and name HA ))
3.700 1.700 1.700 peak 836 spectrum 1 weight 0.10000E+01 volume 0.97514E-03 ppm1 1.560 ppm2 5.081 CV 1
OR { 836}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 73 and name HA ))
OR { 836}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 70 and name HA ))
ASSI { 839}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 13 and name HA ))
4.600 2.700 1.400 peak 839 spectrum 1 weight 0.10000E+01 volume 0.23021E-03 ppm1 1.537 ppm2 5.331 CV 1
OR { 839}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 74 and name HA ))
ASSI { 841}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 64 and name HA ))
3.900 1.900 1.900 peak 841 spectrum 1 weight 0.10000E+01 volume 0.38876E-03 ppm1 1.533 ppm2 4.305 CV 1
OR { 841}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 105 and name HA ))
ASSI { 842}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 87 and name HA ))
2.400 0.700 0.700 peak 842 spectrum 1 weight 0.10000E+01 volume 0.50451E-02 ppm1 1.502 ppm2 4.891 CV 1
OR { 842}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 38 and name HA ))
ASSI { 843}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 103 and name HA ))
6.000 5.000 0.000 peak 843 spectrum 1 weight 0.10000E+01 volume 0.96662E-04 ppm1 1.498 ppm2 4.697 CV 1
OR { 843}
(( segid " " and resid 7 and name HG1 ))
(( segid " " and resid 26 and name HA ))
ASSI { 848}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 73 and name HA ))
4.200 2.300 1.800 peak 848 spectrum 1 weight 0.10000E+01 volume 0.36078E-03 ppm1 1.472 ppm2 5.079 CV 1
OR { 848}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 71 and name HA ))
ASSI { 868}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 84 and name HA ))
2.800 1.000 1.000 peak 868 spectrum 1 weight 0.10000E+01 volume 0.22300E-02 ppm1 1.349 ppm2 4.458 CV 1
OR { 868}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 78 and name HA ))
ASSI { 872}
(( segid " " and resid 14 and name HG ))
(( segid " " and resid 14 and name HA ))
4.400 2.400 1.600 peak 872 spectrum 1 weight 0.10000E+01 volume 0.28702E-03 ppm1 1.326 ppm2 4.692 CV 1
OR { 872}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 30 and name HA ))
ASSI { 877}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HA ))
3.600 1.600 1.600 peak 877 spectrum 1 weight 0.10000E+01 volume 0.36714E-03 ppm1 1.306 ppm2 4.814 CV 1
OR { 877}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 21 and name HA ))
ASSI { 878}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 74 and name HA ))
5.600 3.900 0.400 peak 878 spectrum 1 weight 0.10000E+01 volume 0.73344E-04 ppm1 1.295 ppm2 5.329 CV 1
OR { 878}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 13 and name HA ))
ASSI { 882}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 110 and name HA ))
4.800 2.800 1.200 peak 882 spectrum 1 weight 0.10000E+01 volume 0.17551E-03 ppm1 1.281 ppm2 4.519 CV 1
OR { 882}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 1 and name HA ))
ASSI { 887}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 87 and name HA ))
3.700 1.700 1.700 peak 887 spectrum 1 weight 0.10000E+01 volume 0.48331E-03 ppm1 1.251 ppm2 4.896 CV 1
OR { 887}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 82 and name HA ))
ASSI { 890}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HA ))
2.300 0.700 0.700 peak 890 spectrum 1 weight 0.10000E+01 volume 0.42353E-02 ppm1 1.241 ppm2 4.814 CV 1
OR { 890}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 52 and name HA ))
ASSI { 893}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 53 and name HA ))
4.300 2.300 1.700 peak 893 spectrum 1 weight 0.10000E+01 volume 0.32094E-03 ppm1 1.215 ppm2 5.336 CV 1
OR { 893}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 102 and name HA ))
ASSI { 894}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 81 and name HA1 ))
4.400 2.400 1.600 peak 894 spectrum 1 weight 0.10000E+01 volume 0.18103E-03 ppm1 1.215 ppm2 4.274 CV 1
OR { 894}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 44 and name HA ))
ASSI { 899}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 25 and name HA ))
3.400 1.500 1.500 peak 899 spectrum 1 weight 0.10000E+01 volume 0.54690E-03 ppm1 1.159 ppm2 4.892 CV 1
OR { 899}
(( segid " " and resid 4 and name HG1 ))
(( segid " " and resid 4 and name HA ))
ASSI { 908}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 101 and name HA ))
4.900 3.000 1.100 peak 908 spectrum 1 weight 0.10000E+01 volume 0.18273E-03 ppm1 1.090 ppm2 4.297 CV 1
OR { 908}
( segid " " and resid 88 and name HG2%)
(( segid " " and resid 40 and name HA1 ))
ASSI { 917}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 107 and name HA ))
6.000 6.000 0.000 peak 917 spectrum 1 weight 0.10000E+01 volume 0.19460E-04 ppm1 0.955 ppm2 4.973 CV 1
OR { 917}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 15 and name HA ))
ASSI { 925}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 81 and name HA1 ))
4.000 2.000 2.000 peak 925 spectrum 1 weight 0.10000E+01 volume 0.20392E-03 ppm1 0.913 ppm2 4.275 CV 1
OR { 925}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 69 and name HA2 ))
ASSI { 930}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 24 and name HA ))
4.200 2.200 1.800 peak 930 spectrum 1 weight 0.10000E+01 volume 0.29974E-03 ppm1 0.839 ppm2 4.452 CV 1
OR { 930}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 9 and name HA ))
ASSI { 932}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 3 and name HA ))
4.400 2.400 1.600 peak 932 spectrum 1 weight 0.10000E+01 volume 0.61474E-03 ppm1 0.830 ppm2 4.635 CV 1
OR { 932}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 90 and name HA ))
ASSI { 933}
( segid " " and resid 5 and name HG1%)
(( segid " " and resid 5 and name HA ))
3.000 1.100 1.100 peak 933 spectrum 1 weight 0.10000E+01 volume 0.21961E-02 ppm1 0.828 ppm2 4.414 CV 1
OR { 933}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 22 and name HA ))
ASSI { 938}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 110 and name HA ))
3.500 1.500 1.500 peak 938 spectrum 1 weight 0.10000E+01 volume 0.21113E-03 ppm1 0.822 ppm2 4.549 CV 1
OR { 938}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 110 and name HA ))
ASSI { 939}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 105 and name HA ))
2.700 0.900 0.900 peak 939 spectrum 1 weight 0.10000E+01 volume 0.44515E-02 ppm1 0.825 ppm2 4.288 CV 1
OR { 939}
( segid " " and resid 94 and name HG2%)
(( segid " " and resid 94 and name HA ))
ASSI { 942}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 91 and name HA ))
2.700 0.900 0.900 peak 942 spectrum 1 weight 0.10000E+01 volume 0.25013E-02 ppm1 0.785 ppm2 4.305 CV 1
OR { 942}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 105 and name HA ))
ASSI { 945}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 110 and name HA ))
3.600 1.700 1.700 peak 945 spectrum 1 weight 0.10000E+01 volume 0.98779E-03 ppm1 0.756 ppm2 4.533 CV 1
OR { 945}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 84 and name HA ))
ASSI { 950}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 21 and name HA ))
3.400 1.400 1.400 peak 950 spectrum 1 weight 0.10000E+01 volume 0.14541E-02 ppm1 0.731 ppm2 4.888 CV 1
OR { 950}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 76 and name HA ))
ASSI { 955}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 74 and name HA ))
4.000 2.000 2.000 peak 955 spectrum 1 weight 0.10000E+01 volume 0.44515E-03 ppm1 0.671 ppm2 5.324 CV 1
OR { 955}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 13 and name HA ))
ASSI { 959}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 23 and name HA ))
2.900 1.000 1.000 peak 959 spectrum 1 weight 0.10000E+01 volume 0.34171E-02 ppm1 0.661 ppm2 4.953 CV 1
OR { 959}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 23 and name HA ))
ASSI { 965}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 23 and name HA ))
2.000 2.000 4.000 peak 965 spectrum 1 weight 0.10000E+01 volume 0.24716E-01 ppm1 0.594 ppm2 4.892 CV 1
OR { 965}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 76 and name HA ))
OR { 965}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 4 and name HA ))
ASSI { 967}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 74 and name HA ))
4.800 2.900 1.200 peak 967 spectrum 1 weight 0.10000E+01 volume 0.13524E-03 ppm1 0.584 ppm2 5.325 CV 1
OR { 967}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 104 and name HA ))
ASSI { 969}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 106 and name HA ))
4.000 2.000 2.000 peak 969 spectrum 1 weight 0.10000E+01 volume 0.61897E-03 ppm1 0.588 ppm2 5.078 CV 1
OR { 969}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 106 and name HA ))
OR { 969}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 73 and name HA ))
ASSI { 973}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 107 and name HA ))
6.000 6.000 0.000 peak 973 spectrum 1 weight 0.10000E+01 volume 0.39513E-05 ppm1 0.567 ppm2 4.979 CV 1
OR { 973}
( segid " " and resid 14 and name HD1%)
(( segid " " and resid 15 and name HA ))
ASSI { 975}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 4 and name HA ))
5.000 3.200 1.000 peak 975 spectrum 1 weight 0.10000E+01 volume 0.21706E-03 ppm1 0.540 ppm2 4.893 CV 1
OR { 975}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 25 and name HA ))
ASSI { 980}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 70 and name HA ))
4.900 3.000 1.100 peak 980 spectrum 1 weight 0.10000E+01 volume 0.23445E-03 ppm1 0.510 ppm2 5.097 CV 1
OR { 980}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 17 and name HA ))
ASSI { 992}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 91 and name HA ))
3.000 1.100 1.100 peak 992 spectrum 1 weight 0.10000E+01 volume 0.71648E-03 ppm1 0.318 ppm2 4.316 CV 1
OR { 992}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 33 and name HA1 ))
ASSI { 995}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 17 and name HA ))
4.100 2.100 1.900 peak 995 spectrum 1 weight 0.10000E+01 volume 0.38453E-03 ppm1 0.263 ppm2 5.095 CV 1
OR { 995}
( segid " " and resid 85 and name HG2%)
(( segid " " and resid 106 and name HA ))
ASSI { 1001}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 25 and name HA ))
3.800 1.800 1.800 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.41886E-03 ppm1 0.124 ppm2 4.892 CV 1
OR { 1001}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 4 and name HA ))
ASSI { 1006}
(( segid " " and resid 91 and name HB2 ))
(( segid " " and resid 91 and name HA ))
3.000 1.100 1.100 peak 1006 spectrum 1 weight 0.10000E+01 volume 0.13354E-02 ppm1 0.021 ppm2 4.317 CV 1
OR { 1006}
(( segid " " and resid 89 and name HB2 ))
(( segid " " and resid 101 and name HA ))
ASSI { 1032}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 70 and name HB ))
4.200 2.200 1.800 peak 1032 spectrum 1 weight 0.10000E+01 volume 0.20689E-03 ppm1 2.626 ppm2 3.794 CV 1
OR { 1032}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 1054}
(( segid " " and resid 20 and name HB1 ))
(( segid " " and resid 2 and name HB1 ))
4.600 2.700 1.400 peak 1054 spectrum 1 weight 0.10000E+01 volume 0.21028E-03 ppm1 2.290 ppm2 3.698 CV 1
OR { 1054}
(( segid " " and resid 89 and name HB1 ))
(( segid " " and resid 100 and name HB2 ))
ASSI { 1057}
(( segid " " and resid 48 and name HG1 ))
(( segid " " and resid 49 and name HA ))
4.400 2.400 1.600 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.26964E-03 ppm1 2.214 ppm2 4.120 CV 1
OR { 1057}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 49 and name HA ))
ASSI { 1063}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 29 and name HB1 ))
3.500 1.600 1.600 peak 1063 spectrum 1 weight 0.10000E+01 volume 0.15559E-02 ppm1 2.159 ppm2 3.210 CV 1
OR { 1063}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 74 and name HB1 ))
ASSI { 1065}
(( segid " " and resid 96 and name HB1 ))
(( segid " " and resid 96 and name HD1 ))
5.400 3.700 0.600 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.14033E-03 ppm1 2.132 ppm2 3.574 CV 1
OR { 1065}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 30 and name HD2 ))
ASSI { 1074}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 29 and name HB1 ))
2.800 1.000 1.000 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.30694E-02 ppm1 2.032 ppm2 3.195 CV 1
OR { 1074}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 46 and name HD1 ))
ASSI { 1077}
(( segid " " and resid 96 and name HG1 ))
(( segid " " and resid 96 and name HD1 ))
3.000 1.100 1.100 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.82247E-03 ppm1 2.013 ppm2 3.567 CV 1
OR { 1077}
(( segid " " and resid 60 and name HG1 ))
(( segid " " and resid 60 and name HD1 ))
ASSI { 1080}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 28 and name HB1 ))
5.400 3.600 0.600 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.94966E-04 ppm1 1.952 ppm2 4.121 CV 1
OR { 1080}
(( segid " " and resid 71 and name HB1 ))
(( segid " " and resid 28 and name HB1 ))
ASSI { 1085}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 60 and name HD1 ))
2.800 1.000 1.000 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.53842E-02 ppm1 1.944 ppm2 3.504 CV 1
OR { 1085}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 59 and name HD2 ))
ASSI { 1086}
(( segid " " and resid 59 and name HB1 ))
(( segid " " and resid 60 and name HD1 ))
3.400 1.500 1.500 peak 1086 spectrum 1 weight 0.10000E+01 volume 0.16789E-02 ppm1 1.930 ppm2 3.571 CV 1
OR { 1086}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 96 and name HD1 ))
ASSI { 1092}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 88 and name HB ))
3.100 1.200 1.200 peak 1092 spectrum 1 weight 0.10000E+01 volume 0.18569E-02 ppm1 1.826 ppm2 3.834 CV 1
OR { 1092}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 70 and name HB ))
ASSI { 1095}
(( segid " " and resid 60 and name HG2 ))
(( segid " " and resid 60 and name HD1 ))
2.900 1.100 1.100 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.17637E-02 ppm1 1.827 ppm2 3.572 CV 1
OR { 1095}
(( segid " " and resid 92 and name HG1 ))
(( segid " " and resid 92 and name HD1 ))
OR { 1095}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 45 and name HA ))
ASSI { 1109}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 30 and name HD1 ))
5.700 4.100 0.300 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.46211E-04 ppm1 1.591 ppm2 3.914 CV 1
OR { 1109}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 28 and name HB2 ))
ASSI { 1111}
(( segid " " and resid 65 and name HG ))
(( segid " " and resid 68 and name HA1 ))
4.900 3.000 1.100 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.12167E-03 ppm1 1.573 ppm2 4.074 CV 1
OR { 1111}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 27 and name HD1 ))
ASSI { 1112}
( segid " " and resid 79 and name HB% )
(( segid " " and resid 80 and name HA ))
5.400 3.700 0.600 peak 1112 spectrum 1 weight 0.10000E+01 volume 0.11956E-03 ppm1 1.571 ppm2 4.024 CV 1
OR { 1112}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 85 and name HA ))
OR { 1112}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 66 and name HA1 ))
ASSI { 1113}
( segid " " and resid 79 and name HB% )
(( segid " " and resid 80 and name HA ))
6.000 6.000 0.000 peak 1113 spectrum 1 weight 0.10000E+01 volume 0.24208E-04 ppm1 1.573 ppm2 3.991 CV 1
OR { 1113}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 85 and name HA ))
ASSI { 1114}
(( segid " " and resid 78 and name HD1 ))
(( segid " " and resid 77 and name HA ))
4.300 2.300 1.700 peak 1114 spectrum 1 weight 0.10000E+01 volume 0.29423E-03 ppm1 1.573 ppm2 3.792 CV 1
OR { 1114}
(( segid " " and resid 65 and name HB1 ))
(( segid " " and resid 66 and name HA2 ))
ASSI { 1115}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 60 and name HD1 ))
2.400 2.400 3.600 peak 1115 spectrum 1 weight 0.10000E+01 volume 0.32899E-02 ppm1 1.558 ppm2 3.576 CV 1
OR { 1115}
(( segid " " and resid 21 and name HB1 ))
(( segid " " and resid 19 and name HA2 ))
OR { 1115}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 45 and name HA ))
ASSI { 1118}
( segid " " and resid 79 and name HB% )
(( segid " " and resid 80 and name HA ))
4.700 2.800 1.300 peak 1118 spectrum 1 weight 0.10000E+01 volume 0.27939E-03 ppm1 1.529 ppm2 3.990 CV 1
OR { 1118}
(( segid " " and resid 64 and name HB1 ))
(( segid " " and resid 66 and name HA1 ))
ASSI { 1119}
(( segid " " and resid 21 and name HB2 ))
(( segid " " and resid 1 and name HB1 ))
6.000 4.600 0.000 peak 1119 spectrum 1 weight 0.10000E+01 volume 0.38834E-04 ppm1 1.511 ppm2 3.727 CV 1
OR { 1119}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 1 and name HB1 ))
ASSI { 1132}
( segid " " and resid 32 and name HG2%)
(( segid " " and resid 34 and name HA ))
5.000 3.200 1.000 peak 1132 spectrum 1 weight 0.10000E+01 volume 0.25649E-03 ppm1 1.342 ppm2 3.807 CV 1
OR { 1132}
(( segid " " and resid 78 and name HG1 ))
(( segid " " and resid 77 and name HA ))
ASSI { 1135}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 82 and name HB ))
2.800 2.800 3.200 peak 1135 spectrum 1 weight 0.10000E+01 volume 0.25988E-02 ppm1 1.320 ppm2 3.894 CV 1
OR { 1135}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 30 and name HD1 ))
ASSI { 1136}
(( segid " " and resid 21 and name HG ))
(( segid " " and resid 74 and name HB1 ))
3.000 1.200 1.200 peak 1136 spectrum 1 weight 0.10000E+01 volume 0.25183E-02 ppm1 1.315 ppm2 3.201 CV 1
OR { 1136}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 29 and name HB1 ))
ASSI { 1139}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 76 and name HB ))
4.900 3.000 1.100 peak 1139 spectrum 1 weight 0.10000E+01 volume 0.13566E-03 ppm1 1.270 ppm2 4.050 CV 1
OR { 1139}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 15 and name HB ))
ASSI { 1142}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 34 and name HA ))
5.400 3.600 0.600 peak 1142 spectrum 1 weight 0.10000E+01 volume 0.12888E-03 ppm1 1.259 ppm2 3.852 CV 1
OR { 1142}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 28 and name HB2 ))
OR { 1142}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 82 and name HB ))
ASSI { 1143}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 34 and name HA ))
5.700 4.000 0.300 peak 1143 spectrum 1 weight 0.10000E+01 volume 0.85639E-04 ppm1 1.261 ppm2 3.834 CV 1
OR { 1143}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 82 and name HB ))
ASSI { 1144}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 33 and name HA2 ))
3.800 1.800 1.800 peak 1144 spectrum 1 weight 0.10000E+01 volume 0.22470E-03 ppm1 1.241 ppm2 3.696 CV 1
OR { 1144}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 59 and name HD1 ))
ASSI { 1147}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 76 and name HB ))
4.500 2.500 1.500 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.24716E-03 ppm1 1.241 ppm2 4.031 CV 1
OR { 1147}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 15 and name HB ))
OR { 1147}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 15 and name HB ))
ASSI { 1182}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 76 and name HB ))
4.600 2.600 1.400 peak 1182 spectrum 1 weight 0.10000E+01 volume 0.23954E-03 ppm1 0.676 ppm2 3.992 CV 1
OR { 1182}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 10 and name HA ))
ASSI { 1184}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 74 and name HB1 ))
3.400 1.400 1.400 peak 1184 spectrum 1 weight 0.10000E+01 volume 0.56386E-03 ppm1 0.646 ppm2 3.205 CV 1
OR { 1184}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 18 and name HA ))
ASSI { 1194}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 18 and name HA ))
4.700 2.800 1.300 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.35443E-03 ppm1 0.510 ppm2 3.195 CV 1
OR { 1194}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 29 and name HB1 ))
ASSI { 1229}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 86 and name HA ))
4.700 2.800 1.300 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.23868E-03 ppm1 4.864 ppm2 5.387 CV 1
OR { 1229}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 53 and name HA ))
ASSI { 1230}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 13 and name HA ))
4.100 2.100 1.900 peak 1230 spectrum 1 weight 0.10000E+01 volume 0.50027E-03 ppm1 4.648 ppm2 5.324 CV 1
OR { 1230}
(( segid " " and resid 103 and name HA ))
(( segid " " and resid 102 and name HA ))
ASSI { 1232}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 104 and name HA ))
4.000 2.000 2.000 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.56810E-03 ppm1 4.306 ppm2 5.328 CV 1
OR { 1232}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 13 and name HA ))
ASSI { 1235}
(( segid " " and resid 27 and name HD1 ))
(( segid " " and resid 27 and name HA ))
3.200 1.300 1.300 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.14202E-02 ppm1 4.072 ppm2 4.815 CV 1
OR { 1235}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 52 and name HA ))
ASSI { 1236}
(( segid " " and resid 48 and name HA ))
(( segid " " and resid 47 and name HA ))
3.200 1.200 1.200 peak 1236 spectrum 1 weight 0.10000E+01 volume 0.22554E-02 ppm1 4.054 ppm2 4.455 CV 1
OR { 1236}
(( segid " " and resid 8 and name HA ))
(( segid " " and resid 9 and name HA ))
ASSI { 1238}
(( segid " " and resid 27 and name HD1 ))
(( segid " " and resid 6 and name HA ))
4.200 2.200 1.800 peak 1238 spectrum 1 weight 0.10000E+01 volume 0.52147E-03 ppm1 4.036 ppm2 5.129 CV 1
OR { 1238}
(( segid " " and resid 76 and name HB ))
(( segid " " and resid 75 and name HA ))
ASSI { 1248}
(( segid " " and resid 30 and name HD1 ))
(( segid " " and resid 30 and name HA ))
6.000 6.000 0.000 peak 1248 spectrum 1 weight 0.10000E+01 volume 0.10344E-04 ppm1 3.907 ppm2 4.725 CV 1
OR { 1248}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 26 and name HA ))
ASSI { 1251}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 59 and name HA ))
5.100 3.200 0.900 peak 1251 spectrum 1 weight 0.10000E+01 volume 0.94966E-04 ppm1 3.849 ppm2 4.495 CV 1
OR { 1251}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 78 and name HA ))
ASSI { 1255}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 78 and name HA ))
6.000 5.900 0.000 peak 1255 spectrum 1 weight 0.10000E+01 volume 0.18103E-04 ppm1 3.801 ppm2 4.456 CV 1
OR { 1255}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 61 and name HA ))
OR { 1255}
(( segid " " and resid 49 and name HB1 ))
(( segid " " and resid 50 and name HA ))
ASSI { 1256}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 76 and name HA ))
4.500 2.500 1.500 peak 1256 spectrum 1 weight 0.10000E+01 volume 0.34765E-03 ppm1 3.791 ppm2 4.846 CV 1
OR { 1256}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 27 and name HA ))
ASSI { 1259}
(( segid " " and resid 66 and name HA2 ))
(( segid " " and resid 60 and name HA ))
5.700 4.100 0.300 peak 1259 spectrum 1 weight 0.10000E+01 volume 0.64017E-04 ppm1 3.771 ppm2 4.432 CV 1
OR { 1259}
(( segid " " and resid 49 and name HB1 ))
(( segid " " and resid 50 and name HA ))
ASSI { 1260}
(( segid " " and resid 66 and name HA2 ))
(( segid " " and resid 60 and name HA ))
5.200 3.400 0.800 peak 1260 spectrum 1 weight 0.10000E+01 volume 0.14838E-03 ppm1 3.776 ppm2 4.399 CV 1
OR { 1260}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 98 and name HA ))
ASSI { 1262}
(( segid " " and resid 1 and name HB1 ))
(( segid " " and resid 4 and name HA ))
5.000 3.100 1.000 peak 1262 spectrum 1 weight 0.10000E+01 volume 0.15898E-03 ppm1 3.727 ppm2 4.892 CV 1
OR { 1262}
(( segid " " and resid 1 and name HB1 ))
(( segid " " and resid 23 and name HA ))
OR { 1262}
(( segid " " and resid 2 and name HB1 ))
(( segid " " and resid 4 and name HA ))
ASSI { 1265}
(( segid " " and resid 2 and name HB1 ))
(( segid " " and resid 21 and name HA ))
3.400 1.500 1.500 peak 1265 spectrum 1 weight 0.10000E+01 volume 0.18569E-02 ppm1 3.696 ppm2 4.815 CV 1
OR { 1265}
(( segid " " and resid 81 and name HA2 ))
(( segid " " and resid 108 and name HA ))
ASSI { 1288}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 106 and name HA ))
4.100 2.100 1.900 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.45787E-03 ppm1 4.318 ppm2 5.075 CV 1
OR { 1288}
(( segid " " and resid 56 and name HA ))
(( segid " " and resid 57 and name HA ))
ASSI { 1296}
(( segid " " and resid 33 and name HA1 ))
(( segid " " and resid 32 and name HA ))
5.700 4.000 0.300 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.88183E-04 ppm1 4.272 ppm2 4.461 CV 1
OR { 1296}
(( segid " " and resid 101 and name HA ))
(( segid " " and resid 100 and name HA ))
OR { 1296}
(( segid " " and resid 105 and name HA ))
(( segid " " and resid 9 and name HA ))
ASSI { 1304}
(( segid " " and resid 95 and name HA2 ))
(( segid " " and resid 91 and name HA ))
6.000 6.000 0.000 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.19502E-04 ppm1 3.791 ppm2 4.353 CV 1
OR { 1304}
(( segid " " and resid 66 and name HA2 ))
(( segid " " and resid 67 and name HA ))
ASSI { 1340}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HB1 ))
2.100 0.600 0.600 peak 1340 spectrum 1 weight 0.10000E+01 volume 0.43667E-02 ppm1 3.797 ppm2 3.958 CV 1
OR { 1340}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 97 and name HB1 ))
ASSI { 1347}
(( segid " " and resid 92 and name HD1 ))
(( segid " " and resid 95 and name HA2 ))
3.000 3.000 3.000 peak 1347 spectrum 1 weight 0.10000E+01 volume 0.33789E-02 ppm1 3.507 ppm2 3.752 CV 1
OR { 1347}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 40 and name HA2 ))
ASSI { 1356}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 91 and name HD1 ))
5.400 3.700 0.600 peak 1356 spectrum 1 weight 0.10000E+01 volume 0.15941E-03 ppm1 2.370 ppm2 2.629 CV 1
OR { 1356}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 46 and name HD2 ))
ASSI { 1377}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 57 and name HB2 ))
4.400 2.500 1.600 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.69528E-03 ppm1 1.858 ppm2 2.602 CV 1
OR { 1377}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 47 and name HB1 ))
ASSI { 1390}
(( segid " " and resid 78 and name HD1 ))
(( segid " " and resid 50 and name HG1 ))
3.600 1.600 1.600 peak 1390 spectrum 1 weight 0.10000E+01 volume 0.67408E-03 ppm1 1.597 ppm2 2.788 CV 1
OR { 1390}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 73 and name HB1 ))
ASSI { 1395}
( segid " " and resid 79 and name HB% )
(( segid " " and resid 47 and name HB1 ))
4.200 2.200 1.800 peak 1395 spectrum 1 weight 0.10000E+01 volume 0.29168E-03 ppm1 1.559 ppm2 2.625 CV 1
OR { 1395}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 72 and name HB2 ))
ASSI { 1396}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 72 and name HB2 ))
2.400 0.700 0.700 peak 1396 spectrum 1 weight 0.10000E+01 volume 0.27600E-02 ppm1 1.500 ppm2 2.629 CV 1
OR { 1396}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 56 and name HE1 ))
ASSI { 1411}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 83 and name HB1 ))
2.700 0.900 0.900 peak 1411 spectrum 1 weight 0.10000E+01 volume 0.51722E-02 ppm1 1.348 ppm2 2.867 CV 1
OR { 1411}
(( segid " " and resid 78 and name HG1 ))
(( segid " " and resid 78 and name HE1 ))
ASSI { 1415}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 36 and name HB2 ))
4.300 2.300 1.700 peak 1415 spectrum 1 weight 0.10000E+01 volume 0.64865E-03 ppm1 1.249 ppm2 2.629 CV 1
OR { 1415}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 36 and name HB2 ))
ASSI { 1416}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
5.000 3.200 1.000 peak 1416 spectrum 1 weight 0.10000E+01 volume 0.24293E-03 ppm1 1.241 ppm2 2.897 CV 1
OR { 1416}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 10 and name HB2 ))
ASSI { 1418}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 73 and name HB1 ))
4.200 2.200 1.800 peak 1418 spectrum 1 weight 0.10000E+01 volume 0.79703E-03 ppm1 1.242 ppm2 2.802 CV 1
OR { 1418}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 83 and name HB2 ))
ASSI { 1426}
(( segid " " and resid 56 and name HG1 ))
(( segid " " and resid 57 and name HB2 ))
5.800 4.300 0.200 peak 1426 spectrum 1 weight 0.10000E+01 volume 0.88183E-04 ppm1 0.964 ppm2 2.571 CV 1
OR { 1426}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 57 and name HB2 ))
ASSI { 1428}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 51 and name HB1 ))
4.600 2.600 1.400 peak 1428 spectrum 1 weight 0.10000E+01 volume 0.41590E-03 ppm1 0.947 ppm2 2.891 CV 1
OR { 1428}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 83 and name HB1 ))
ASSI { 1431}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
5.300 3.500 0.700 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.13609E-03 ppm1 0.907 ppm2 2.885 CV 1
OR { 1431}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 51 and name HB1 ))
ASSI { 1448}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 3 and name HB1 ))
4.200 2.200 1.800 peak 1448 spectrum 1 weight 0.10000E+01 volume 0.26158E-03 ppm1 0.571 ppm2 2.991 CV 1
OR { 1448}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 72 and name HB1 ))
OR { 1448}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 72 and name HB1 ))
ASSI { 1449}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 73 and name HB1 ))
3.500 1.500 1.500 peak 1449 spectrum 1 weight 0.10000E+01 volume 0.11786E-02 ppm1 0.576 ppm2 2.831 CV 1
OR { 1449}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 73 and name HB1 ))
ASSI { 1476}
(( segid " " and resid 78 and name HG1 ))
(( segid " " and resid 50 and name HG2 ))
4.100 2.100 1.900 peak 1476 spectrum 1 weight 0.10000E+01 volume 0.38792E-03 ppm1 1.376 ppm2 2.256 CV 1
OR { 1476}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 54 and name HG1 ))
ASSI { 1479}
(( segid " " and resid 78 and name HG1 ))
(( segid " " and resid 50 and name HG2 ))
3.900 1.900 1.900 peak 1479 spectrum 1 weight 0.10000E+01 volume 0.50451E-03 ppm1 1.321 ppm2 2.257 CV 1
OR { 1479}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 89 and name HB1 ))
OR { 1479}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 54 and name HG1 ))
ASSI { 1490}
(( segid " " and resid 46 and name HG1 ))
(( segid " " and resid 46 and name HB1 ))
1.900 0.500 0.500 peak 1490 spectrum 1 weight 0.10000E+01 volume 0.11998E-01 ppm1 1.948 ppm2 2.282 CV 1
OR { 1490}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 48 and name HG1 ))
OR { 1490}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HG1 ))
ASSI { 1492}
(( segid " " and resid 54 and name HB2 ))
(( segid " " and resid 54 and name HB1 ))
2.300 2.300 3.700 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.26625E-02 ppm1 1.931 ppm2 2.144 CV 1
OR { 1492}
(( segid " " and resid 96 and name HB2 ))
(( segid " " and resid 96 and name HB1 ))
ASSI { 1504}
( segid " " and resid 77 and name HG1%)
( segid " " and resid 109 and name HB% )
2.700 0.900 0.900 peak 1504 spectrum 1 weight 0.10000E+01 volume 0.44515E-02 ppm1 0.946 ppm2 1.324 CV 1
OR { 1504}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 25 and name HB2 ))
ASSI { 1505}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 60 and name HG1 ))
3.300 1.400 1.400 peak 1505 spectrum 1 weight 0.10000E+01 volume 0.91575E-03 ppm1 0.920 ppm2 1.959 CV 1
OR { 1505}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 60 and name HB2 ))
OR { 1505}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 22 and name HB ))
ASSI { 1507}
( segid " " and resid 82 and name HG2%)
( segid " " and resid 84 and name HB% )
3.200 1.200 1.200 peak 1507 spectrum 1 weight 0.10000E+01 volume 0.10472E-02 ppm1 0.922 ppm2 1.376 CV 1
OR { 1507}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 78 and name HG1 ))
OR { 1507}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 78 and name HB2 ))
ASSI { 1508}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HG ))
2.500 0.800 0.800 peak 1508 spectrum 1 weight 0.10000E+01 volume 0.40742E-02 ppm1 0.895 ppm2 1.561 CV 1
OR { 1508}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 64 and name HG ))
ASSI { 1512}
( segid " " and resid 65 and name HD2%)
(( segid " " and resid 65 and name HG ))
1.500 0.300 0.700 peak 1512 spectrum 1 weight 0.10000E+01 volume 0.87762E-01 ppm1 0.860 ppm2 1.577 CV 1
OR { 1512}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 64 and name HG ))
OR { 1512}
( segid " " and resid 64 and name HD2%)
(( segid " " and resid 64 and name HG ))
ASSI { 1516}
( segid " " and resid 22 and name HG1%)
( segid " " and resid 109 and name HB% )
1.700 1.700 4.300 peak 1516 spectrum 1 weight 0.10000E+01 volume 0.72072E-01 ppm1 0.826 ppm2 1.324 CV 1
OR { 1516}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 78 and name HG1 ))
ASSI { 1517}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 78 and name HB1 ))
4.600 2.600 1.400 peak 1517 spectrum 1 weight 0.10000E+01 volume 0.23275E-03 ppm1 0.818 ppm2 1.830 CV 1
OR { 1517}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 23 and name HG1 ))
OR { 1517}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 18 and name HB ))
ASSI { 1524}
( segid " " and resid 18 and name HG1%)
( segid " " and resid 79 and name HB% )
4.700 2.800 1.300 peak 1524 spectrum 1 weight 0.10000E+01 volume 0.22342E-03 ppm1 0.749 ppm2 1.573 CV 1
OR { 1524}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 78 and name HD1 ))
ASSI { 1535}
( segid " " and resid 22 and name HG2%)
(( segid " " and resid 18 and name HB ))
4.800 2.900 1.200 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.17509E-03 ppm1 0.647 ppm2 1.830 CV 1
OR { 1535}
( segid " " and resid 21 and name HD1%)
(( segid " " and resid 23 and name HG1 ))
ASSI { 1539}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 24 and name HG11))
1.900 0.400 0.400 peak 1539 spectrum 1 weight 0.10000E+01 volume 0.59778E-02 ppm1 0.600 ppm2 1.557 CV 1
OR { 1539}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 24 and name HG11))
ASSI { 1541}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 85 and name HB ))
2.300 0.700 0.700 peak 1541 spectrum 1 weight 0.10000E+01 volume 0.55538E-02 ppm1 0.590 ppm2 2.030 CV 1
OR { 1541}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 75 and name HB ))
ASSI { 1550}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 109 and name HB% )
3.200 1.200 1.200 peak 1550 spectrum 1 weight 0.10000E+01 volume 0.38665E-02 ppm1 0.511 ppm2 1.325 CV 1
OR { 1550}
( segid " " and resid 16 and name HG1%)
( segid " " and resid 17 and name HB% )
ASSI { 2}
(( segid " " and resid 48 and name HB1 ))
(( segid " " and resid 48 and name HN ))
1.000 0.100 1.200 peak 2 spectrum 1 weight 0.10000E+01 volume 0.87460E+00 ppm1 1.957 ppm2 9.057 CV 1
OR { 2}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 24 and name HN ))
ASSI { 5}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 12 and name HN ))
1.500 1.500 4.500 peak 5 spectrum 1 weight 0.10000E+01 volume 0.13707E+00 ppm1 3.987 ppm2 8.503 CV 1
OR { 5}
(( segid " " and resid 100 and name HB1 ))
(( segid " " and resid 89 and name HN ))
ASSI { 17}
(( segid " " and resid 82 and name HA ))
(( segid " " and resid 83 and name HN ))
1.600 0.300 0.600 peak 17 spectrum 1 weight 0.10000E+01 volume 0.29664E-01 ppm1 4.909 ppm2 9.022 CV 1
OR { 17}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
ASSI { 23}
(( segid " " and resid 74 and name HA ))
(( segid " " and resid 24 and name HG12))
2.200 2.200 3.800 peak 23 spectrum 1 weight 0.10000E+01 volume 0.20023E-01 ppm1 5.327 ppm2 0.584 CV 1
OR { 23}
(( segid " " and resid 74 and name HA ))
( segid " " and resid 75 and name HG2%)
ASSI { 36}
(( segid " " and resid 83 and name HA ))
(( segid " " and resid 84 and name HN ))
1.900 0.500 0.500 peak 36 spectrum 1 weight 0.10000E+01 volume 0.13502E-01 ppm1 4.922 ppm2 9.063 CV 1
OR { 36}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 24 and name HN ))
ASSI { 45}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 74 and name HN ))
1.900 0.500 0.500 peak 45 spectrum 1 weight 0.10000E+01 volume 0.11175E-01 ppm1 5.082 ppm2 9.593 CV 1
OR { 45}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 71 and name HN ))
ASSI { 50}
(( segid " " and resid 85 and name HB ))
(( segid " " and resid 85 and name HN ))
2.200 0.600 0.600 peak 50 spectrum 1 weight 0.10000E+01 volume 0.10510E-01 ppm1 2.031 ppm2 8.595 CV 1
OR { 50}
(( segid " " and resid 77 and name HB ))
(( segid " " and resid 78 and name HN ))
ASSI { 53}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 88 and name HN ))
2.000 0.500 0.500 peak 53 spectrum 1 weight 0.10000E+01 volume 0.99218E-02 ppm1 4.865 ppm2 9.387 CV 1
OR { 53}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 22 and name HN ))
ASSI { 62}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 109 and name HN ))
2.100 0.600 0.600 peak 62 spectrum 1 weight 0.10000E+01 volume 0.92057E-02 ppm1 1.341 ppm2 9.065 CV 1
OR { 62}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 84 and name HN ))
ASSI { 74}
( segid " " and resid 106 and name HD% )
(( segid " " and resid 106 and name HN ))
2.300 0.600 0.600 peak 74 spectrum 1 weight 0.10000E+01 volume 0.81063E-02 ppm1 6.695 ppm2 8.653 CV 1
OR { 74}
( segid " " and resid 51 and name HD% )
(( segid " " and resid 77 and name HN ))
ASSI { 88}
(( segid " " and resid 41 and name HA2 ))
(( segid " " and resid 41 and name HN ))
2.200 0.600 0.600 peak 88 spectrum 1 weight 0.10000E+01 volume 0.69556E-02 ppm1 3.164 ppm2 8.647 CV 1
OR { 88}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 19 and name HN ))
ASSI { 106}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HB1 ))
2.200 0.600 0.600 peak 106 spectrum 1 weight 0.10000E+01 volume 0.59839E-02 ppm1 4.870 ppm2 2.165 CV 1
OR { 106}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 54 and name HB1 ))
ASSI { 118}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 75 and name HG2%)
2.700 0.900 0.900 peak 118 spectrum 1 weight 0.10000E+01 volume 0.55491E-02 ppm1 5.380 ppm2 0.586 CV 1
OR { 118}
(( segid " " and resid 74 and name HA ))
( segid " " and resid 75 and name HG2%)
ASSI { 124}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 46 and name HD1 ))
2.400 0.700 0.700 peak 124 spectrum 1 weight 0.10000E+01 volume 0.54724E-02 ppm1 1.850 ppm2 3.205 CV 1
OR { 124}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 18 and name HA ))
ASSI { 128}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 54 and name HN ))
2.600 0.900 0.900 peak 128 spectrum 1 weight 0.10000E+01 volume 0.54213E-02 ppm1 1.349 ppm2 8.588 CV 1
OR { 128}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 85 and name HN ))
ASSI { 154}
(( segid " " and resid 85 and name HA ))
(( segid " " and resid 85 and name HB ))
2.500 0.800 0.800 peak 154 spectrum 1 weight 0.10000E+01 volume 0.49354E-02 ppm1 4.031 ppm2 2.026 CV 1
OR { 154}
(( segid " " and resid 27 and name HD1 ))
(( segid " " and resid 27 and name HG2 ))
ASSI { 155}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HN ))
2.300 0.700 0.700 peak 155 spectrum 1 weight 0.10000E+01 volume 0.49354E-02 ppm1 4.468 ppm2 8.412 CV 1
OR { 155}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 61 and name HN ))
ASSI { 177}
(( segid " " and resid 33 and name HA1 ))
(( segid " " and resid 33 and name HN ))
2.300 0.700 0.700 peak 177 spectrum 1 weight 0.10000E+01 volume 0.42961E-02 ppm1 4.299 ppm2 7.827 CV 1
OR { 177}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HN ))
ASSI { 193}
(( segid " " and resid 18 and name HB ))
(( segid " " and resid 18 and name HN ))
2.800 1.000 1.000 peak 193 spectrum 1 weight 0.10000E+01 volume 0.39636E-02 ppm1 1.853 ppm2 8.413 CV 1
OR { 193}
(( segid " " and resid 60 and name HG2 ))
(( segid " " and resid 61 and name HN ))
ASSI { 194}
(( segid " " and resid 78 and name HD1 ))
(( segid " " and resid 78 and name HN ))
2.600 0.800 0.800 peak 194 spectrum 1 weight 0.10000E+01 volume 0.39636E-02 ppm1 1.565 ppm2 8.555 CV 1
OR { 194}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 26 and name HN ))
ASSI { 195}
(( segid " " and resid 106 and name HA ))
(( segid " " and resid 106 and name HB1 ))
2.200 0.600 0.600 peak 195 spectrum 1 weight 0.10000E+01 volume 0.39381E-02 ppm1 5.041 ppm2 3.104 CV 1
OR { 195}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB1 ))
ASSI { 197}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 57 and name HB2 ))
2.700 0.900 0.900 peak 197 spectrum 1 weight 0.10000E+01 volume 0.39125E-02 ppm1 5.064 ppm2 2.589 CV 1
OR { 197}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 57 and name HB2 ))
ASSI { 198}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 85 and name HN ))
2.900 1.000 1.000 peak 198 spectrum 1 weight 0.10000E+01 volume 0.39125E-02 ppm1 1.343 ppm2 8.561 CV 1
OR { 198}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 26 and name HN ))
ASSI { 205}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 41 and name HN ))
2.300 0.700 0.700 peak 205 spectrum 1 weight 0.10000E+01 volume 0.38358E-02 ppm1 3.789 ppm2 8.662 CV 1
OR { 205}
(( segid " " and resid 66 and name HA2 ))
(( segid " " and resid 66 and name HN ))
ASSI { 228}
(( segid " " and resid 95 and name HA1 ))
(( segid " " and resid 90 and name HB2 ))
2.900 1.100 1.100 peak 228 spectrum 1 weight 0.10000E+01 volume 0.35290E-02 ppm1 4.243 ppm2 1.408 CV 1
OR { 228}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HG1 ))
ASSI { 239}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 36 and name HB2 ))
2.400 0.700 0.700 peak 239 spectrum 1 weight 0.10000E+01 volume 0.34011E-02 ppm1 1.854 ppm2 2.656 CV 1
OR { 239}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 46 and name HD2 ))
ASSI { 290}
(( segid " " and resid 7 and name HA ))
( segid " " and resid 103 and name HD% )
2.800 1.000 1.000 peak 290 spectrum 1 weight 0.10000E+01 volume 0.28896E-02 ppm1 3.880 ppm2 6.716 CV 1
OR { 290}
(( segid " " and resid 41 and name HA1 ))
( segid " " and resid 37 and name HE% )
ASSI { 331}
(( segid " " and resid 58 and name HB2 ))
(( segid " " and resid 58 and name HN ))
2.800 1.000 1.000 peak 331 spectrum 1 weight 0.10000E+01 volume 0.26083E-02 ppm1 2.640 ppm2 8.478 CV 1
OR { 331}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 63 and name HN ))
ASSI { 332}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 40 and name HN ))
2.500 0.800 0.800 peak 332 spectrum 1 weight 0.10000E+01 volume 0.26083E-02 ppm1 3.444 ppm2 8.963 CV 1
OR { 332}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 38 and name HN ))
ASSI { 347}
(( segid " " and resid 53 and name HB ))
(( segid " " and resid 53 and name HN ))
2.900 1.100 1.100 peak 347 spectrum 1 weight 0.10000E+01 volume 0.24984E-02 ppm1 2.174 ppm2 8.896 CV 1
OR { 347}
(( segid " " and resid 27 and name HG1 ))
(( segid " " and resid 7 and name HN ))
ASSI { 354}
(( segid " " and resid 5 and name HB ))
(( segid " " and resid 5 and name HN ))
2.600 0.900 0.900 peak 354 spectrum 1 weight 0.10000E+01 volume 0.24652E-02 ppm1 1.873 ppm2 8.941 CV 1
OR { 354}
( segid " " and resid 90 and name HE% )
(( segid " " and resid 40 and name HN ))
ASSI { 357}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 106 and name HN ))
2.900 1.000 1.000 peak 357 spectrum 1 weight 0.10000E+01 volume 0.24575E-02 ppm1 1.566 ppm2 8.654 CV 1
OR { 357}
( segid " " and resid 79 and name HB% )
(( segid " " and resid 80 and name HN ))
ASSI { 367}
(( segid " " and resid 46 and name HB2 ))
(( segid " " and resid 47 and name HN ))
2.900 1.000 1.000 peak 367 spectrum 1 weight 0.10000E+01 volume 0.23961E-02 ppm1 1.820 ppm2 7.560 CV 1
OR { 367}
(( segid " " and resid 92 and name HG1 ))
(( segid " " and resid 93 and name HE3 ))
ASSI { 376}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 92 and name HD1 ))
2.900 1.100 3.100 peak 376 spectrum 1 weight 0.10000E+01 volume 0.23628E-02 ppm1 2.509 ppm2 3.503 CV 1
OR { 376}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 38 and name HB1 ))
ASSI { 380}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 107 and name HN ))
2.800 1.000 1.000 peak 380 spectrum 1 weight 0.10000E+01 volume 0.23475E-02 ppm1 1.881 ppm2 9.144 CV 1
OR { 380}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 108 and name HN ))
ASSI { 381}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 103 and name HB2 ))
3.400 1.400 1.400 peak 381 spectrum 1 weight 0.10000E+01 volume 0.23449E-02 ppm1 4.862 ppm2 2.253 CV 1
OR { 381}
(( segid " " and resid 54 and name HA ))
(( segid " " and resid 55 and name HB1 ))
ASSI { 385}
(( segid " " and resid 60 and name HB2 ))
(( segid " " and resid 66 and name HA2 ))
3.000 1.100 1.100 peak 385 spectrum 1 weight 0.10000E+01 volume 0.23270E-02 ppm1 1.945 ppm2 3.746 CV 1
OR { 385}
(( segid " " and resid 96 and name HG1 ))
(( segid " " and resid 95 and name HA2 ))
ASSI { 390}
(( segid " " and resid 48 and name HG1 ))
(( segid " " and resid 48 and name HN ))
3.000 1.100 1.100 peak 390 spectrum 1 weight 0.10000E+01 volume 0.23066E-02 ppm1 2.251 ppm2 9.056 CV 1
OR { 390}
(( segid " " and resid 55 and name HB1 ))
(( segid " " and resid 55 and name HN ))
ASSI { 427}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 71 and name HG2 ))
2.700 0.900 0.900 peak 427 spectrum 1 weight 0.10000E+01 volume 0.21660E-02 ppm1 5.063 ppm2 2.311 CV 1
OR { 427}
(( segid " " and resid 57 and name HA ))
(( segid " " and resid 71 and name HG2 ))
ASSI { 428}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 83 and name HB1 ))
3.100 1.200 1.200 peak 428 spectrum 1 weight 0.10000E+01 volume 0.21583E-02 ppm1 0.583 ppm2 2.889 CV 1
OR { 428}
( segid " " and resid 75 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
ASSI { 441}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 72 and name HE1 ))
2.900 1.000 1.000 peak 441 spectrum 1 weight 0.10000E+01 volume 0.21123E-02 ppm1 1.846 ppm2 7.953 CV 1
OR { 441}
(( segid " " and resid 43 and name HB2 ))
(( segid " " and resid 44 and name HN ))
ASSI { 472}
(( segid " " and resid 3 and name HB2 ))
(( segid " " and resid 4 and name HN ))
3.200 1.300 1.300 peak 472 spectrum 1 weight 0.10000E+01 volume 0.20023E-02 ppm1 2.883 ppm2 8.551 CV 1
OR { 472}
(( segid " " and resid 51 and name HB1 ))
(( segid " " and resid 78 and name HN ))
ASSI { 483}
(( segid " " and resid 87 and name HB1 ))
(( segid " " and resid 36 and name HZ3 ))
3.200 1.300 1.300 peak 483 spectrum 1 weight 0.10000E+01 volume 0.19511E-02 ppm1 1.474 ppm2 6.765 CV 1
OR { 483}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 74 and name HD2 ))
ASSI { 485}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 25 and name HE22))
3.000 1.100 1.100 peak 485 spectrum 1 weight 0.10000E+01 volume 0.19461E-02 ppm1 1.552 ppm2 6.677 CV 1
OR { 485}
(( segid " " and resid 78 and name HD1 ))
( segid " " and resid 51 and name HD% )
ASSI { 492}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
2.600 0.800 0.800 peak 492 spectrum 1 weight 0.10000E+01 volume 0.19256E-02 ppm1 4.917 ppm2 1.342 CV 1
OR { 492}
(( segid " " and resid 83 and name HA ))
( segid " " and resid 84 and name HB% )
ASSI { 506}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 24 and name HN ))
3.400 1.400 1.400 peak 506 spectrum 1 weight 0.10000E+01 volume 0.18795E-02 ppm1 1.550 ppm2 9.061 CV 1
OR { 506}
(( segid " " and resid 23 and name HG2 ))
(( segid " " and resid 24 and name HN ))
ASSI { 524}
(( segid " " and resid 45 and name HA ))
( segid " " and resid 75 and name HG1%)
3.100 1.200 1.200 peak 524 spectrum 1 weight 0.10000E+01 volume 0.18310E-02 ppm1 3.563 ppm2 0.900 CV 1
OR { 524}
(( segid " " and resid 60 and name HD1 ))
( segid " " and resid 65 and name HD1%)
ASSI { 531}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 64 and name HD2%)
3.000 1.100 1.100 peak 531 spectrum 1 weight 0.10000E+01 volume 0.18105E-02 ppm1 4.376 ppm2 0.842 CV 1
OR { 531}
(( segid " " and resid 5 and name HA ))
( segid " " and resid 5 and name HG1%)
ASSI { 539}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 108 and name HN ))
3.100 1.200 1.200 peak 539 spectrum 1 weight 0.10000E+01 volume 0.17823E-02 ppm1 1.261 ppm2 9.146 CV 1
OR { 539}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 43 and name HN ))
ASSI { 540}
( segid " " and resid 70 and name HG2%)
(( segid " " and resid 72 and name HD2 ))
3.200 1.200 1.200 peak 540 spectrum 1 weight 0.10000E+01 volume 0.17773E-02 ppm1 0.943 ppm2 6.738 CV 1
OR { 540}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 83 and name HD2 ))
ASSI { 566}
(( segid " " and resid 58 and name HA ))
(( segid " " and resid 58 and name HN ))
2.900 1.000 1.000 peak 566 spectrum 1 weight 0.10000E+01 volume 0.16622E-02 ppm1 4.574 ppm2 8.473 CV 1
OR { 566}
(( segid " " and resid 110 and name HA ))
(( segid " " and resid 81 and name HN ))
ASSI { 568}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 42 and name HN ))
3.000 1.100 1.100 peak 568 spectrum 1 weight 0.10000E+01 volume 0.16545E-02 ppm1 3.808 ppm2 7.327 CV 1
OR { 568}
(( segid " " and resid 49 and name HB1 ))
(( segid " " and resid 50 and name HN ))
ASSI { 582}
(( segid " " and resid 36 and name HB2 ))
( segid " " and resid 57 and name HD% )
3.200 1.300 1.300 peak 582 spectrum 1 weight 0.10000E+01 volume 0.16111E-02 ppm1 2.641 ppm2 7.201 CV 1
OR { 582}
(( segid " " and resid 91 and name HD1 ))
(( segid " " and resid 93 and name HH2 ))
ASSI { 583}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 76 and name HN ))
3.300 1.400 1.400 peak 583 spectrum 1 weight 0.10000E+01 volume 0.16059E-02 ppm1 0.908 ppm2 8.715 CV 1
OR { 583}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 76 and name HN ))
ASSI { 597}
(( segid " " and resid 96 and name HA ))
(( segid " " and resid 96 and name HG1 ))
3.300 1.400 1.400 peak 597 spectrum 1 weight 0.10000E+01 volume 0.15701E-02 ppm1 4.319 ppm2 2.008 CV 1
OR { 597}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HG1 ))
ASSI { 602}
(( segid " " and resid 60 and name HD1 ))
(( segid " " and resid 60 and name HG2 ))
3.200 1.300 1.300 peak 602 spectrum 1 weight 0.10000E+01 volume 0.15420E-02 ppm1 3.577 ppm2 1.823 CV 1
OR { 602}
(( segid " " and resid 30 and name HD2 ))
(( segid " " and resid 30 and name HB2 ))
OR { 602}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 46 and name HG2 ))
ASSI { 609}
(( segid " " and resid 87 and name HG ))
( segid " " and resid 103 and name HE% )
3.100 1.200 1.200 peak 609 spectrum 1 weight 0.10000E+01 volume 0.15215E-02 ppm1 0.673 ppm2 6.911 CV 1
OR { 609}
( segid " " and resid 105 and name HG2%)
( segid " " and resid 103 and name HE% )
ASSI { 621}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 5 and name HG1%)
3.600 1.600 1.600 peak 621 spectrum 1 weight 0.10000E+01 volume 0.14883E-02 ppm1 4.861 ppm2 0.820 CV 1
OR { 621}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 22 and name HG1%)
OR { 621}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 77 and name HG2%)
ASSI { 636}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 21 and name HB2 ))
2.800 1.000 1.000 peak 636 spectrum 1 weight 0.10000E+01 volume 0.14551E-02 ppm1 4.861 ppm2 1.504 CV 1
OR { 636}
(( segid " " and resid 87 and name HA ))
(( segid " " and resid 87 and name HB1 ))
ASSI { 638}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 47 and name HB1 ))
3.400 1.400 1.400 peak 638 spectrum 1 weight 0.10000E+01 volume 0.14473E-02 ppm1 0.917 ppm2 2.594 CV 1
OR { 638}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 61 and name HB1 ))
ASSI { 646}
(( segid " " and resid 77 and name HB ))
(( segid " " and resid 77 and name HN ))
3.200 1.300 1.300 peak 646 spectrum 1 weight 0.10000E+01 volume 0.14244E-02 ppm1 2.031 ppm2 8.655 CV 1
OR { 646}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 16 and name HN ))
ASSI { 651}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 25 and name HE21))
3.100 1.200 1.200 peak 651 spectrum 1 weight 0.10000E+01 volume 0.14141E-02 ppm1 4.884 ppm2 7.265 CV 1
OR { 651}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HE21))
ASSI { 665}
(( segid " " and resid 78 and name HG1 ))
(( segid " " and resid 50 and name HG2 ))
3.200 1.300 1.300 peak 665 spectrum 1 weight 0.10000E+01 volume 0.13835E-02 ppm1 1.329 ppm2 2.252 CV 1
OR { 665}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 89 and name HB1 ))
ASSI { 673}
( segid " " and resid 22 and name HG1%)
(( segid " " and resid 3 and name HB2 ))
3.600 1.600 1.600 peak 673 spectrum 1 weight 0.10000E+01 volume 0.13553E-02 ppm1 0.820 ppm2 2.887 CV 1
OR { 673}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
ASSI { 682}
(( segid " " and resid 53 and name HB ))
(( segid " " and resid 54 and name HN ))
3.100 1.200 1.200 peak 682 spectrum 1 weight 0.10000E+01 volume 0.13246E-02 ppm1 2.170 ppm2 8.607 CV 1
OR { 682}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 54 and name HN ))
ASSI { 686}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 75 and name HG2%)
3.400 1.400 1.400 peak 686 spectrum 1 weight 0.10000E+01 volume 0.13195E-02 ppm1 4.868 ppm2 0.584 CV 1
OR { 686}
(( segid " " and resid 4 and name HA ))
( segid " " and resid 24 and name HD1%)
ASSI { 703}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HG1 ))
3.700 1.700 1.700 peak 703 spectrum 1 weight 0.10000E+01 volume 0.12914E-02 ppm1 4.862 ppm2 2.338 CV 1
OR { 703}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 20 and name HB1 ))
ASSI { 707}
( segid " " and resid 82 and name HG2%)
(( segid " " and resid 82 and name HN ))
3.600 1.600 1.600 peak 707 spectrum 1 weight 0.10000E+01 volume 0.12863E-02 ppm1 0.928 ppm2 8.116 CV 1
OR { 707}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 65 and name HN ))
ASSI { 714}
(( segid " " and resid 15 and name HA ))
(( segid " " and resid 108 and name HB1 ))
3.000 1.100 1.100 peak 714 spectrum 1 weight 0.10000E+01 volume 0.12709E-02 ppm1 4.941 ppm2 1.795 CV 1
OR { 714}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB2 ))
ASSI { 719}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 34 and name HB2 ))
3.700 1.700 1.700 peak 719 spectrum 1 weight 0.10000E+01 volume 0.12658E-02 ppm1 4.694 ppm2 0.746 CV 1
OR { 719}
(( segid " " and resid 3 and name HA ))
( segid " " and resid 18 and name HG1%)
ASSI { 721}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 16 and name HB ))
3.400 1.400 1.400 peak 721 spectrum 1 weight 0.10000E+01 volume 0.12658E-02 ppm1 5.078 ppm2 2.028 CV 1
OR { 721}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 77 and name HB ))
ASSI { 759}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 73 and name HN ))
3.100 1.200 1.200 peak 759 spectrum 1 weight 0.10000E+01 volume 0.12070E-02 ppm1 9.062 ppm2 9.605 CV 1
OR { 759}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 74 and name HN ))
ASSI { 761}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HN ))
3.100 1.200 1.200 peak 761 spectrum 1 weight 0.10000E+01 volume 0.12019E-02 ppm1 0.778 ppm2 7.822 CV 1
OR { 761}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 105 and name HN ))
ASSI { 769}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 71 and name HB1 ))
3.300 1.400 1.400 peak 769 spectrum 1 weight 0.10000E+01 volume 0.11865E-02 ppm1 1.240 ppm2 1.947 CV 1
OR { 769}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 60 and name HB2 ))
OR { 769}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 48 and name HB1 ))
OR { 769}
(( segid " " and resid 30 and name HG2 ))
(( segid " " and resid 59 and name HB1 ))
ASSI { 785}
( segid " " and resid 85 and name HG1%)
(( segid " " and resid 73 and name HB2 ))
3.600 1.600 1.600 peak 785 spectrum 1 weight 0.10000E+01 volume 0.11457E-02 ppm1 0.594 ppm2 2.591 CV 1
OR { 785}
(( segid " " and resid 24 and name HG12))
(( segid " " and resid 73 and name HB2 ))
ASSI { 790}
(( segid " " and resid 70 and name HB ))
(( segid " " and resid 70 and name HN ))
3.100 1.200 1.200 peak 790 spectrum 1 weight 0.10000E+01 volume 0.11405E-02 ppm1 3.784 ppm2 8.389 CV 1
OR { 790}
(( segid " " and resid 66 and name HA2 ))
(( segid " " and resid 61 and name HN ))
ASSI { 795}
(( segid " " and resid 7 and name HA ))
(( segid " " and resid 7 and name HB1 ))
3.400 1.400 1.400 peak 795 spectrum 1 weight 0.10000E+01 volume 0.11277E-02 ppm1 3.903 ppm2 1.823 CV 1
OR { 795}
(( segid " " and resid 30 and name HD1 ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 797}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 91 and name HB1 ))
2.900 1.100 1.100 peak 797 spectrum 1 weight 0.10000E+01 volume 0.11252E-02 ppm1 4.334 ppm2 0.742 CV 1
OR { 797}
(( segid " " and resid 33 and name HA1 ))
(( segid " " and resid 91 and name HB1 ))
ASSI { 801}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
3.700 1.700 1.700 peak 801 spectrum 1 weight 0.10000E+01 volume 0.11226E-02 ppm1 1.238 ppm2 2.882 CV 1
OR { 801}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 83 and name HB1 ))
ASSI { 809}
(( segid " " and resid 24 and name HG11))
( segid " " and resid 103 and name HE% )
3.600 1.600 1.600 peak 809 spectrum 1 weight 0.10000E+01 volume 0.11124E-02 ppm1 1.556 ppm2 6.882 CV 1
OR { 809}
( segid " " and resid 12 and name HB% )
( segid " " and resid 103 and name HE% )
ASSI { 813}
(( segid " " and resid 36 and name HH2 ))
(( segid " " and resid 102 and name HN ))
3.300 1.300 1.300 peak 813 spectrum 1 weight 0.10000E+01 volume 0.11073E-02 ppm1 6.764 ppm2 8.489 CV 1
OR { 813}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 58 and name HN ))
ASSI { 824}
( segid " " and resid 105 and name HG1%)
(( segid " " and resid 106 and name HN ))
3.600 1.600 1.600 peak 824 spectrum 1 weight 0.10000E+01 volume 0.10919E-02 ppm1 0.818 ppm2 8.654 CV 1
OR { 824}
( segid " " and resid 77 and name HG2%)
(( segid " " and resid 77 and name HN ))
ASSI { 842}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 36 and name HD1 ))
3.900 1.900 1.900 peak 842 spectrum 1 weight 0.10000E+01 volume 0.10715E-02 ppm1 4.117 ppm2 7.402 CV 1
OR { 842}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 51 and name HN ))
ASSI { 853}
(( segid " " and resid 81 and name HN ))
(( segid " " and resid 109 and name HN ))
3.300 1.300 1.300 peak 853 spectrum 1 weight 0.10000E+01 volume 0.10536E-02 ppm1 8.452 ppm2 9.070 CV 1
OR { 853}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HN ))
ASSI { 857}
(( segid " " and resid 56 and name HB1 ))
( segid " " and resid 58 and name HD% )
3.400 1.500 1.500 peak 857 spectrum 1 weight 0.10000E+01 volume 0.10459E-02 ppm1 1.469 ppm2 6.815 CV 1
OR { 857}
(( segid " " and resid 90 and name HB2 ))
( segid " " and resid 37 and name HD% )
ASSI { 871}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 9 and name HD2 ))
3.400 1.500 1.500 peak 871 spectrum 1 weight 0.10000E+01 volume 0.10075E-02 ppm1 0.580 ppm2 7.019 CV 1
OR { 871}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 3 and name HD2 ))
OR { 871}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 3 and name HD2 ))
ASSI { 876}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 83 and name HD2 ))
3.500 1.500 1.500 peak 876 spectrum 1 weight 0.10000E+01 volume 0.99984E-03 ppm1 1.320 ppm2 6.738 CV 1
OR { 876}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 74 and name HD2 ))
ASSI { 899}
(( segid " " and resid 13 and name HA ))
( segid " " and resid 105 and name HG2%)
3.700 1.700 1.700 peak 899 spectrum 1 weight 0.10000E+01 volume 0.96154E-03 ppm1 5.355 ppm2 0.719 CV 1
OR { 899}
(( segid " " and resid 104 and name HA ))
( segid " " and resid 105 and name HG2%)
ASSI { 912}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 33 and name HN ))
3.300 1.400 1.400 peak 912 spectrum 1 weight 0.10000E+01 volume 0.94105E-03 ppm1 7.552 ppm2 7.829 CV 1
OR { 912}
(( segid " " and resid 104 and name HN ))
(( segid " " and resid 10 and name HD21))
ASSI { 918}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 38 and name HE% )
3.800 1.800 1.800 peak 918 spectrum 1 weight 0.10000E+01 volume 0.92823E-03 ppm1 4.891 ppm2 6.881 CV 1
OR { 918}
(( segid " " and resid 25 and name HA ))
( segid " " and resid 73 and name HD% )
OR { 918}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 38 and name HE% )
ASSI { 930}
(( segid " " and resid 4 and name HD1 ))
(( segid " " and resid 4 and name HN ))
3.800 1.800 1.800 peak 930 spectrum 1 weight 0.10000E+01 volume 0.90783E-03 ppm1 1.469 ppm2 8.553 CV 1
OR { 930}
(( segid " " and resid 56 and name HD1 ))
(( segid " " and resid 26 and name HN ))
ASSI { 945}
(( segid " " and resid 47 and name HA ))
(( segid " " and resid 49 and name HN ))
3.500 1.500 1.500 peak 945 spectrum 1 weight 0.10000E+01 volume 0.88226E-03 ppm1 4.405 ppm2 7.955 CV 1
OR { 945}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 44 and name HN ))
ASSI { 949}
(( segid " " and resid 87 and name HA ))
( segid " " and resid 87 and name HD1%)
4.100 2.100 1.900 peak 949 spectrum 1 weight 0.10000E+01 volume 0.87968E-03 ppm1 4.883 ppm2 -0.466 CV 1
OR { 949}
(( segid " " and resid 38 and name HA ))
( segid " " and resid 87 and name HD1%)
ASSI { 958}
(( segid " " and resid 89 and name HA ))
(( segid " " and resid 90 and name HB2 ))
4.000 2.000 2.000 peak 958 spectrum 1 weight 0.10000E+01 volume 0.84900E-03 ppm1 4.459 ppm2 1.471 CV 1
OR { 958}
(( segid " " and resid 100 and name HA ))
(( segid " " and resid 90 and name HB2 ))
ASSI { 978}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 19 and name HA2 ))
3.900 1.900 1.900 peak 978 spectrum 1 weight 0.10000E+01 volume 0.81319E-03 ppm1 0.741 ppm2 3.571 CV 1
OR { 978}
(( segid " " and resid 91 and name HB1 ))
(( segid " " and resid 96 and name HD1 ))
ASSI { 987}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 82 and name HG2%)
3.200 1.300 1.300 peak 987 spectrum 1 weight 0.10000E+01 volume 0.80041E-03 ppm1 0.263 ppm2 0.916 CV 1
OR { 987}
( segid " " and resid 16 and name HG2%)
( segid " " and resid 77 and name HG1%)
ASSI { 997}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 47 and name HB1 ))
3.600 1.600 1.600 peak 997 spectrum 1 weight 0.10000E+01 volume 0.77739E-03 ppm1 0.895 ppm2 2.628 CV 1
OR { 997}
( segid " " and resid 75 and name HG1%)
(( segid " " and resid 46 and name HD2 ))
ASSI { 1004}
(( segid " " and resid 56 and name HB1 ))
( segid " " and resid 58 and name HE% )
3.900 1.900 1.900 peak 1004 spectrum 1 weight 0.10000E+01 volume 0.77228E-03 ppm1 1.456 ppm2 6.980 CV 1
OR { 1004}
(( segid " " and resid 7 and name HG1 ))
(( segid " " and resid 29 and name HD22))
ASSI { 1012}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 72 and name HD2 ))
3.600 1.600 1.600 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.76461E-03 ppm1 1.813 ppm2 6.769 CV 1
OR { 1012}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 74 and name HD2 ))
OR { 1012}
(( segid " " and resid 46 and name HG2 ))
(( segid " " and resid 83 and name HD2 ))
ASSI { 1039}
(( segid " " and resid 40 and name HA2 ))
(( segid " " and resid 40 and name HA1 ))
2.600 2.600 3.400 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.71091E-03 ppm1 3.784 ppm2 4.242 CV 1
OR { 1039}
(( segid " " and resid 95 and name HA2 ))
(( segid " " and resid 95 and name HA1 ))
ASSI { 1068}
(( segid " " and resid 88 and name HB ))
( segid " " and resid 90 and name HE% )
3.700 1.700 1.700 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.66487E-03 ppm1 3.841 ppm2 1.823 CV 1
OR { 1068}
(( segid " " and resid 77 and name HA ))
(( segid " " and resid 78 and name HB1 ))
ASSI { 1072}
( segid " " and resid 105 and name HG1%)
( segid " " and resid 106 and name HD% )
3.500 1.500 1.500 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.65720E-03 ppm1 0.783 ppm2 6.687 CV 1
OR { 1072}
( segid " " and resid 18 and name HG1%)
(( segid " " and resid 110 and name HD22))
ASSI { 1074}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 36 and name HZ2 ))
3.600 1.600 1.600 peak 1074 spectrum 1 weight 0.10000E+01 volume 0.65208E-03 ppm1 1.303 ppm2 6.976 CV 1
OR { 1074}
( segid " " and resid 31 and name HG2%)
(( segid " " and resid 29 and name HD22))
ASSI { 1084}
(( segid " " and resid 66 and name HA1 ))
(( segid " " and resid 65 and name HN ))
4.000 2.000 2.000 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.63674E-03 ppm1 3.992 ppm2 8.119 CV 1
OR { 1084}
(( segid " " and resid 80 and name HA ))
(( segid " " and resid 110 and name HN ))
ASSI { 1085}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 43 and name HN ))
3.400 1.400 1.400 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.63163E-03 ppm1 4.884 ppm2 9.167 CV 1
OR { 1085}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 39 and name HN ))
ASSI { 1098}
(( segid " " and resid 66 and name HA2 ))
(( segid " " and resid 66 and name HA1 ))
3.000 3.000 3.000 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.61373E-03 ppm1 3.806 ppm2 3.995 CV 1
OR { 1098}
(( segid " " and resid 97 and name HB2 ))
(( segid " " and resid 97 and name HB1 ))
ASSI { 1108}
(( segid " " and resid 108 and name HG1 ))
(( segid " " and resid 16 and name HN ))
4.100 2.100 1.900 peak 1108 spectrum 1 weight 0.10000E+01 volume 0.59839E-03 ppm1 1.225 ppm2 8.651 CV 1
OR { 1108}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 41 and name HN ))
ASSI { 1109}
( segid " " and resid 103 and name HD% )
(( segid " " and resid 103 and name HN ))
4.000 2.000 2.000 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.59839E-03 ppm1 6.691 ppm2 9.208 CV 1
OR { 1109}
( segid " " and resid 106 and name HD% )
(( segid " " and resid 107 and name HN ))
ASSI { 1110}
(( segid " " and resid 108 and name HB1 ))
(( segid " " and resid 110 and name HD22))
3.600 1.600 1.600 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.59583E-03 ppm1 1.772 ppm2 6.682 CV 1
OR { 1110}
(( segid " " and resid 7 and name HB2 ))
(( segid " " and resid 25 and name HE22))
ASSI { 1150}
(( segid " " and resid 107 and name HB1 ))
(( segid " " and resid 83 and name HB1 ))
3.800 1.800 1.800 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.52678E-03 ppm1 1.909 ppm2 2.903 CV 1
OR { 1150}
(( segid " " and resid 50 and name HB1 ))
(( segid " " and resid 51 and name HB1 ))
ASSI { 1168}
(( segid " " and resid 43 and name HG1 ))
(( segid " " and resid 55 and name HN ))
3.900 1.900 1.900 peak 1168 spectrum 1 weight 0.10000E+01 volume 0.50121E-03 ppm1 1.127 ppm2 9.072 CV 1
OR { 1168}
( segid " " and resid 15 and name HG2%)
(( segid " " and resid 109 and name HN ))
ASSI { 1169}
(( segid " " and resid 71 and name HA ))
(( segid " " and resid 72 and name HA ))
3.900 1.900 1.900 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.49610E-03 ppm1 5.069 ppm2 5.672 CV 1
OR { 1169}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 72 and name HA ))
ASSI { 1193}
(( segid " " and resid 9 and name HB2 ))
( segid " " and resid 103 and name HD% )
4.100 2.100 1.900 peak 1193 spectrum 1 weight 0.10000E+01 volume 0.44751E-03 ppm1 3.278 ppm2 6.688 CV 1
OR { 1193}
(( segid " " and resid 104 and name HB ))
( segid " " and resid 103 and name HD% )
ASSI { 1194}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 38 and name HB2 ))
4.300 2.300 1.700 peak 1194 spectrum 1 weight 0.10000E+01 volume 0.44495E-03 ppm1 1.226 ppm2 3.142 CV 1
OR { 1194}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 38 and name HB2 ))
OR { 1194}
( segid " " and resid 35 and name HB% )
(( segid " " and resid 41 and name HA2 ))
ASSI { 1201}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 49 and name HN ))
4.700 2.700 1.300 peak 1201 spectrum 1 weight 0.10000E+01 volume 0.43728E-03 ppm1 5.097 ppm2 7.958 CV 1
OR { 1201}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 72 and name HE1 ))
ASSI { 1210}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 110 and name HD22))
4.300 2.300 1.700 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.42705E-03 ppm1 0.263 ppm2 6.655 CV 1
OR { 1210}
( segid " " and resid 85 and name HG2%)
( segid " " and resid 103 and name HD% )
ASSI { 1215}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HN ))
4.000 2.000 2.000 peak 1215 spectrum 1 weight 0.10000E+01 volume 0.42449E-03 ppm1 4.243 ppm2 7.779 CV 1
OR { 1215}
(( segid " " and resid 31 and name HB ))
(( segid " " and resid 32 and name HN ))
ASSI { 1222}
( segid " " and resid 12 and name HB% )
(( segid " " and resid 104 and name HN ))
3.800 1.800 1.800 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.41171E-03 ppm1 1.544 ppm2 7.555 CV 1
OR { 1222}
(( segid " " and resid 24 and name HG11))
(( segid " " and resid 86 and name HD21))
ASSI { 1224}
(( segid " " and resid 61 and name HB1 ))
(( segid " " and resid 61 and name HN ))
3.900 1.900 1.900 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.40404E-03 ppm1 2.589 ppm2 8.424 CV 1
OR { 1224}
(( segid " " and resid 57 and name HB2 ))
(( segid " " and resid 57 and name HN ))
ASSI { 1226}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HE22))
4.500 2.600 1.500 peak 1226 spectrum 1 weight 0.10000E+01 volume 0.39892E-03 ppm1 4.909 ppm2 6.676 CV 1
OR { 1226}
(( segid " " and resid 87 and name HA ))
( segid " " and resid 103 and name HD% )
ASSI { 1229}
( segid " " and resid 77 and name HG1%)
(( segid " " and resid 77 and name HN ))
3.900 1.900 1.900 peak 1229 spectrum 1 weight 0.10000E+01 volume 0.39636E-03 ppm1 0.904 ppm2 8.656 CV 1
OR { 1229}
( segid " " and resid 76 and name HG2%)
(( segid " " and resid 77 and name HN ))
ASSI { 1232}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 47 and name HN ))
3.700 1.800 1.800 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.39381E-03 ppm1 4.323 ppm2 7.561 CV 1
OR { 1232}
(( segid " " and resid 33 and name HA1 ))
(( segid " " and resid 34 and name HN ))
ASSI { 1234}
(( segid " " and resid 47 and name HB1 ))
(( segid " " and resid 47 and name HN ))
4.300 2.300 1.700 peak 1234 spectrum 1 weight 0.10000E+01 volume 0.38870E-03 ppm1 2.596 ppm2 7.562 CV 1
OR { 1234}
(( segid " " and resid 91 and name HD1 ))
(( segid " " and resid 95 and name HN ))
ASSI { 1257}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 60 and name HG1 ))
4.500 2.500 1.500 peak 1257 spectrum 1 weight 0.10000E+01 volume 0.36568E-03 ppm1 4.456 ppm2 2.012 CV 1
OR { 1257}
(( segid " " and resid 50 and name HA ))
( segid " " and resid 50 and name HE% )
OR { 1257}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 85 and name HB ))
ASSI { 1263}
( segid " " and resid 80 and name HB% )
(( segid " " and resid 110 and name HN ))
4.600 2.700 1.400 peak 1263 spectrum 1 weight 0.10000E+01 volume 0.36057E-03 ppm1 1.410 ppm2 8.121 CV 1
OR { 1263}
(( segid " " and resid 63 and name HG1 ))
(( segid " " and resid 65 and name HN ))
ASSI { 1271}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 55 and name HN ))
4.500 2.500 1.500 peak 1271 spectrum 1 weight 0.10000E+01 volume 0.35545E-03 ppm1 8.605 ppm2 9.060 CV 1
OR { 1271}
(( segid " " and resid 85 and name HN ))
(( segid " " and resid 84 and name HN ))
ASSI { 1282}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 36 and name HZ2 ))
4.400 2.400 1.600 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.34778E-03 ppm1 0.399 ppm2 6.939 CV 1
OR { 1282}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 29 and name HD22))
OR { 1282}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 29 and name HD22))
ASSI { 1296}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 72 and name HE1 ))
4.700 2.800 1.300 peak 1296 spectrum 1 weight 0.10000E+01 volume 0.33755E-03 ppm1 3.037 ppm2 7.952 CV 1
OR { 1296}
(( segid " " and resid 72 and name HB1 ))
(( segid " " and resid 74 and name HE1 ))
ASSI { 1303}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 61 and name HB1 ))
4.200 2.200 1.800 peak 1303 spectrum 1 weight 0.10000E+01 volume 0.32988E-03 ppm1 4.312 ppm2 2.593 CV 1
OR { 1303}
(( segid " " and resid 33 and name HA1 ))
(( segid " " and resid 91 and name HD1 ))
ASSI { 1339}
(( segid " " and resid 86 and name HA ))
( segid " " and resid 103 and name HE% )
4.300 2.300 1.700 peak 1339 spectrum 1 weight 0.10000E+01 volume 0.29664E-03 ppm1 5.362 ppm2 6.878 CV 1
OR { 1339}
(( segid " " and resid 86 and name HA ))
( segid " " and resid 38 and name HE% )
ASSI { 1342}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HG2 ))
4.300 2.300 1.700 peak 1342 spectrum 1 weight 0.10000E+01 volume 0.29408E-03 ppm1 4.843 ppm2 2.016 CV 1
OR { 1342}
(( segid " " and resid 76 and name HA ))
(( segid " " and resid 77 and name HB ))
ASSI { 1343}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 93 and name HN ))
4.200 2.200 1.800 peak 1343 spectrum 1 weight 0.10000E+01 volume 0.29408E-03 ppm1 4.307 ppm2 6.890 CV 1
OR { 1343}
(( segid " " and resid 105 and name HA ))
( segid " " and resid 103 and name HE% )
OR { 1343}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 93 and name HN ))
ASSI { 1356}
(( segid " " and resid 78 and name HB1 ))
( segid " " and resid 51 and name HE% )
4.300 2.300 1.700 peak 1356 spectrum 1 weight 0.10000E+01 volume 0.28640E-03 ppm1 1.852 ppm2 7.113 CV 1
OR { 1356}
(( segid " " and resid 71 and name HB2 ))
(( segid " " and resid 36 and name HE3 ))
ASSI { 1357}
(( segid " " and resid 48 and name HG1 ))
(( segid " " and resid 49 and name HN ))
4.200 2.200 1.800 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.28640E-03 ppm1 2.214 ppm2 7.986 CV 1
OR { 1357}
(( segid " " and resid 50 and name HG2 ))
(( segid " " and resid 49 and name HN ))
ASSI { 1367}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 3 and name HD2 ))
4.500 2.600 1.500 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.27874E-03 ppm1 4.403 ppm2 6.988 CV 1
OR { 1367}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 9 and name HD2 ))
ASSI { 1372}
(( segid " " and resid 85 and name HB ))
( segid " " and resid 38 and name HD% )
4.500 2.500 1.500 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.27618E-03 ppm1 2.016 ppm2 7.501 CV 1
OR { 1372}
(( segid " " and resid 16 and name HB ))
(( segid " " and resid 110 and name HD21))
ASSI { 1374}
(( segid " " and resid 85 and name HB ))
(( segid " " and resid 38 and name HZ ))
4.700 2.800 1.300 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.27107E-03 ppm1 2.014 ppm2 7.269 CV 1
OR { 1374}
(( segid " " and resid 27 and name HG2 ))
(( segid " " and resid 25 and name HE21))
ASSI { 1377}
( segid " " and resid 105 and name HG2%)
(( segid " " and resid 107 and name HN ))
4.400 2.400 1.600 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.27107E-03 ppm1 0.659 ppm2 9.182 CV 1
OR { 1377}
(( segid " " and resid 87 and name HG ))
(( segid " " and resid 103 and name HN ))
ASSI { 1381}
(( segid " " and resid 96 and name HD1 ))
(( segid " " and resid 95 and name HN ))
4.000 2.000 2.000 peak 1381 spectrum 1 weight 0.10000E+01 volume 0.26851E-03 ppm1 3.575 ppm2 7.573 CV 1
OR { 1381}
(( segid " " and resid 92 and name HD1 ))
(( segid " " and resid 93 and name HE3 ))
ASSI { 1411}
(( segid " " and resid 74 and name HB1 ))
(( segid " " and resid 74 and name HD2 ))
4.500 2.500 1.500 peak 1411 spectrum 1 weight 0.10000E+01 volume 0.22427E-03 ppm1 3.231 ppm2 6.769 CV 1
OR { 1411}
(( segid " " and resid 46 and name HD1 ))
(( segid " " and resid 83 and name HD2 ))
ASSI { 1431}
(( segid " " and resid 74 and name HD2 ))
(( segid " " and resid 73 and name HN ))
3.900 1.900 1.900 peak 1431 spectrum 1 weight 0.10000E+01 volume 0.21225E-03 ppm1 6.772 ppm2 9.600 CV 1
OR { 1431}
(( segid " " and resid 74 and name HD2 ))
(( segid " " and resid 74 and name HN ))
ASSI { 1452}
(( segid " " and resid 58 and name HB1 ))
(( segid " " and resid 58 and name HN ))
4.700 2.800 1.300 peak 1452 spectrum 1 weight 0.10000E+01 volume 0.19282E-03 ppm1 2.724 ppm2 8.475 CV 1
OR { 1452}
(( segid " " and resid 110 and name HB1 ))
(( segid " " and resid 81 and name HN ))
ASSI { 1475}
(( segid " " and resid 75 and name HB ))
(( segid " " and resid 83 and name HD2 ))
5.100 3.200 0.900 peak 1475 spectrum 1 weight 0.10000E+01 volume 0.16980E-03 ppm1 2.001 ppm2 6.752 CV 1
OR { 1475}
(( segid " " and resid 102 and name HB1 ))
(( segid " " and resid 36 and name HZ3 ))
OR { 1475}
(( segid " " and resid 71 and name HB1 ))
(( segid " " and resid 72 and name HD2 ))
ASSI { 1493}
(( segid " " and resid 96 and name HA ))
( segid " " and resid 34 and name HE% )
5.000 3.100 1.000 peak 1493 spectrum 1 weight 0.10000E+01 volume 0.15778E-03 ppm1 4.290 ppm2 7.093 CV 1
OR { 1493}
(( segid " " and resid 94 and name HA ))
(( segid " " and resid 93 and name HD1 ))
ASSI { 1499}
(( segid " " and resid 29 and name HD22))
(( segid " " and resid 28 and name HN ))
4.700 2.800 1.300 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.15599E-03 ppm1 6.990 ppm2 8.301 CV 1
OR { 1499}
(( segid " " and resid 3 and name HD2 ))
(( segid " " and resid 3 and name HE1 ))
ASSI { 1501}
(( segid " " and resid 7 and name HG1 ))
(( segid " " and resid 10 and name HN ))
4.800 2.900 1.200 peak 1501 spectrum 1 weight 0.10000E+01 volume 0.15599E-03 ppm1 1.478 ppm2 7.239 CV 1
OR { 1501}
(( segid " " and resid 56 and name HB1 ))
( segid " " and resid 57 and name HD% )
ASSI { 1511}
(( segid " " and resid 91 and name HD1 ))
( segid " " and resid 34 and name HE% )
4.700 2.800 1.300 peak 1511 spectrum 1 weight 0.10000E+01 volume 0.14576E-03 ppm1 2.603 ppm2 7.118 CV 1
OR { 1511}
(( segid " " and resid 99 and name HB1 ))
( segid " " and resid 34 and name HE% )
ASSI { 1544}
( segid " " and resid 53 and name HG1%)
(( segid " " and resid 55 and name HD21))
5.100 3.200 0.900 peak 1544 spectrum 1 weight 0.10000E+01 volume 0.11763E-03 ppm1 1.370 ppm2 7.501 CV 1
OR { 1544}
( segid " " and resid 80 and name HB% )
(( segid " " and resid 110 and name HD21))
ASSI { 1545}
(( segid " " and resid 5 and name HA ))
(( segid " " and resid 5 and name HN ))
4.500 2.600 1.500 peak 1545 spectrum 1 weight 0.10000E+01 volume 0.11584E-03 ppm1 4.379 ppm2 8.942 CV 1
OR { 1545}
(( segid " " and resid 52 and name HB ))
(( segid " " and resid 53 and name HN ))
ASSI { 1547}
(( segid " " and resid 26 and name HG ))
( segid " " and resid 73 and name HD% )
5.200 3.400 0.800 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.11533E-03 ppm1 0.361 ppm2 6.880 CV 1
OR { 1547}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 93 and name HN ))
ASSI { 1564}
(( segid " " and resid 72 and name HD2 ))
(( segid " " and resid 72 and name HE1 ))
5.300 3.600 0.700 peak 1564 spectrum 1 weight 0.10000E+01 volume 0.10408E-03 ppm1 6.772 ppm2 7.953 CV 1
OR { 1564}
(( segid " " and resid 74 and name HD2 ))
(( segid " " and resid 74 and name HE1 ))
ASSI { 1574}
(( segid " " and resid 78 and name HB2 ))
(( segid " " and resid 19 and name HN ))
5.100 3.200 0.900 peak 1574 spectrum 1 weight 0.10000E+01 volume 0.98194E-04 ppm1 1.323 ppm2 8.653 CV 1
OR { 1574}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 16 and name HN ))
OR { 1574}
( segid " " and resid 84 and name HB% )
(( segid " " and resid 106 and name HN ))
ASSI { 1587}
(( segid " " and resid 110 and name HB2 ))
(( segid " " and resid 110 and name HD21))
5.000 3.200 1.000 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.84900E-04 ppm1 2.622 ppm2 7.517 CV 1
OR { 1587}
(( segid " " and resid 99 and name HB1 ))
(( segid " " and resid 100 and name HN ))
ASSI { 1594}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 106 and name HD% )
5.500 3.800 0.500 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.80552E-04 ppm1 4.403 ppm2 6.718 CV 1
OR { 1594}
(( segid " " and resid 89 and name HA ))
( segid " " and resid 37 and name HE% )
ASSI { 1616}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 14 and name HB1 ))
5.600 3.900 0.400 peak 1616 spectrum 1 weight 0.10000E+01 volume 0.62652E-04 ppm1 4.067 ppm2 1.239 CV 1
OR { 1616}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 108 and name HB2 ))
OR { 1616}
(( segid " " and resid 15 and name HB ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 1636}
( segid " " and resid 73 and name HD% )
(( segid " " and resid 24 and name HN ))
5.900 4.400 0.100 peak 1636 spectrum 1 weight 0.10000E+01 volume 0.46286E-04 ppm1 6.882 ppm2 9.057 CV 1
OR { 1636}
( segid " " and resid 57 and name HE% )
(( segid " " and resid 55 and name HN ))
ASSI { 1638}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HN ))
5.400 3.700 0.600 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.45262E-04 ppm1 5.090 ppm2 8.340 CV 1
OR { 1638}
(( segid " " and resid 73 and name HA ))
(( segid " " and resid 56 and name HN ))
ASSI { 1660}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 75 and name HN ))
5.700 4.000 0.300 peak 1660 spectrum 1 weight 0.10000E+01 volume 0.35290E-04 ppm1 4.858 ppm2 9.797 CV 1
OR { 1660}
(( segid " " and resid 4 and name HA ))
(( segid " " and resid 75 and name HN ))
ASSI { 1663}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB1 ))
5.800 4.300 0.200 peak 1663 spectrum 1 weight 0.10000E+01 volume 0.33755E-04 ppm1 4.911 ppm2 1.567 CV 1
OR { 1663}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HG2 ))
ASSI { 1670}
( segid " " and resid 50 and name HE% )
(( segid " " and resid 50 and name HN ))
6.000 5.400 0.000 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.30686E-04 ppm1 2.012 ppm2 7.316 CV 1
OR { 1670}
(( segid " " and resid 85 and name HB ))
(( segid " " and resid 38 and name HZ ))
ASSI { 1685}
( segid " " and resid 109 and name HB% )
(( segid " " and resid 110 and name HD21))
6.000 6.000 0.000 peak 1685 spectrum 1 weight 0.10000E+01 volume 0.21123E-04 ppm1 1.302 ppm2 7.502 CV 1
OR { 1685}
(( segid " " and resid 108 and name HB2 ))
(( segid " " and resid 110 and name HD21))
ASSI { 1688}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 110 and name HD21))
6.000 5.700 0.000 peak 1688 spectrum 1 weight 0.10000E+01 volume 0.18489E-04 ppm1 5.073 ppm2 7.508 CV 1
OR { 1688}
(( segid " " and resid 42 and name HA ))
( segid " " and resid 38 and name HD% )
ASSI { 1695}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 109 and name HN ))
6.000 6.000 0.000 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.14167E-04 ppm1 0.511 ppm2 9.072 CV 1
OR { 1695}
( segid " " and resid 5 and name HG2%)
(( segid " " and resid 24 and name HN ))
ASSI { 1709}
(( segid " " and resid 54 and name HB1 ))
(( segid " " and resid 74 and name HN ))
6.000 6.000 0.000 peak 1709 spectrum 1 weight 0.10000E+01 volume 0.72113E-05 ppm1 2.156 ppm2 9.598 CV 1
OR { 1709}
(( segid " " and resid 55 and name HB2 ))
(( segid " " and resid 74 and name HN ))
ASSI { 2}
(( segid " " and resid 19 and name HA1 ))
(( segid " " and resid 2 and name HB1 ))
2.100 2.100 3.900 peak 2 spectrum 1 weight 0.10000E+01 volume 0.38864E-01 ppm1 4.303 ppm2 3.698 CV 1
OR { 2}
(( segid " " and resid 40 and name HA1 ))
(( segid " " and resid 100 and name HB2 ))
ASSI { 9}
( segid " " and resid 24 and name HG2%)
( segid " " and resid 24 and name HD1%)
1.900 0.400 0.400 peak 9 spectrum 1 weight 0.10000E+01 volume 0.15655E-01 ppm1 0.133 ppm2 0.587 CV 1
OR { 9}
( segid " " and resid 24 and name HG2%)
( segid " " and resid 85 and name HG1%)
ASSI { 36}
(( segid " " and resid 82 and name HA ))
( segid " " and resid 82 and name HG2%)
2.100 0.600 0.600 peak 36 spectrum 1 weight 0.10000E+01 volume 0.10302E-01 ppm1 4.900 ppm2 0.931 CV 1
OR { 36}
(( segid " " and resid 76 and name HA ))
( segid " " and resid 76 and name HG2%)
ASSI { 44}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HG ))
2.200 0.600 0.600 peak 44 spectrum 1 weight 0.10000E+01 volume 0.92289E-02 ppm1 0.908 ppm2 1.560 CV 1
OR { 44}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 64 and name HG ))
ASSI { 159}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 64 and name HA ))
2.900 2.900 3.100 peak 159 spectrum 1 weight 0.10000E+01 volume 0.47404E-02 ppm1 1.926 ppm2 4.305 CV 1
OR { 159}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 62 and name HA ))
ASSI { 511}
(( segid " " and resid 26 and name HB2 ))
( segid " " and resid 73 and name HD% )
3.200 1.300 1.300 peak 511 spectrum 1 weight 0.10000E+01 volume 0.16750E-02 ppm1 0.411 ppm2 6.913 CV 1
OR { 511}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 36 and name HZ2 ))
ASSI { 562}
(( segid " " and resid 91 and name HG1 ))
(( segid " " and resid 90 and name HB1 ))
6.000 6.000 0.000 peak 562 spectrum 1 weight 0.10000E+01 volume 0.11277E-04 ppm1 0.372 ppm2 1.732 CV 1
OR { 562}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 7 and name HB2 ))
ASSI { 706}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 48 and name HB1 ))
3.500 1.600 1.600 peak 706 spectrum 1 weight 0.10000E+01 volume 0.92074E-03 ppm1 1.252 ppm2 1.942 CV 1
OR { 706}
( segid " " and resid 52 and name HG2%)
(( segid " " and resid 54 and name HB2 ))
ASSI { 755}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HZ2 ))
3.900 1.900 1.900 peak 755 spectrum 1 weight 0.10000E+01 volume 0.77291E-03 ppm1 3.127 ppm2 6.920 CV 1
OR { 755}
(( segid " " and resid 36 and name HB1 ))
( segid " " and resid 57 and name HE% )
ASSI { 868}
(( segid " " and resid 91 and name HA ))
(( segid " " and resid 93 and name HZ3 ))
4.300 2.400 1.700 peak 868 spectrum 1 weight 0.10000E+01 volume 0.50798E-03 ppm1 4.323 ppm2 7.153 CV 1
OR { 868}
(( segid " " and resid 91 and name HA ))
( segid " " and resid 34 and name HE% )
ASSI { 900}
(( segid " " and resid 26 and name HG ))
(( segid " " and resid 36 and name HZ2 ))
4.100 2.100 1.900 peak 900 spectrum 1 weight 0.10000E+01 volume 0.45105E-03 ppm1 0.382 ppm2 6.913 CV 1
OR { 900}
(( segid " " and resid 26 and name HG ))
( segid " " and resid 73 and name HD% )
ASSI { 904}
(( segid " " and resid 46 and name HD2 ))
( segid " " and resid 109 and name HB% )
4.200 2.300 1.800 peak 904 spectrum 1 weight 0.10000E+01 volume 0.44120E-03 ppm1 2.668 ppm2 1.318 CV 1
OR { 904}
(( segid " " and resid 46 and name HD2 ))
( segid " " and resid 53 and name HG1%)
ASSI { 977}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 87 and name HB2 ))
5.000 3.100 1.000 peak 977 spectrum 1 weight 0.10000E+01 volume 0.32077E-03 ppm1 3.475 ppm2 1.245 CV 1
OR { 977}
(( segid " " and resid 38 and name HB1 ))
( segid " " and resid 42 and name HG2%)
ASSI { 1010}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 38 and name HB2 ))
5.500 3.800 0.500 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.28355E-03 ppm1 1.242 ppm2 3.148 CV 1
OR { 1010}
(( segid " " and resid 87 and name HB2 ))
(( segid " " and resid 10 and name HB1 ))
ASSI { 1104}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 60 and name HG1 ))
5.300 3.500 0.700 peak 1104 spectrum 1 weight 0.10000E+01 volume 0.16750E-03 ppm1 4.122 ppm2 2.016 CV 1
OR { 1104}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 71 and name HB1 ))
ASSI { 1128}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 27 and name HG2 ))
5.400 3.600 0.600 peak 1128 spectrum 1 weight 0.10000E+01 volume 0.13576E-03 ppm1 0.521 ppm2 2.023 CV 1
OR { 1128}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 71 and name HB1 ))
ASSI { 130}
(( segid " " and resid 36 and name HZ3 ))
(( segid " " and resid 102 and name HB1 ))
3.500 1.600 1.600 peak 130 spectrum 1 weight 0.10000E+01 volume 0.98185E-03 ppm1 6.760 ppm2 1.970 CV 1
OR { 130}
(( segid " " and resid 36 and name HH2 ))
(( segid " " and resid 101 and name HB1 ))
ASSI { 152}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 23 and name HB2 ))
3.200 1.300 1.300 peak 152 spectrum 1 weight 0.10000E+01 volume 0.30459E-02 ppm1 8.943 ppm2 1.779 CV 1
OR { 152}
(( segid " " and resid 5 and name HN ))
(( segid " " and resid 24 and name HB ))
ASSI { 555}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 87 and name HB2 ))
6.000 5.700 0.000 peak 555 spectrum 1 weight 0.10000E+01 volume 0.29997E-04 ppm1 9.105 ppm2 1.274 CV 1
OR { 555}
(( segid " " and resid 37 and name HN ))
( segid " " and resid 35 and name HB% )
ASSI { 560}
(( segid " " and resid 74 and name HN ))
( segid " " and resid 53 and name HG1%)
6.000 6.000 0.000 peak 560 spectrum 1 weight 0.10000E+01 volume 0.81915E-05 ppm1 9.597 ppm2 1.334 CV 1
OR { 560}
(( segid " " and resid 74 and name HN ))
(( segid " " and resid 25 and name HB2 ))