NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
11475 |
1rjt   |
6038 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 9}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 43 and name HG2%)
3.900 1.900 1.900 peak 9 spectrum 1 weight 0.10000E+01 volume 0.97073E-03 ppm1 9.412 ppm2 0.860 CV 1
ASSI { 16}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 43 and name HB ))
2.800 1.000 1.000 peak 16 spectrum 1 weight 0.10000E+01 volume 0.24490E-02 ppm1 9.412 ppm2 2.038 CV 1
ASSI { 19}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 52 and name HB1 ))
2.900 1.000 1.000 peak 19 spectrum 1 weight 0.10000E+01 volume 0.18764E-02 ppm1 9.407 ppm2 1.425 CV 1
ASSI { 20}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 24 and name HA ))
2.400 0.700 0.700 peak 20 spectrum 1 weight 0.10000E+01 volume 0.37046E-02 ppm1 9.248 ppm2 3.626 CV 1
ASSI { 24}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 44 and name HG2%)
3.200 1.200 1.200 peak 24 spectrum 1 weight 0.10000E+01 volume 0.86062E-03 ppm1 9.252 ppm2 1.307 CV 1
ASSI { 29}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 45 and name HA ))
3.100 1.200 1.200 peak 29 spectrum 1 weight 0.10000E+01 volume 0.67627E-03 ppm1 9.248 ppm2 4.990 CV 1
ASSI { 32}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 24 and name HG2%)
3.200 1.300 1.300 peak 32 spectrum 1 weight 0.10000E+01 volume 0.16730E-02 ppm1 9.251 ppm2 0.687 CV 1
ASSI { 33}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 43 and name HG2%)
3.900 1.900 1.900 peak 33 spectrum 1 weight 0.10000E+01 volume 0.14802E-02 ppm1 9.250 ppm2 0.862 CV 1
ASSI { 35}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 26 and name HN ))
2.700 0.900 0.900 peak 35 spectrum 1 weight 0.10000E+01 volume 0.20811E-02 ppm1 9.251 ppm2 7.744 CV 1
ASSI { 36}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HB2 ))
2.800 1.000 1.000 peak 36 spectrum 1 weight 0.10000E+01 volume 0.22910E-02 ppm1 9.248 ppm2 1.776 CV 1
OR { 36}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 25 and name HB1 ))
ASSI { 48}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HB ))
3.700 1.700 1.700 peak 48 spectrum 1 weight 0.10000E+01 volume 0.89294E-03 ppm1 9.132 ppm2 1.845 CV 1
ASSI { 49}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 41 and name HB ))
2.800 1.000 1.000 peak 49 spectrum 1 weight 0.10000E+01 volume 0.16945E-02 ppm1 9.169 ppm2 2.201 CV 1
ASSI { 51}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB1 ))
2.800 1.000 1.000 peak 51 spectrum 1 weight 0.10000E+01 volume 0.22048E-02 ppm1 9.071 ppm2 2.120 CV 1
OR { 51}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 52}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HG1 ))
3.500 1.500 1.500 peak 52 spectrum 1 weight 0.10000E+01 volume 0.10996E-02 ppm1 9.169 ppm2 2.320 CV 1
ASSI { 54}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 43 and name HB ))
3.700 1.700 1.700 peak 54 spectrum 1 weight 0.10000E+01 volume 0.77642E-03 ppm1 9.172 ppm2 2.043 CV 1
ASSI { 58}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HB1 ))
2.600 0.900 0.900 peak 58 spectrum 1 weight 0.10000E+01 volume 0.31552E-02 ppm1 9.169 ppm2 1.446 CV 1
ASSI { 59}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HB2 ))
3.200 1.200 1.200 peak 59 spectrum 1 weight 0.10000E+01 volume 0.97153E-03 ppm1 9.176 ppm2 1.658 CV 1
ASSI { 62}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HG2 ))
4.100 2.100 1.900 peak 62 spectrum 1 weight 0.10000E+01 volume 0.58292E-03 ppm1 9.172 ppm2 1.582 CV 1
ASSI { 67}
(( segid " " and resid 19 and name HN ))
( segid " " and resid 19 and name HG1%)
3.100 1.200 1.200 peak 67 spectrum 1 weight 0.10000E+01 volume 0.22208E-02 ppm1 9.129 ppm2 0.714 CV 1
ASSI { 68}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 41 and name HG2%)
3.000 1.100 1.100 peak 68 spectrum 1 weight 0.10000E+01 volume 0.20205E-02 ppm1 9.169 ppm2 0.805 CV 1
ASSI { 71}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 43 and name HG2%)
2.800 1.000 1.000 peak 71 spectrum 1 weight 0.10000E+01 volume 0.12947E-02 ppm1 9.068 ppm2 0.860 CV 1
ASSI { 73}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 31 and name HN ))
2.500 2.500 3.500 peak 73 spectrum 1 weight 0.10000E+01 volume 0.11191E-02 ppm1 9.172 ppm2 8.365 CV 1
ASSI { 74}
(( segid " " and resid 19 and name HN ))
(( segid " " and resid 19 and name HA ))
3.300 1.400 1.400 peak 74 spectrum 1 weight 0.10000E+01 volume 0.72216E-03 ppm1 9.131 ppm2 4.311 CV 1
ASSI { 80}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HB1 ))
3.500 1.600 1.600 peak 80 spectrum 1 weight 0.10000E+01 volume 0.12580E-02 ppm1 9.062 ppm2 3.140 CV 1
ASSI { 82}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HN ))
3.200 1.300 1.300 peak 82 spectrum 1 weight 0.10000E+01 volume 0.99748E-03 ppm1 9.062 ppm2 10.538 CV 1
ASSI { 86}
(( segid " " and resid 30 and name HN ))
( segid " " and resid 29 and name HG2%)
3.400 1.400 1.400 peak 86 spectrum 1 weight 0.10000E+01 volume 0.99709E-03 ppm1 9.070 ppm2 0.391 CV 1
ASSI { 87}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 44 and name HB ))
3.000 1.100 1.100 peak 87 spectrum 1 weight 0.10000E+01 volume 0.15884E-02 ppm1 9.068 ppm2 3.992 CV 1
ASSI { 88}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 24 and name HA ))
4.600 2.600 1.400 peak 88 spectrum 1 weight 0.10000E+01 volume 0.45087E-03 ppm1 9.062 ppm2 3.624 CV 1
ASSI { 91}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HB2 ))
3.700 1.700 1.700 peak 91 spectrum 1 weight 0.10000E+01 volume 0.51628E-03 ppm1 9.003 ppm2 2.203 CV 1
OR { 91}
(( segid " " and resid 33 and name HN ))
(( segid " " and resid 32 and name HB1 ))
ASSI { 94}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HA ))
2.900 1.000 1.000 peak 94 spectrum 1 weight 0.10000E+01 volume 0.18924E-02 ppm1 8.793 ppm2 4.747 CV 1
ASSI { 96}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HA ))
3.000 1.100 1.100 peak 96 spectrum 1 weight 0.10000E+01 volume 0.11315E-02 ppm1 8.802 ppm2 4.781 CV 1
ASSI { 104}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 13 and name HA2 ))
2.800 2.800 3.200 peak 104 spectrum 1 weight 0.10000E+01 volume 0.51309E-03 ppm1 8.796 ppm2 4.280 CV 1
ASSI { 105}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 46 and name HA ))
2.600 2.600 3.400 peak 105 spectrum 1 weight 0.10000E+01 volume 0.48757E-02 ppm1 8.860 ppm2 4.272 CV 1
ASSI { 107}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HB2 ))
3.400 1.400 1.400 peak 107 spectrum 1 weight 0.10000E+01 volume 0.50471E-03 ppm1 8.824 ppm2 3.794 CV 1
ASSI { 111}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB2 ))
3.300 1.300 1.300 peak 111 spectrum 1 weight 0.10000E+01 volume 0.10884E-02 ppm1 8.793 ppm2 2.934 CV 1
ASSI { 112}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 37 and name HB1 ))
3.100 1.200 1.200 peak 112 spectrum 1 weight 0.10000E+01 volume 0.11766E-02 ppm1 8.775 ppm2 2.718 CV 1
ASSI { 120}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 43 and name HB ))
2.900 1.000 1.000 peak 120 spectrum 1 weight 0.10000E+01 volume 0.20396E-02 ppm1 8.866 ppm2 2.051 CV 1
ASSI { 121}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HB1 ))
4.000 2.000 2.000 peak 121 spectrum 1 weight 0.10000E+01 volume 0.74610E-03 ppm1 8.800 ppm2 1.446 CV 1
ASSI { 124}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 52 and name HG1 ))
2.600 0.900 0.900 peak 124 spectrum 1 weight 0.10000E+01 volume 0.53185E-02 ppm1 8.867 ppm2 1.540 CV 1
ASSI { 125}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 24 and name HB ))
2.900 1.100 1.100 peak 125 spectrum 1 weight 0.10000E+01 volume 0.42612E-02 ppm1 8.857 ppm2 1.959 CV 1
ASSI { 128}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 44 and name HG1 ))
2.800 1.000 1.000 peak 128 spectrum 1 weight 0.10000E+01 volume 0.30718E-02 ppm1 8.869 ppm2 1.280 CV 1
OR { 128}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 44 and name HG2%)
ASSI { 130}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB2 ))
3.500 1.500 1.500 peak 130 spectrum 1 weight 0.10000E+01 volume 0.11678E-02 ppm1 8.805 ppm2 3.586 CV 1
ASSI { 133}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 27 and name HA ))
2.400 0.700 0.700 peak 133 spectrum 1 weight 0.10000E+01 volume 0.26980E-02 ppm1 8.827 ppm2 5.221 CV 1
ASSI { 134}
(( segid " " and resid 28 and name HN ))
( segid " " and resid 27 and name HB% )
3.500 1.500 1.500 peak 134 spectrum 1 weight 0.10000E+01 volume 0.10338E-02 ppm1 8.827 ppm2 1.147 CV 1
ASSI { 135}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB1 ))
3.400 1.500 1.500 peak 135 spectrum 1 weight 0.10000E+01 volume 0.63999E-03 ppm1 8.802 ppm2 3.088 CV 1
ASSI { 136}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 52 and name HB2 ))
4.100 2.100 1.900 peak 136 spectrum 1 weight 0.10000E+01 volume 0.10781E-02 ppm1 8.803 ppm2 1.662 CV 1
ASSI { 137}
(( segid " " and resid 37 and name HN ))
(( segid " " and resid 38 and name HN ))
2.900 1.000 1.000 peak 137 spectrum 1 weight 0.10000E+01 volume 0.97553E-03 ppm1 8.793 ppm2 7.569 CV 1
ASSI { 143}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 43 and name HA ))
4.300 2.300 1.700 peak 143 spectrum 1 weight 0.10000E+01 volume 0.30136E-03 ppm1 8.763 ppm2 4.851 CV 1
ASSI { 147}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 42 and name HB ))
2.900 1.100 1.100 peak 147 spectrum 1 weight 0.10000E+01 volume 0.11323E-02 ppm1 8.750 ppm2 1.723 CV 1
ASSI { 149}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HA ))
2.400 0.700 0.700 peak 149 spectrum 1 weight 0.10000E+01 volume 0.45764E-02 ppm1 8.654 ppm2 4.310 CV 1
ASSI { 151}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 16 and name HB ))
2.600 0.800 0.800 peak 151 spectrum 1 weight 0.10000E+01 volume 0.13753E-02 ppm1 8.630 ppm2 2.374 CV 1
ASSI { 152}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HG1 ))
4.700 2.700 1.300 peak 152 spectrum 1 weight 0.10000E+01 volume 0.33834E-03 ppm1 8.647 ppm2 2.456 CV 1
ASSI { 153}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HG1 ))
4.500 2.500 1.500 peak 153 spectrum 1 weight 0.10000E+01 volume 0.49872E-03 ppm1 8.655 ppm2 1.378 CV 1
ASSI { 155}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 46 and name HN ))
3.700 1.700 1.700 peak 155 spectrum 1 weight 0.10000E+01 volume 0.18597E-02 ppm1 8.652 ppm2 8.288 CV 1
ASSI { 158}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HB1 ))
2.600 0.900 0.900 peak 158 spectrum 1 weight 0.10000E+01 volume 0.23189E-02 ppm1 8.648 ppm2 2.019 CV 1
ASSI { 159}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HB2 ))
2.900 1.100 1.100 peak 159 spectrum 1 weight 0.10000E+01 volume 0.21182E-02 ppm1 8.649 ppm2 2.158 CV 1
ASSI { 160}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HB2 ))
2.100 0.600 0.600 peak 160 spectrum 1 weight 0.10000E+01 volume 0.52508E-02 ppm1 8.652 ppm2 1.809 CV 1
OR { 160}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HB1 ))
ASSI { 166}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HG1 ))
3.700 1.700 1.700 peak 166 spectrum 1 weight 0.10000E+01 volume 0.62719E-03 ppm1 8.631 ppm2 1.616 CV 1
ASSI { 167}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 19 and name HG1%)
4.100 2.100 1.900 peak 167 spectrum 1 weight 0.10000E+01 volume 0.81393E-03 ppm1 8.652 ppm2 0.711 CV 1
ASSI { 168}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 16 and name HG1%)
3.700 1.700 1.700 peak 168 spectrum 1 weight 0.10000E+01 volume 0.22256E-02 ppm1 8.630 ppm2 0.832 CV 1
ASSI { 170}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 60 and name HA ))
2.900 1.100 1.100 peak 170 spectrum 1 weight 0.10000E+01 volume 0.13159E-02 ppm1 8.648 ppm2 4.010 CV 1
ASSI { 171}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 18 and name HN ))
3.100 1.200 1.200 peak 171 spectrum 1 weight 0.10000E+01 volume 0.83949E-03 ppm1 8.630 ppm2 7.363 CV 1
ASSI { 172}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 16 and name HG2%)
4.600 2.600 1.400 peak 172 spectrum 1 weight 0.10000E+01 volume 0.34413E-03 ppm1 8.630 ppm2 1.051 CV 1
ASSI { 175}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 53 and name HB1 ))
4.300 2.400 1.700 peak 175 spectrum 1 weight 0.10000E+01 volume 0.67589E-03 ppm1 8.540 ppm2 3.080 CV 1
ASSI { 176}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 61 and name HA ))
4.400 2.400 1.600 peak 176 spectrum 1 weight 0.10000E+01 volume 0.33220E-03 ppm1 8.420 ppm2 3.827 CV 1
ASSI { 177}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 62 and name HA ))
3.600 1.600 1.600 peak 177 spectrum 1 weight 0.10000E+01 volume 0.49676E-03 ppm1 8.421 ppm2 3.938 CV 1
ASSI { 178}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HA1 ))
2.500 0.800 0.800 peak 178 spectrum 1 weight 0.10000E+01 volume 0.31289E-02 ppm1 8.512 ppm2 3.814 CV 1
ASSI { 179}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA1 ))
2.300 0.700 0.700 peak 179 spectrum 1 weight 0.10000E+01 volume 0.71059E-02 ppm1 8.503 ppm2 3.904 CV 1
OR { 179}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 15 and name HA2 ))
ASSI { 180}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HB2 ))
4.100 2.200 1.900 peak 180 spectrum 1 weight 0.10000E+01 volume 0.61205E-03 ppm1 8.457 ppm2 3.796 CV 1
ASSI { 185}
(( segid " " and resid 12 and name HN ))
( segid " " and resid 12 and name HG2%)
2.800 1.000 1.000 peak 185 spectrum 1 weight 0.10000E+01 volume 0.30291E-02 ppm1 8.285 ppm2 0.904 CV 1
ASSI { 186}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 21 and name HG1%)
2.900 1.100 1.100 peak 186 spectrum 1 weight 0.10000E+01 volume 0.22068E-02 ppm1 8.371 ppm2 1.052 CV 1
OR { 186}
(( segid " " and resid 21 and name HN ))
( segid " " and resid 21 and name HG2%)
ASSI { 192}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 64 and name HG2%)
4.000 2.000 2.000 peak 192 spectrum 1 weight 0.10000E+01 volume 0.48915E-03 ppm1 8.419 ppm2 0.728 CV 1
ASSI { 193}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 41 and name HG2%)
3.600 1.600 1.600 peak 193 spectrum 1 weight 0.10000E+01 volume 0.11802E-02 ppm1 8.540 ppm2 0.813 CV 1
ASSI { 194}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HA ))
2.700 0.900 0.900 peak 194 spectrum 1 weight 0.10000E+01 volume 0.18174E-02 ppm1 8.515 ppm2 4.211 CV 1
ASSI { 196}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HB2 ))
2.400 0.700 0.700 peak 196 spectrum 1 weight 0.10000E+01 volume 0.30945E-02 ppm1 8.542 ppm2 1.499 CV 1
ASSI { 198}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 41 and name HB ))
3.300 1.400 1.400 peak 198 spectrum 1 weight 0.10000E+01 volume 0.75048E-03 ppm1 8.542 ppm2 2.200 CV 1
ASSI { 199}
(( segid " " and resid 54 and name HN ))
(( segid " " and resid 54 and name HB1 ))
3.200 1.300 1.300 peak 199 spectrum 1 weight 0.10000E+01 volume 0.16323E-02 ppm1 8.543 ppm2 1.217 CV 1
ASSI { 200}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 16 and name HB ))
3.800 1.900 1.900 peak 200 spectrum 1 weight 0.10000E+01 volume 0.64076E-03 ppm1 8.507 ppm2 2.374 CV 1
ASSI { 204}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 49 and name HB1 ))
3.200 1.200 1.200 peak 204 spectrum 1 weight 0.10000E+01 volume 0.22148E-02 ppm1 8.513 ppm2 1.801 CV 1
ASSI { 205}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 68 and name HG1%)
3.500 1.500 1.500 peak 205 spectrum 1 weight 0.10000E+01 volume 0.65233E-03 ppm1 8.454 ppm2 1.052 CV 1
OR { 205}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 68 and name HG2%)
ASSI { 206}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 27 and name HB% )
2.800 0.900 0.900 peak 206 spectrum 1 weight 0.10000E+01 volume 0.16127E-02 ppm1 8.454 ppm2 1.147 CV 1
ASSI { 207}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 16 and name HG2%)
2.800 1.000 1.000 peak 207 spectrum 1 weight 0.10000E+01 volume 0.17986E-02 ppm1 8.506 ppm2 1.051 CV 1
ASSI { 209}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 50 and name HA2 ))
3.600 1.600 1.600 peak 209 spectrum 1 weight 0.10000E+01 volume 0.58811E-03 ppm1 8.512 ppm2 4.459 CV 1
ASSI { 213}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HA ))
3.000 1.100 1.100 peak 213 spectrum 1 weight 0.10000E+01 volume 0.12604E-02 ppm1 7.906 ppm2 3.938 CV 1
ASSI { 215}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 22 and name HA ))
2.900 1.000 1.000 peak 215 spectrum 1 weight 0.10000E+01 volume 0.19566E-02 ppm1 8.222 ppm2 4.178 CV 1
ASSI { 218}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 36 and name HB1 ))
2.900 1.000 1.000 peak 218 spectrum 1 weight 0.10000E+01 volume 0.47439E-02 ppm1 8.277 ppm2 3.945 CV 1
ASSI { 225}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 36 and name HB1 ))
3.900 1.900 1.900 peak 225 spectrum 1 weight 0.10000E+01 volume 0.18066E-02 ppm1 8.088 ppm2 3.938 CV 1
ASSI { 227}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA2 ))
2.600 0.800 0.800 peak 227 spectrum 1 weight 0.10000E+01 volume 0.43931E-02 ppm1 8.240 ppm2 3.900 CV 1
OR { 227}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 15 and name HA1 ))
ASSI { 231}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 68 and name HA ))
3.000 1.100 1.100 peak 231 spectrum 1 weight 0.10000E+01 volume 0.13334E-02 ppm1 8.036 ppm2 4.076 CV 1
ASSI { 237}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 12 and name HA ))
2.500 0.800 0.800 peak 237 spectrum 1 weight 0.10000E+01 volume 0.43169E-02 ppm1 8.303 ppm2 4.235 CV 1
ASSI { 239}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 13 and name HA1 ))
2.700 0.900 0.900 peak 239 spectrum 1 weight 0.10000E+01 volume 0.31297E-02 ppm1 8.302 ppm2 4.027 CV 1
ASSI { 242}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 50 and name HA1 ))
2.800 1.000 1.000 peak 242 spectrum 1 weight 0.10000E+01 volume 0.17950E-02 ppm1 8.305 ppm2 3.804 CV 1
ASSI { 247}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HA ))
3.500 1.500 1.500 peak 247 spectrum 1 weight 0.10000E+01 volume 0.74410E-03 ppm1 7.838 ppm2 4.135 CV 1
ASSI { 249}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HD2 ))
3.600 1.600 1.600 peak 249 spectrum 1 weight 0.10000E+01 volume 0.65951E-03 ppm1 8.242 ppm2 3.777 CV 1
ASSI { 257}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HA ))
3.000 1.100 1.100 peak 257 spectrum 1 weight 0.10000E+01 volume 0.12520E-02 ppm1 8.420 ppm2 3.615 CV 1
ASSI { 258}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HA ))
3.400 1.400 1.400 peak 258 spectrum 1 weight 0.10000E+01 volume 0.50871E-03 ppm1 8.418 ppm2 3.666 CV 1
ASSI { 260}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB1 ))
2.300 0.600 0.600 peak 260 spectrum 1 weight 0.10000E+01 volume 0.50152E-02 ppm1 7.811 ppm2 1.958 CV 1
OR { 260}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 263}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HB ))
3.000 1.100 1.100 peak 263 spectrum 1 weight 0.10000E+01 volume 0.14635E-02 ppm1 8.453 ppm2 1.719 CV 1
ASSI { 266}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HB1 ))
2.700 0.900 0.900 peak 266 spectrum 1 weight 0.10000E+01 volume 0.23871E-02 ppm1 8.177 ppm2 2.125 CV 1
OR { 266}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HB2 ))
ASSI { 268}
(( segid " " and resid 22 and name HN ))
( segid " " and resid 22 and name HB% )
2.300 0.700 0.700 peak 268 spectrum 1 weight 0.10000E+01 volume 0.70702E-02 ppm1 8.221 ppm2 1.389 CV 1
ASSI { 272}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HG12))
3.100 1.200 1.200 peak 272 spectrum 1 weight 0.10000E+01 volume 0.14104E-02 ppm1 8.277 ppm2 1.172 CV 1
OR { 272}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HG11))
ASSI { 277}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 65 and name HB ))
2.200 0.600 0.600 peak 277 spectrum 1 weight 0.10000E+01 volume 0.53546E-02 ppm1 8.419 ppm2 1.829 CV 1
ASSI { 280}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HG2 ))
3.200 1.300 1.300 peak 280 spectrum 1 weight 0.10000E+01 volume 0.20340E-02 ppm1 8.005 ppm2 1.424 CV 1
ASSI { 285}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 62 and name HB2 ))
2.300 0.700 0.700 peak 285 spectrum 1 weight 0.10000E+01 volume 0.31620E-02 ppm1 7.906 ppm2 1.949 CV 1
ASSI { 288}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 12 and name HB ))
2.600 0.900 0.900 peak 288 spectrum 1 weight 0.10000E+01 volume 0.51909E-02 ppm1 8.272 ppm2 1.877 CV 1
ASSI { 293}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 20 and name HB1 ))
2.900 1.000 1.000 peak 293 spectrum 1 weight 0.10000E+01 volume 0.24199E-02 ppm1 8.224 ppm2 1.807 CV 1
OR { 293}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 302}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HB1 ))
3.200 1.300 1.300 peak 302 spectrum 1 weight 0.10000E+01 volume 0.11156E-02 ppm1 8.370 ppm2 1.808 CV 1
OR { 302}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 305}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HG1 ))
4.200 2.200 1.800 peak 305 spectrum 1 weight 0.10000E+01 volume 0.11096E-02 ppm1 7.966 ppm2 1.657 CV 1
OR { 305}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HG2 ))
ASSI { 306}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 70 and name HB2 ))
2.800 1.000 1.000 peak 306 spectrum 1 weight 0.10000E+01 volume 0.10697E-02 ppm1 7.957 ppm2 1.936 CV 1
ASSI { 312}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HG11))
3.700 1.700 1.700 peak 312 spectrum 1 weight 0.10000E+01 volume 0.85025E-03 ppm1 8.447 ppm2 1.655 CV 1
OR { 312}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HG12))
ASSI { 319}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HG12))
3.800 1.800 1.800 peak 319 spectrum 1 weight 0.10000E+01 volume 0.73934E-03 ppm1 8.457 ppm2 1.363 CV 1
OR { 319}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 29 and name HG11))
ASSI { 324}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HN ))
2.700 0.900 0.900 peak 324 spectrum 1 weight 0.10000E+01 volume 0.16925E-02 ppm1 8.419 ppm2 7.834 CV 1
ASSI { 325}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HN ))
2.800 1.000 1.000 peak 325 spectrum 1 weight 0.10000E+01 volume 0.22064E-02 ppm1 8.454 ppm2 7.766 CV 1
ASSI { 327}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HB1 ))
3.200 1.200 1.200 peak 327 spectrum 1 weight 0.10000E+01 volume 0.97115E-03 ppm1 8.444 ppm2 2.115 CV 1
OR { 327}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 333}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 21 and name HA ))
3.000 1.100 1.100 peak 333 spectrum 1 weight 0.10000E+01 volume 0.13258E-02 ppm1 8.371 ppm2 3.538 CV 1
ASSI { 335}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 14 and name HG2 ))
3.800 1.800 1.800 peak 335 spectrum 1 weight 0.10000E+01 volume 0.66432E-03 ppm1 8.280 ppm2 2.334 CV 1
ASSI { 337}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 37 and name HN ))
3.300 1.400 1.400 peak 337 spectrum 1 weight 0.10000E+01 volume 0.96316E-03 ppm1 8.270 ppm2 8.790 CV 1
ASSI { 339}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HA ))
2.200 0.600 0.600 peak 339 spectrum 1 weight 0.10000E+01 volume 0.29214E-02 ppm1 8.294 ppm2 4.992 CV 1
ASSI { 345}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 24 and name HA ))
3.600 1.600 1.600 peak 345 spectrum 1 weight 0.10000E+01 volume 0.16594E-02 ppm1 8.283 ppm2 3.624 CV 1
ASSI { 346}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 25 and name HN ))
3.000 1.100 1.100 peak 346 spectrum 1 weight 0.10000E+01 volume 0.23333E-02 ppm1 8.289 ppm2 9.242 CV 1
ASSI { 347}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 11 and name HB2 ))
3.600 1.600 1.600 peak 347 spectrum 1 weight 0.10000E+01 volume 0.83987E-03 ppm1 8.279 ppm2 3.197 CV 1
ASSI { 356}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HG2 ))
3.000 1.100 1.100 peak 356 spectrum 1 weight 0.10000E+01 volume 0.83349E-03 ppm1 8.176 ppm2 2.523 CV 1
ASSI { 358}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HB2 ))
2.700 0.900 0.900 peak 358 spectrum 1 weight 0.10000E+01 volume 0.28600E-02 ppm1 8.095 ppm2 2.738 CV 1
ASSI { 364}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 34 and name HN ))
2.700 0.900 0.900 peak 364 spectrum 1 weight 0.10000E+01 volume 0.18302E-02 ppm1 8.091 ppm2 7.262 CV 1
ASSI { 365}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HB1 ))
2.800 1.000 1.000 peak 365 spectrum 1 weight 0.10000E+01 volume 0.21222E-02 ppm1 8.089 ppm2 2.558 CV 1
ASSI { 374}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 39 and name HG2%)
2.900 1.100 1.100 peak 374 spectrum 1 weight 0.10000E+01 volume 0.18066E-02 ppm1 8.018 ppm2 0.723 CV 1
ASSI { 375}
(( segid " " and resid 68 and name HN ))
( segid " " and resid 68 and name HG1%)
2.700 0.900 0.900 peak 375 spectrum 1 weight 0.10000E+01 volume 0.24510E-02 ppm1 8.039 ppm2 1.046 CV 1
OR { 375}
(( segid " " and resid 68 and name HN ))
( segid " " and resid 68 and name HG2%)
ASSI { 380}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HB1 ))
3.700 1.700 1.700 peak 380 spectrum 1 weight 0.10000E+01 volume 0.78361E-03 ppm1 7.960 ppm2 2.123 CV 1
OR { 380}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 69 and name HB2 ))
ASSI { 383}
(( segid " " and resid 62 and name HN ))
( segid " " and resid 61 and name HB% )
3.000 1.100 1.100 peak 383 spectrum 1 weight 0.10000E+01 volume 0.19866E-02 ppm1 7.906 ppm2 1.426 CV 1
ASSI { 386}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 61 and name HA ))
3.600 1.600 1.600 peak 386 spectrum 1 weight 0.10000E+01 volume 0.44526E-03 ppm1 7.905 ppm2 3.808 CV 1
ASSI { 389}
(( segid " " and resid 64 and name HN ))
( segid " " and resid 64 and name HD1%)
3.700 1.700 1.700 peak 389 spectrum 1 weight 0.10000E+01 volume 0.65875E-03 ppm1 7.837 ppm2 0.624 CV 1
ASSI { 390}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HA ))
2.800 1.000 1.000 peak 390 spectrum 1 weight 0.10000E+01 volume 0.12045E-02 ppm1 7.840 ppm2 3.664 CV 1
ASSI { 391}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 64 and name HA ))
3.500 1.600 1.600 peak 391 spectrum 1 weight 0.10000E+01 volume 0.51547E-03 ppm1 7.815 ppm2 3.662 CV 1
ASSI { 392}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 61 and name HA ))
3.400 1.400 1.400 peak 392 spectrum 1 weight 0.10000E+01 volume 0.62081E-03 ppm1 7.839 ppm2 3.812 CV 1
ASSI { 393}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HG12))
3.100 1.200 1.200 peak 393 spectrum 1 weight 0.10000E+01 volume 0.96635E-03 ppm1 7.841 ppm2 1.044 CV 1
OR { 393}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HG11))
ASSI { 396}
(( segid " " and resid 61 and name HN ))
( segid " " and resid 61 and name HB% )
2.300 0.600 0.600 peak 396 spectrum 1 weight 0.10000E+01 volume 0.49353E-02 ppm1 7.742 ppm2 1.427 CV 1
ASSI { 398}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 44 and name HN ))
2.500 0.800 0.800 peak 398 spectrum 1 weight 0.10000E+01 volume 0.74372E-03 ppm1 7.749 ppm2 9.064 CV 1
ASSI { 402}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HB2 ))
4.500 2.500 1.500 peak 402 spectrum 1 weight 0.10000E+01 volume 0.47358E-03 ppm1 7.740 ppm2 2.155 CV 1
ASSI { 404}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HN ))
2.600 0.800 0.800 peak 404 spectrum 1 weight 0.10000E+01 volume 0.96635E-03 ppm1 7.742 ppm2 8.643 CV 1
ASSI { 405}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 61 and name HA ))
2.900 1.000 1.000 peak 405 spectrum 1 weight 0.10000E+01 volume 0.11040E-02 ppm1 7.743 ppm2 3.811 CV 1
ASSI { 406}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HB1 ))
2.800 1.000 1.000 peak 406 spectrum 1 weight 0.10000E+01 volume 0.49995E-02 ppm1 7.666 ppm2 2.671 CV 1
ASSI { 409}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB2 ))
4.100 2.100 1.900 peak 409 spectrum 1 weight 0.10000E+01 volume 0.63438E-03 ppm1 7.578 ppm2 2.937 CV 1
ASSI { 411}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 23 and name HB2 ))
2.500 0.800 0.800 peak 411 spectrum 1 weight 0.10000E+01 volume 0.20237E-02 ppm1 7.667 ppm2 2.974 CV 1
ASSI { 414}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HA ))
3.700 1.700 1.700 peak 414 spectrum 1 weight 0.10000E+01 volume 0.53903E-03 ppm1 7.649 ppm2 3.938 CV 1
ASSI { 415}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 60 and name HA ))
3.700 1.700 1.700 peak 415 spectrum 1 weight 0.10000E+01 volume 0.41335E-03 ppm1 7.651 ppm2 4.014 CV 1
ASSI { 417}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HB1 ))
3.300 1.300 1.300 peak 417 spectrum 1 weight 0.10000E+01 volume 0.18617E-02 ppm1 7.651 ppm2 1.669 CV 1
ASSI { 418}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HB ))
2.600 0.900 0.900 peak 418 spectrum 1 weight 0.10000E+01 volume 0.32474E-02 ppm1 7.640 ppm2 1.824 CV 1
ASSI { 424}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 65 and name HA ))
3.600 1.600 1.600 peak 424 spectrum 1 weight 0.10000E+01 volume 0.70383E-03 ppm1 7.638 ppm2 3.615 CV 1
ASSI { 426}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HG1 ))
2.900 1.100 1.100 peak 426 spectrum 1 weight 0.10000E+01 volume 0.18409E-02 ppm1 7.574 ppm2 1.353 CV 1
ASSI { 427}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HG2 ))
2.700 0.900 0.900 peak 427 spectrum 1 weight 0.10000E+01 volume 0.22591E-02 ppm1 7.575 ppm2 1.433 CV 1
ASSI { 428}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HB1 ))
3.600 1.600 1.600 peak 428 spectrum 1 weight 0.10000E+01 volume 0.81674E-03 ppm1 7.567 ppm2 2.736 CV 1
ASSI { 433}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB2 ))
2.900 1.000 1.000 peak 433 spectrum 1 weight 0.10000E+01 volume 0.15154E-02 ppm1 7.575 ppm2 1.870 CV 1
ASSI { 439}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HB1 ))
3.000 1.100 1.100 peak 439 spectrum 1 weight 0.10000E+01 volume 0.14399E-02 ppm1 7.486 ppm2 1.768 CV 1
OR { 439}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 25 and name HB2 ))
ASSI { 441}
(( segid " " and resid 24 and name HN ))
( segid " " and resid 24 and name HD1%)
3.300 1.400 1.400 peak 441 spectrum 1 weight 0.10000E+01 volume 0.13749E-02 ppm1 7.491 ppm2 0.607 CV 1
ASSI { 443}
(( segid " " and resid 24 and name HN ))
( segid " " and resid 24 and name HG2%)
3.700 1.700 1.700 peak 443 spectrum 1 weight 0.10000E+01 volume 0.75329E-03 ppm1 7.491 ppm2 0.688 CV 1
ASSI { 444}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HB ))
2.400 0.700 0.700 peak 444 spectrum 1 weight 0.10000E+01 volume 0.61486E-02 ppm1 7.492 ppm2 1.938 CV 1
ASSI { 445}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 24 and name HA ))
3.100 1.200 1.200 peak 445 spectrum 1 weight 0.10000E+01 volume 0.98991E-03 ppm1 7.490 ppm2 3.626 CV 1
ASSI { 446}
(( segid " " and resid 24 and name HN ))
(( segid " " and resid 23 and name HB1 ))
3.500 1.500 1.500 peak 446 spectrum 1 weight 0.10000E+01 volume 0.69745E-03 ppm1 7.487 ppm2 2.671 CV 1
ASSI { 450}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 18 and name HB% )
3.100 1.200 1.200 peak 450 spectrum 1 weight 0.10000E+01 volume 0.17049E-02 ppm1 7.368 ppm2 1.326 CV 1
ASSI { 455}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HA ))
3.500 1.500 1.500 peak 455 spectrum 1 weight 0.10000E+01 volume 0.74890E-03 ppm1 7.368 ppm2 4.241 CV 1
ASSI { 456}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HB2 ))
3.700 1.700 1.700 peak 456 spectrum 1 weight 0.10000E+01 volume 0.57097E-03 ppm1 7.366 ppm2 1.918 CV 1
OR { 456}
(( segid " " and resid 18 and name HN ))
(( segid " " and resid 17 and name HB1 ))
ASSI { 459}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HB2 ))
3.400 1.500 1.500 peak 459 spectrum 1 weight 0.10000E+01 volume 0.11531E-02 ppm1 7.260 ppm2 3.131 CV 1
ASSI { 461}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 31 and name HB2 ))
3.100 1.200 1.200 peak 461 spectrum 1 weight 0.10000E+01 volume 0.11056E-02 ppm1 7.215 ppm2 3.217 CV 1
ASSI { 463}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 31 and name HB2 ))
2.700 2.700 3.300 peak 463 spectrum 1 weight 0.10000E+01 volume 0.69502E-03 ppm1 7.267 ppm2 3.207 CV 1
ASSI { 467}
(( segid " " and resid 34 and name HN ))
( segid " " and resid 39 and name HG2%)
3.700 3.700 2.300 peak 467 spectrum 1 weight 0.10000E+01 volume 0.91927E-03 ppm1 7.264 ppm2 0.740 CV 1
ASSI { 469}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 32 and name HB2 ))
3.100 1.200 1.200 peak 469 spectrum 1 weight 0.10000E+01 volume 0.10809E-02 ppm1 7.261 ppm2 2.227 CV 1
OR { 469}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 32 and name HB1 ))
ASSI { 470}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HA ))
3.500 1.500 1.500 peak 470 spectrum 1 weight 0.10000E+01 volume 0.53822E-03 ppm1 7.263 ppm2 4.742 CV 1
ASSI { 473}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 35 and name HB1 ))
4.000 2.000 2.000 peak 473 spectrum 1 weight 0.10000E+01 volume 0.70383E-03 ppm1 7.264 ppm2 2.556 CV 1
ASSI { 474}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 36 and name HN ))
3.600 1.600 1.600 peak 474 spectrum 1 weight 0.10000E+01 volume 0.12915E-02 ppm1 7.264 ppm2 8.272 CV 1
ASSI { 475}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 40 and name HG1 ))
2.700 2.700 3.300 peak 475 spectrum 1 weight 0.10000E+01 volume 0.72658E-03 ppm1 7.259 ppm2 2.328 CV 1
ASSI { 477}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 32 and name HD2 ))
3.600 1.600 1.600 peak 477 spectrum 1 weight 0.10000E+01 volume 0.49076E-03 ppm1 7.215 ppm2 3.870 CV 1
ASSI { 481}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HA ))
2.900 1.100 1.100 peak 481 spectrum 1 weight 0.10000E+01 volume 0.12133E-02 ppm1 7.127 ppm2 4.207 CV 1
ASSI { 483}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HB1 ))
2.800 1.000 1.000 peak 483 spectrum 1 weight 0.10000E+01 volume 0.25851E-02 ppm1 7.129 ppm2 1.796 CV 1
ASSI { 488}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 49 and name HB2 ))
3.200 1.300 1.300 peak 488 spectrum 1 weight 0.10000E+01 volume 0.93003E-03 ppm1 7.129 ppm2 1.962 CV 1
ASSI { 489}
(( segid " " and resid 49 and name HN ))
(( segid " " and resid 50 and name HN ))
3.500 1.500 1.500 peak 489 spectrum 1 weight 0.10000E+01 volume 0.87576E-03 ppm1 7.126 ppm2 8.507 CV 1
ASSI { 518}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name HN ))
2.500 0.800 0.800 peak 518 spectrum 1 weight 0.10000E+01 volume 0.31664E-02 ppm1 5.571 ppm2 9.168 CV 1
ASSI { 520}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 52 and name HB2 ))
3.700 1.700 1.700 peak 520 spectrum 1 weight 0.10000E+01 volume 0.98991E-03 ppm1 5.579 ppm2 1.659 CV 1
ASSI { 523}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB1 ))
2.600 0.800 0.800 peak 523 spectrum 1 weight 0.10000E+01 volume 0.25148E-02 ppm1 5.573 ppm2 1.846 CV 1
ASSI { 524}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 43 and name HB ))
3.500 1.500 1.500 peak 524 spectrum 1 weight 0.10000E+01 volume 0.19096E-02 ppm1 5.579 ppm2 2.047 CV 1
ASSI { 525}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HB2 ))
3.200 1.300 1.300 peak 525 spectrum 1 weight 0.10000E+01 volume 0.14252E-02 ppm1 5.571 ppm2 1.940 CV 1
ASSI { 526}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 51 and name HG1 ))
3.200 1.300 1.300 peak 526 spectrum 1 weight 0.10000E+01 volume 0.19666E-02 ppm1 5.575 ppm2 2.293 CV 1
ASSI { 527}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HN ))
2.300 0.700 0.700 peak 527 spectrum 1 weight 0.10000E+01 volume 0.45007E-02 ppm1 5.410 ppm2 8.538 CV 1
ASSI { 532}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB2 ))
3.000 1.100 1.100 peak 532 spectrum 1 weight 0.10000E+01 volume 0.12341E-02 ppm1 5.410 ppm2 3.581 CV 1
ASSI { 534}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 53 and name HB1 ))
2.900 1.100 1.100 peak 534 spectrum 1 weight 0.10000E+01 volume 0.17511E-02 ppm1 5.409 ppm2 3.081 CV 1
ASSI { 535}
(( segid " " and resid 27 and name HA ))
( segid " " and resid 27 and name HB% )
2.300 0.700 0.700 peak 535 spectrum 1 weight 0.10000E+01 volume 0.33228E-02 ppm1 5.226 ppm2 1.148 CV 1
ASSI { 536}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 43 and name HA ))
2.700 0.900 0.900 peak 536 spectrum 1 weight 0.10000E+01 volume 0.16259E-02 ppm1 5.229 ppm2 4.827 CV 1
ASSI { 537}
(( segid " " and resid 27 and name HA ))
(( segid " " and resid 27 and name HN ))
3.400 1.400 1.400 peak 537 spectrum 1 weight 0.10000E+01 volume 0.64556E-03 ppm1 5.227 ppm2 8.450 CV 1
ASSI { 540}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 65 and name HD1%)
3.400 1.500 1.500 peak 540 spectrum 1 weight 0.10000E+01 volume 0.12504E-02 ppm1 3.942 ppm2 0.799 CV 1
ASSI { 541}
(( segid " " and resid 19 and name HA ))
( segid " " and resid 19 and name HG1%)
2.800 1.000 1.000 peak 541 spectrum 1 weight 0.10000E+01 volume 0.20380E-02 ppm1 4.315 ppm2 0.714 CV 1
ASSI { 542}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB1 ))
2.500 0.800 0.800 peak 542 spectrum 1 weight 0.10000E+01 volume 0.44688E-02 ppm1 4.867 ppm2 2.125 CV 1
OR { 542}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 30 and name HB2 ))
ASSI { 544}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 25 and name HB2 ))
2.500 0.800 0.800 peak 544 spectrum 1 weight 0.10000E+01 volume 0.35697E-02 ppm1 4.997 ppm2 1.793 CV 1
OR { 544}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 25 and name HB1 ))
ASSI { 546}
(( segid " " and resid 39 and name HA ))
( segid " " and resid 39 and name HG2%)
2.900 1.000 1.000 peak 546 spectrum 1 weight 0.10000E+01 volume 0.23732E-02 ppm1 4.418 ppm2 0.723 CV 1
ASSI { 547}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 18 and name HB% )
2.500 0.800 0.800 peak 547 spectrum 1 weight 0.10000E+01 volume 0.42173E-02 ppm1 4.721 ppm2 1.330 CV 1
ASSI { 548}
(( segid " " and resid 68 and name HA ))
( segid " " and resid 68 and name HG1%)
2.700 0.900 0.900 peak 548 spectrum 1 weight 0.10000E+01 volume 0.39021E-02 ppm1 4.077 ppm2 1.043 CV 1
OR { 548}
(( segid " " and resid 68 and name HA ))
( segid " " and resid 68 and name HG2%)
ASSI { 550}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 63 and name HD2%)
3.000 1.100 1.100 peak 550 spectrum 1 weight 0.10000E+01 volume 0.17124E-02 ppm1 4.019 ppm2 0.943 CV 1
OR { 550}
(( segid " " and resid 60 and name HA ))
( segid " " and resid 63 and name HD1%)
ASSI { 552}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 45 and name HG ))
2.800 1.000 1.000 peak 552 spectrum 1 weight 0.10000E+01 volume 0.30263E-02 ppm1 4.993 ppm2 1.662 CV 1
ASSI { 553}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HD2%)
2.700 0.900 0.900 peak 553 spectrum 1 weight 0.10000E+01 volume 0.44250E-02 ppm1 4.140 ppm2 0.909 CV 1
OR { 553}
(( segid " " and resid 63 and name HA ))
( segid " " and resid 63 and name HD1%)
ASSI { 555}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 12 and name HG2%)
2.600 0.900 0.900 peak 555 spectrum 1 weight 0.10000E+01 volume 0.50633E-02 ppm1 4.236 ppm2 0.911 CV 1
ASSI { 556}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HB1 ))
2.100 0.500 0.500 peak 556 spectrum 1 weight 0.10000E+01 volume 0.10773E-01 ppm1 4.736 ppm2 1.699 CV 1
ASSI { 559}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 24 and name HG2%)
3.200 1.200 1.200 peak 559 spectrum 1 weight 0.10000E+01 volume 0.24973E-02 ppm1 4.275 ppm2 0.721 CV 1
ASSI { 564}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 52 and name HG1 ))
3.600 1.600 1.600 peak 564 spectrum 1 weight 0.10000E+01 volume 0.11918E-02 ppm1 4.993 ppm2 1.542 CV 1
ASSI { 569}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 43 and name HG2%)
2.500 0.800 0.800 peak 569 spectrum 1 weight 0.10000E+01 volume 0.22707E-02 ppm1 4.834 ppm2 0.859 CV 1
ASSI { 570}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 41 and name HG1%)
3.200 1.300 1.300 peak 570 spectrum 1 weight 0.10000E+01 volume 0.16658E-02 ppm1 4.792 ppm2 0.790 CV 1
OR { 570}
(( segid " " and resid 28 and name HA ))
( segid " " and resid 41 and name HG2%)
ASSI { 571}
(( segid " " and resid 18 and name HA ))
( segid " " and resid 19 and name HG2%)
3.000 1.200 1.200 peak 571 spectrum 1 weight 0.10000E+01 volume 0.41415E-02 ppm1 4.738 ppm2 0.814 CV 1
ASSI { 572}
(( segid " " and resid 30 and name HA ))
( segid " " and resid 41 and name HG2%)
2.300 2.300 3.700 peak 572 spectrum 1 weight 0.10000E+01 volume 0.87257E-02 ppm1 4.873 ppm2 0.819 CV 1
ASSI { 575}
(( segid " " and resid 18 and name HA ))
(( segid " " and resid 19 and name HN ))
2.600 0.900 0.900 peak 575 spectrum 1 weight 0.10000E+01 volume 0.24338E-02 ppm1 4.724 ppm2 9.123 CV 1
ASSI { 577}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 44 and name HN ))
2.200 0.600 0.600 peak 577 spectrum 1 weight 0.10000E+01 volume 0.33479E-02 ppm1 4.834 ppm2 9.065 CV 1
ASSI { 588}
(( segid " " and resid 30 and name HA ))
(( segid " " and resid 31 and name HN ))
2.600 0.800 0.800 peak 588 spectrum 1 weight 0.10000E+01 volume 0.26373E-02 ppm1 4.861 ppm2 8.366 CV 1
ASSI { 590}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HA ))
3.000 1.200 1.200 peak 590 spectrum 1 weight 0.10000E+01 volume 0.39683E-02 ppm1 4.798 ppm2 5.405 CV 1
ASSI { 591}
(( segid " " and resid 35 and name HA ))
(( segid " " and resid 35 and name HB2 ))
2.500 0.800 0.800 peak 591 spectrum 1 weight 0.10000E+01 volume 0.54222E-02 ppm1 4.703 ppm2 2.746 CV 1
ASSI { 594}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB2 ))
2.300 0.700 0.700 peak 594 spectrum 1 weight 0.10000E+01 volume 0.67788E-02 ppm1 4.763 ppm2 2.950 CV 1
ASSI { 599}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 14 and name HG2 ))
3.400 1.500 1.500 peak 599 spectrum 1 weight 0.10000E+01 volume 0.96354E-03 ppm1 4.785 ppm2 2.321 CV 1
ASSI { 600}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 38 and name HN ))
3.000 1.100 1.100 peak 600 spectrum 1 weight 0.10000E+01 volume 0.12720E-02 ppm1 4.742 ppm2 7.580 CV 1
ASSI { 601}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 36 and name HN ))
3.500 1.500 1.500 peak 601 spectrum 1 weight 0.10000E+01 volume 0.18681E-02 ppm1 4.746 ppm2 8.267 CV 1
ASSI { 602}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 39 and name HN ))
2.300 0.700 0.700 peak 602 spectrum 1 weight 0.10000E+01 volume 0.55940E-02 ppm1 4.734 ppm2 8.009 CV 1
ASSI { 603}
(( segid " " and resid 34 and name HA ))
(( segid " " and resid 35 and name HN ))
2.700 0.900 0.900 peak 603 spectrum 1 weight 0.10000E+01 volume 0.23201E-02 ppm1 4.742 ppm2 8.089 CV 1
ASSI { 611}
(( segid " " and resid 32 and name HA ))
(( segid " " and resid 33 and name HN ))
2.800 1.000 1.000 peak 611 spectrum 1 weight 0.10000E+01 volume 0.15545E-02 ppm1 4.529 ppm2 8.993 CV 1
ASSI { 615}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HN ))
2.500 0.800 0.800 peak 615 spectrum 1 weight 0.10000E+01 volume 0.35745E-02 ppm1 4.417 ppm2 8.007 CV 1
ASSI { 618}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 62 and name HN ))
3.600 1.600 1.600 peak 618 spectrum 1 weight 0.10000E+01 volume 0.18848E-02 ppm1 4.123 ppm2 7.920 CV 1
ASSI { 619}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 69 and name HN ))
2.900 1.100 1.100 peak 619 spectrum 1 weight 0.10000E+01 volume 0.20388E-02 ppm1 4.076 ppm2 8.170 CV 1
ASSI { 620}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 40 and name HN ))
2.500 0.800 0.800 peak 620 spectrum 1 weight 0.10000E+01 volume 0.29454E-02 ppm1 4.414 ppm2 8.437 CV 1
ASSI { 621}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 23 and name HN ))
3.400 1.500 1.500 peak 621 spectrum 1 weight 0.10000E+01 volume 0.94559E-03 ppm1 4.181 ppm2 7.654 CV 1
ASSI { 622}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 21 and name HN ))
2.200 0.600 0.600 peak 622 spectrum 1 weight 0.10000E+01 volume 0.63438E-02 ppm1 4.246 ppm2 8.365 CV 1
ASSI { 625}
(( segid " " and resid 50 and name HA2 ))
(( segid " " and resid 51 and name HN ))
3.000 1.100 1.100 peak 625 spectrum 1 weight 0.10000E+01 volume 0.29282E-02 ppm1 4.465 ppm2 8.304 CV 1
ASSI { 627}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 35 and name HN ))
3.000 1.100 1.100 peak 627 spectrum 1 weight 0.10000E+01 volume 0.16279E-02 ppm1 4.013 ppm2 8.094 CV 1
OR { 627}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 35 and name HN ))
ASSI { 636}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 36 and name HN ))
2.200 0.600 0.600 peak 636 spectrum 1 weight 0.10000E+01 volume 0.50433E-02 ppm1 4.117 ppm2 8.274 CV 1
ASSI { 637}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HN ))
2.800 1.000 1.000 peak 637 spectrum 1 weight 0.10000E+01 volume 0.16478E-02 ppm1 4.174 ppm2 7.805 CV 1
ASSI { 648}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 35 and name HN ))
3.400 1.500 1.500 peak 648 spectrum 1 weight 0.10000E+01 volume 0.38977E-02 ppm1 4.342 ppm2 8.092 CV 1
ASSI { 660}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HG11))
3.200 1.300 1.300 peak 660 spectrum 1 weight 0.10000E+01 volume 0.15708E-02 ppm1 4.413 ppm2 1.646 CV 1
OR { 660}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HG12))
ASSI { 661}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB2 ))
2.300 0.600 0.600 peak 661 spectrum 1 weight 0.10000E+01 volume 0.78999E-02 ppm1 4.214 ppm2 1.967 CV 1
ASSI { 664}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 68 and name HB ))
2.900 1.100 1.100 peak 664 spectrum 1 weight 0.10000E+01 volume 0.15836E-02 ppm1 4.077 ppm2 2.240 CV 1
ASSI { 665}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 69 and name HB1 ))
3.100 1.200 1.200 peak 665 spectrum 1 weight 0.10000E+01 volume 0.10893E-02 ppm1 4.144 ppm2 2.121 CV 1
OR { 665}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 69 and name HB2 ))
ASSI { 667}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 63 and name HB1 ))
2.700 0.900 0.900 peak 667 spectrum 1 weight 0.10000E+01 volume 0.28608E-02 ppm1 4.140 ppm2 1.671 CV 1
ASSI { 668}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB2 ))
2.200 0.600 0.600 peak 668 spectrum 1 weight 0.10000E+01 volume 0.41854E-02 ppm1 4.400 ppm2 1.781 CV 1
OR { 668}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 25 and name HB1 ))
ASSI { 672}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 49 and name HB1 ))
2.100 2.100 3.900 peak 672 spectrum 1 weight 0.10000E+01 volume 0.14160E-01 ppm1 4.275 ppm2 1.792 CV 1
ASSI { 674}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 38 and name HB1 ))
2.800 2.800 3.200 peak 674 spectrum 1 weight 0.10000E+01 volume 0.78999E-02 ppm1 4.345 ppm2 1.707 CV 1
ASSI { 679}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HB2 ))
2.400 0.700 0.700 peak 679 spectrum 1 weight 0.10000E+01 volume 0.44088E-02 ppm1 4.309 ppm2 1.943 CV 1
ASSI { 681}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HG1 ))
2.900 1.100 1.100 peak 681 spectrum 1 weight 0.10000E+01 volume 0.14208E-02 ppm1 4.315 ppm2 1.657 CV 1
OR { 681}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HG2 ))
ASSI { 682}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HG1 ))
3.800 1.800 1.800 peak 682 spectrum 1 weight 0.10000E+01 volume 0.67750E-03 ppm1 4.245 ppm2 1.616 CV 1
ASSI { 683}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HG2 ))
2.900 1.100 1.100 peak 683 spectrum 1 weight 0.10000E+01 volume 0.65475E-02 ppm1 4.408 ppm2 2.326 CV 1
ASSI { 684}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HB1 ))
2.400 0.700 0.700 peak 684 spectrum 1 weight 0.10000E+01 volume 0.44488E-02 ppm1 4.408 ppm2 2.033 CV 1
ASSI { 686}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 38 and name HG1 ))
2.500 2.500 3.500 peak 686 spectrum 1 weight 0.10000E+01 volume 0.15980E-01 ppm1 4.111 ppm2 1.360 CV 1
ASSI { 687}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HG1 ))
2.300 0.700 0.700 peak 687 spectrum 1 weight 0.10000E+01 volume 0.77485E-02 ppm1 4.216 ppm2 1.458 CV 1
ASSI { 688}
(( segid " " and resid 22 and name HA ))
( segid " " and resid 22 and name HB% )
2.300 0.700 0.700 peak 688 spectrum 1 weight 0.10000E+01 volume 0.78722E-02 ppm1 4.181 ppm2 1.388 CV 1
ASSI { 693}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB2 ))
2.600 0.800 0.800 peak 693 spectrum 1 weight 0.10000E+01 volume 0.38087E-02 ppm1 4.300 ppm2 2.130 CV 1
OR { 693}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 69 and name HB1 ))
ASSI { 700}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HG12))
3.200 1.300 1.300 peak 700 spectrum 1 weight 0.10000E+01 volume 0.16841E-02 ppm1 4.233 ppm2 1.178 CV 1
OR { 700}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HG11))
ASSI { 711}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB2 ))
2.600 0.900 0.900 peak 711 spectrum 1 weight 0.10000E+01 volume 0.22483E-02 ppm1 4.018 ppm2 2.157 CV 1
ASSI { 712}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HB1 ))
3.000 1.200 1.200 peak 712 spectrum 1 weight 0.10000E+01 volume 0.25077E-02 ppm1 4.016 ppm2 2.015 CV 1
ASSI { 715}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB1 ))
2.700 0.900 0.900 peak 715 spectrum 1 weight 0.10000E+01 volume 0.25503E-02 ppm1 3.940 ppm2 1.924 CV 1
OR { 715}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 717}
(( segid " " and resid 62 and name HA ))
(( segid " " and resid 65 and name HB ))
2.700 0.900 0.900 peak 717 spectrum 1 weight 0.10000E+01 volume 0.22180E-02 ppm1 3.943 ppm2 1.830 CV 1
ASSI { 720}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 52 and name HG2 ))
4.200 2.200 1.800 peak 720 spectrum 1 weight 0.10000E+01 volume 0.73853E-03 ppm1 3.998 ppm2 1.603 CV 1
ASSI { 722}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 60 and name HG1 ))
2.700 0.900 0.900 peak 722 spectrum 1 weight 0.10000E+01 volume 0.23333E-02 ppm1 4.020 ppm2 2.455 CV 1
ASSI { 724}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 62 and name HN ))
3.400 1.500 1.500 peak 724 spectrum 1 weight 0.10000E+01 volume 0.66075E-03 ppm1 4.004 ppm2 7.912 CV 1
ASSI { 726}
(( segid " " and resid 44 and name HB ))
( segid " " and resid 44 and name HG2%)
2.500 0.800 0.800 peak 726 spectrum 1 weight 0.10000E+01 volume 0.32526E-02 ppm1 3.998 ppm2 1.282 CV 1
OR { 726}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 44 and name HG1 ))
ASSI { 731}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 52 and name HD1 ))
3.700 1.800 1.800 peak 731 spectrum 1 weight 0.10000E+01 volume 0.71777E-03 ppm1 3.889 ppm2 3.099 CV 1
OR { 731}
(( segid " " and resid 15 and name HA2 ))
(( segid " " and resid 52 and name HD1 ))
ASSI { 737}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 64 and name HB ))
2.400 0.700 0.700 peak 737 spectrum 1 weight 0.10000E+01 volume 0.27682E-02 ppm1 3.816 ppm2 1.871 CV 1
ASSI { 738}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 14 and name HB1 ))
2.800 2.800 3.200 peak 738 spectrum 1 weight 0.10000E+01 volume 0.50871E-02 ppm1 3.885 ppm2 2.052 CV 1
OR { 738}
(( segid " " and resid 15 and name HA2 ))
(( segid " " and resid 14 and name HB1 ))
OR { 738}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 14 and name HB2 ))
OR { 738}
(( segid " " and resid 15 and name HA2 ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 750}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 64 and name HD1%)
3.600 1.600 1.600 peak 750 spectrum 1 weight 0.10000E+01 volume 0.23397E-02 ppm1 3.815 ppm2 0.646 CV 1
ASSI { 753}
(( segid " " and resid 32 and name HD2 ))
(( segid " " and resid 32 and name HG1 ))
3.000 1.100 1.100 peak 753 spectrum 1 weight 0.10000E+01 volume 0.18393E-02 ppm1 3.878 ppm2 1.646 CV 1
ASSI { 756}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 61 and name HB% )
2.300 0.600 0.600 peak 756 spectrum 1 weight 0.10000E+01 volume 0.57454E-02 ppm1 3.815 ppm2 1.427 CV 1
ASSI { 757}
(( segid " " and resid 50 and name HA1 ))
(( segid " " and resid 51 and name HA ))
4.200 2.200 1.800 peak 757 spectrum 1 weight 0.10000E+01 volume 0.39939E-03 ppm1 3.796 ppm2 5.578 CV 1
ASSI { 760}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 14 and name HG2 ))
2.900 1.000 1.000 peak 760 spectrum 1 weight 0.10000E+01 volume 0.10010E-02 ppm1 3.782 ppm2 2.319 CV 1
ASSI { 766}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HG12))
3.000 1.100 1.100 peak 766 spectrum 1 weight 0.10000E+01 volume 0.21916E-02 ppm1 3.670 ppm2 1.045 CV 1
OR { 766}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 64 and name HG11))
ASSI { 768}
(( segid " " and resid 14 and name HD1 ))
(( segid " " and resid 14 and name HG2 ))
3.400 1.500 1.500 peak 768 spectrum 1 weight 0.10000E+01 volume 0.14703E-02 ppm1 3.608 ppm2 2.318 CV 1
ASSI { 770}
(( segid " " and resid 32 and name HD1 ))
(( segid " " and resid 32 and name HB1 ))
3.100 1.200 1.200 peak 770 spectrum 1 weight 0.10000E+01 volume 0.21298E-02 ppm1 3.664 ppm2 2.203 CV 1
OR { 770}
(( segid " " and resid 32 and name HD1 ))
(( segid " " and resid 32 and name HB2 ))
ASSI { 774}
(( segid " " and resid 32 and name HD1 ))
(( segid " " and resid 32 and name HG1 ))
2.400 0.700 0.700 peak 774 spectrum 1 weight 0.10000E+01 volume 0.31724E-02 ppm1 3.667 ppm2 1.654 CV 1
ASSI { 777}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 64 and name HG2%)
2.600 0.900 0.900 peak 777 spectrum 1 weight 0.10000E+01 volume 0.25424E-02 ppm1 3.669 ppm2 0.727 CV 1
ASSI { 778}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 24 and name HD1%)
3.400 1.400 1.400 peak 778 spectrum 1 weight 0.10000E+01 volume 0.21514E-02 ppm1 3.631 ppm2 0.612 CV 1
ASSI { 779}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 64 and name HD1%)
3.200 1.200 1.200 peak 779 spectrum 1 weight 0.10000E+01 volume 0.70859E-03 ppm1 3.668 ppm2 0.622 CV 1
ASSI { 780}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HG1%)
3.000 1.100 1.100 peak 780 spectrum 1 weight 0.10000E+01 volume 0.19838E-02 ppm1 3.542 ppm2 1.054 CV 1
OR { 780}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 21 and name HG2%)
ASSI { 784}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 64 and name HG2%)
2.800 2.800 3.200 peak 784 spectrum 1 weight 0.10000E+01 volume 0.37461E-02 ppm1 3.540 ppm2 0.744 CV 1
ASSI { 785}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 24 and name HG2%)
2.600 0.800 0.800 peak 785 spectrum 1 weight 0.10000E+01 volume 0.31197E-02 ppm1 3.632 ppm2 0.687 CV 1
ASSI { 786}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 65 and name HD1%)
2.700 0.900 0.900 peak 786 spectrum 1 weight 0.10000E+01 volume 0.27091E-02 ppm1 3.616 ppm2 0.801 CV 1
ASSI { 789}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 19 and name HG2%)
3.800 1.800 1.800 peak 789 spectrum 1 weight 0.10000E+01 volume 0.67469E-03 ppm1 3.542 ppm2 0.843 CV 1
ASSI { 792}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 53 and name HB1 ))
1.700 0.400 0.500 peak 792 spectrum 1 weight 0.10000E+01 volume 0.15656E-01 ppm1 3.588 ppm2 3.081 CV 1
ASSI { 794}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 45 and name HA ))
4.100 2.100 1.900 peak 794 spectrum 1 weight 0.10000E+01 volume 0.75329E-03 ppm1 3.631 ppm2 4.997 CV 1
ASSI { 799}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 24 and name HB ))
2.700 0.900 0.900 peak 799 spectrum 1 weight 0.10000E+01 volume 0.21294E-02 ppm1 3.630 ppm2 1.932 CV 1
ASSI { 801}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 65 and name HB ))
2.900 1.000 1.000 peak 801 spectrum 1 weight 0.10000E+01 volume 0.19674E-02 ppm1 3.619 ppm2 1.829 CV 1
ASSI { 811}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HG2 ))
2.800 1.000 1.000 peak 811 spectrum 1 weight 0.10000E+01 volume 0.22367E-02 ppm1 3.526 ppm2 1.586 CV 1
ASSI { 812}
(( segid " " and resid 52 and name HD2 ))
(( segid " " and resid 52 and name HG1 ))
2.600 0.800 0.800 peak 812 spectrum 1 weight 0.10000E+01 volume 0.21529E-02 ppm1 3.528 ppm2 1.513 CV 1
ASSI { 822}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 32 and name HD2 ))
3.100 1.200 1.200 peak 822 spectrum 1 weight 0.10000E+01 volume 0.39384E-02 ppm1 3.217 ppm2 3.872 CV 1
ASSI { 824}
(( segid " " and resid 70 and name HD1 ))
(( segid " " and resid 21 and name HB ))
3.200 1.300 1.300 peak 824 spectrum 1 weight 0.10000E+01 volume 0.21936E-02 ppm1 3.201 ppm2 2.035 CV 1
ASSI { 828}
(( segid " " and resid 70 and name HD1 ))
(( segid " " and resid 70 and name HG2 ))
2.200 0.600 0.600 peak 828 spectrum 1 weight 0.10000E+01 volume 0.88614E-02 ppm1 3.216 ppm2 1.672 CV 1
OR { 828}
(( segid " " and resid 70 and name HD1 ))
(( segid " " and resid 70 and name HG1 ))
ASSI { 832}
(( segid " " and resid 70 and name HD1 ))
(( segid " " and resid 70 and name HA ))
4.000 2.000 2.000 peak 832 spectrum 1 weight 0.10000E+01 volume 0.13266E-02 ppm1 3.216 ppm2 4.323 CV 1
ASSI { 833}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 11 and name HN ))
3.700 1.700 1.700 peak 833 spectrum 1 weight 0.10000E+01 volume 0.60168E-03 ppm1 3.198 ppm2 9.055 CV 1
ASSI { 834}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HA ))
3.500 1.500 1.500 peak 834 spectrum 1 weight 0.10000E+01 volume 0.77242E-03 ppm1 3.128 ppm2 4.735 CV 1
ASSI { 857}
(( segid " " and resid 52 and name HD1 ))
(( segid " " and resid 52 and name HG2 ))
2.500 0.800 0.800 peak 857 spectrum 1 weight 0.10000E+01 volume 0.24709E-02 ppm1 3.064 ppm2 1.591 CV 1
ASSI { 880}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 33 and name HB1 ))
2.300 0.700 0.700 peak 880 spectrum 1 weight 0.10000E+01 volume 0.73296E-02 ppm1 2.734 ppm2 4.006 CV 1
OR { 880}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 33 and name HB2 ))
ASSI { 895}
(( segid " " and resid 31 and name HB1 ))
( segid " " and resid 31 and name HD% )
2.900 1.000 1.000 peak 895 spectrum 1 weight 0.10000E+01 volume 0.19634E-02 ppm1 2.733 ppm2 7.212 CV 1
ASSI { 900}
(( segid " " and resid 31 and name HB1 ))
(( segid " " and resid 31 and name HN ))
3.300 1.300 1.300 peak 900 spectrum 1 weight 0.10000E+01 volume 0.19506E-02 ppm1 2.735 ppm2 8.368 CV 1
ASSI { 920}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 16 and name HG2%)
2.400 0.700 0.700 peak 920 spectrum 1 weight 0.10000E+01 volume 0.40896E-02 ppm1 2.377 ppm2 1.052 CV 1
ASSI { 922}
(( segid " " and resid 16 and name HB ))
( segid " " and resid 16 and name HG1%)
2.500 0.800 0.800 peak 922 spectrum 1 weight 0.10000E+01 volume 0.28867E-02 ppm1 2.377 ppm2 0.832 CV 1
ASSI { 926}
(( segid " " and resid 40 and name HG1 ))
(( segid " " and resid 40 and name HN ))
3.600 1.600 1.600 peak 926 spectrum 1 weight 0.10000E+01 volume 0.66870E-03 ppm1 2.328 ppm2 8.438 CV 1
ASSI { 930}
(( segid " " and resid 68 and name HB ))
(( segid " " and resid 69 and name HN ))
3.000 1.100 1.100 peak 930 spectrum 1 weight 0.10000E+01 volume 0.19570E-02 ppm1 2.246 ppm2 8.177 CV 1
ASSI { 931}
(( segid " " and resid 40 and name HG1 ))
(( segid " " and resid 40 and name HA ))
3.600 1.700 1.700 peak 931 spectrum 1 weight 0.10000E+01 volume 0.10138E-02 ppm1 2.322 ppm2 4.780 CV 1
ASSI { 940}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 32 and name HD2 ))
3.300 1.300 1.300 peak 940 spectrum 1 weight 0.10000E+01 volume 0.31520E-02 ppm1 2.208 ppm2 3.873 CV 1
OR { 940}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HD2 ))
ASSI { 946}
(( segid " " and resid 69 and name HB1 ))
(( segid " " and resid 68 and name HA ))
4.200 2.200 1.800 peak 946 spectrum 1 weight 0.10000E+01 volume 0.65951E-03 ppm1 2.129 ppm2 4.090 CV 1
OR { 946}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 68 and name HA ))
ASSI { 947}
(( segid " " and resid 49 and name HG2 ))
(( segid " " and resid 49 and name HA ))
2.600 0.900 0.900 peak 947 spectrum 1 weight 0.10000E+01 volume 0.31305E-02 ppm1 1.690 ppm2 4.209 CV 1
ASSI { 958}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 17 and name HA ))
2.600 0.900 0.900 peak 958 spectrum 1 weight 0.10000E+01 volume 0.28292E-02 ppm1 1.928 ppm2 4.248 CV 1
OR { 958}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HA ))
ASSI { 959}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 62 and name HA ))
2.900 1.000 1.000 peak 959 spectrum 1 weight 0.10000E+01 volume 0.29409E-02 ppm1 1.933 ppm2 3.938 CV 1
ASSI { 961}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 14 and name HD2 ))
3.400 1.400 1.400 peak 961 spectrum 1 weight 0.10000E+01 volume 0.22994E-02 ppm1 2.038 ppm2 3.783 CV 1
ASSI { 964}
(( segid " " and resid 39 and name HB ))
(( segid " " and resid 39 and name HA ))
2.700 0.900 0.900 peak 964 spectrum 1 weight 0.10000E+01 volume 0.20588E-02 ppm1 1.924 ppm2 4.402 CV 1
ASSI { 971}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HA ))
3.600 1.600 1.600 peak 971 spectrum 1 weight 0.10000E+01 volume 0.80636E-03 ppm1 2.081 ppm2 4.400 CV 1
ASSI { 972}
(( segid " " and resid 32 and name HG2 ))
(( segid " " and resid 32 and name HD2 ))
2.700 0.900 0.900 peak 972 spectrum 1 weight 0.10000E+01 volume 0.11627E-02 ppm1 1.920 ppm2 3.872 CV 1
ASSI { 980}
(( segid " " and resid 68 and name HB ))
(( segid " " and resid 65 and name HA ))
3.100 1.200 1.200 peak 980 spectrum 1 weight 0.10000E+01 volume 0.14032E-02 ppm1 2.239 ppm2 3.620 CV 1
ASSI { 982}
(( segid " " and resid 68 and name HB ))
(( segid " " and resid 68 and name HN ))
2.700 0.900 0.900 peak 982 spectrum 1 weight 0.10000E+01 volume 0.22734E-02 ppm1 2.242 ppm2 8.034 CV 1
ASSI { 999}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 68 and name HN ))
2.400 0.700 0.700 peak 999 spectrum 1 weight 0.10000E+01 volume 0.33551E-02 ppm1 1.969 ppm2 8.028 CV 1
OR { 999}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 68 and name HN ))
ASSI { 1002}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 64 and name HN ))
2.200 0.600 0.600 peak 1002 spectrum 1 weight 0.10000E+01 volume 0.63238E-02 ppm1 1.878 ppm2 7.834 CV 1
ASSI { 1007}
(( segid " " and resid 38 and name HB1 ))
(( segid " " and resid 39 and name HN ))
2.500 0.800 0.800 peak 1007 spectrum 1 weight 0.10000E+01 volume 0.68188E-02 ppm1 1.684 ppm2 8.015 CV 1
ASSI { 1011}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 39 and name HN ))
2.700 0.900 0.900 peak 1011 spectrum 1 weight 0.10000E+01 volume 0.53546E-02 ppm1 1.881 ppm2 8.014 CV 1
ASSI { 1012}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 62 and name HN ))
3.300 1.300 1.300 peak 1012 spectrum 1 weight 0.10000E+01 volume 0.32913E-02 ppm1 1.888 ppm2 7.906 CV 1
ASSI { 1022}
(( segid " " and resid 19 and name HB ))
(( segid " " and resid 20 and name HN ))
2.300 0.600 0.600 peak 1022 spectrum 1 weight 0.10000E+01 volume 0.20592E-02 ppm1 1.864 ppm2 8.645 CV 1
ASSI { 1025}
(( segid " " and resid 63 and name HB1 ))
(( segid " " and resid 64 and name HN ))
3.400 1.400 1.400 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.93003E-03 ppm1 1.675 ppm2 7.835 CV 1
ASSI { 1035}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 51 and name HA ))
3.700 1.700 1.700 peak 1035 spectrum 1 weight 0.10000E+01 volume 0.11822E-02 ppm1 2.077 ppm2 5.574 CV 1
ASSI { 1036}
(( segid " " and resid 14 and name HG1 ))
(( segid " " and resid 51 and name HA ))
4.200 2.200 1.800 peak 1036 spectrum 1 weight 0.10000E+01 volume 0.36759E-03 ppm1 2.128 ppm2 5.573 CV 1
ASSI { 1038}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HD1 ))
3.300 1.300 1.300 peak 1038 spectrum 1 weight 0.10000E+01 volume 0.45764E-02 ppm1 2.086 ppm2 3.615 CV 1
ASSI { 1039}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 14 and name HD1 ))
3.500 1.500 1.500 peak 1039 spectrum 1 weight 0.10000E+01 volume 0.12935E-02 ppm1 2.037 ppm2 3.614 CV 1
ASSI { 1046}
(( segid " " and resid 70 and name HB1 ))
(( segid " " and resid 70 and name HD1 ))
2.300 0.600 0.600 peak 1046 spectrum 1 weight 0.10000E+01 volume 0.61686E-02 ppm1 1.885 ppm2 3.212 CV 1
ASSI { 1050}
(( segid " " and resid 32 and name HG1 ))
(( segid " " and resid 37 and name HB2 ))
2.500 2.500 3.500 peak 1050 spectrum 1 weight 0.10000E+01 volume 0.10070E-01 ppm1 1.666 ppm2 2.961 CV 1
ASSI { 1057}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 23 and name HB2 ))
2.000 2.000 4.000 peak 1057 spectrum 1 weight 0.10000E+01 volume 0.39276E-02 ppm1 1.794 ppm2 2.998 CV 1
OR { 1057}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 23 and name HB2 ))
ASSI { 1065}
(( segid " " and resid 60 and name HB1 ))
(( segid " " and resid 61 and name HN ))
3.000 1.100 1.100 peak 1065 spectrum 1 weight 0.10000E+01 volume 0.80793E-03 ppm1 2.020 ppm2 7.737 CV 1
ASSI { 1067}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HA ))
2.700 0.900 0.900 peak 1067 spectrum 1 weight 0.10000E+01 volume 0.29681E-02 ppm1 1.942 ppm2 4.778 CV 1
ASSI { 1071}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 64 and name HA ))
2.700 0.900 0.900 peak 1071 spectrum 1 weight 0.10000E+01 volume 0.19139E-02 ppm1 1.876 ppm2 3.664 CV 1
ASSI { 1075}
(( segid " " and resid 40 and name HB1 ))
(( segid " " and resid 41 and name HN ))
3.400 1.500 1.500 peak 1075 spectrum 1 weight 0.10000E+01 volume 0.15054E-02 ppm1 1.886 ppm2 9.164 CV 1
ASSI { 1080}
(( segid " " and resid 42 and name HB ))
(( segid " " and resid 28 and name HN ))
3.300 1.300 1.300 peak 1080 spectrum 1 weight 0.10000E+01 volume 0.79517E-03 ppm1 1.736 ppm2 8.854 CV 1
ASSI { 1084}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 18 and name HA ))
3.700 1.700 1.700 peak 1084 spectrum 1 weight 0.10000E+01 volume 0.10737E-02 ppm1 1.745 ppm2 4.732 CV 1
ASSI { 1109}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 36 and name HA ))
2.100 2.100 3.900 peak 1109 spectrum 1 weight 0.10000E+01 volume 0.38179E-02 ppm1 1.425 ppm2 4.340 CV 1
ASSI { 1116}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 53 and name HA ))
2.500 2.500 3.500 peak 1116 spectrum 1 weight 0.10000E+01 volume 0.54065E-02 ppm1 1.459 ppm2 5.404 CV 1
ASSI { 1117}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 52 and name HA ))
2.600 0.800 0.800 peak 1117 spectrum 1 weight 0.10000E+01 volume 0.34281E-02 ppm1 1.453 ppm2 4.782 CV 1
ASSI { 1120}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 51 and name HA ))
3.700 1.700 1.700 peak 1120 spectrum 1 weight 0.10000E+01 volume 0.15932E-02 ppm1 1.449 ppm2 5.577 CV 1
ASSI { 1126}
(( segid " " and resid 49 and name HG1 ))
(( segid " " and resid 51 and name HN ))
3.300 3.300 2.700 peak 1126 spectrum 1 weight 0.10000E+01 volume 0.11072E-02 ppm1 1.466 ppm2 8.284 CV 1
ASSI { 1147}
(( segid " " and resid 29 and name HG11))
( segid " " and resid 29 and name HG2%)
3.000 1.100 1.100 peak 1147 spectrum 1 weight 0.10000E+01 volume 0.18214E-02 ppm1 1.372 ppm2 0.390 CV 1
OR { 1147}
(( segid " " and resid 29 and name HG12))
( segid " " and resid 29 and name HG2%)
ASSI { 1149}
(( segid " " and resid 44 and name HG1 ))
(( segid " " and resid 46 and name HA ))
3.600 1.600 1.600 peak 1149 spectrum 1 weight 0.10000E+01 volume 0.81193E-03 ppm1 1.287 ppm2 4.282 CV 1
OR { 1149}
( segid " " and resid 44 and name HG2%)
(( segid " " and resid 46 and name HA ))
ASSI { 1150}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 19 and name HN ))
3.800 1.800 1.800 peak 1150 spectrum 1 weight 0.10000E+01 volume 0.10968E-02 ppm1 1.330 ppm2 9.128 CV 1
ASSI { 1159}
( segid " " and resid 27 and name HB% )
(( segid " " and resid 53 and name HA ))
4.300 2.300 1.700 peak 1159 spectrum 1 weight 0.10000E+01 volume 0.52866E-03 ppm1 1.153 ppm2 5.397 CV 1
ASSI { 1166}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 65 and name HN ))
3.700 1.700 1.700 peak 1166 spectrum 1 weight 0.10000E+01 volume 0.70463E-03 ppm1 0.942 ppm2 8.413 CV 1
ASSI { 1173}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 69 and name HN ))
3.700 1.700 1.700 peak 1173 spectrum 1 weight 0.10000E+01 volume 0.82550E-03 ppm1 1.050 ppm2 8.172 CV 1
OR { 1173}
( segid " " and resid 68 and name HG1%)
(( segid " " and resid 69 and name HN ))
ASSI { 1188}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 66 and name HA ))
3.100 1.200 1.200 peak 1188 spectrum 1 weight 0.10000E+01 volume 0.17408E-02 ppm1 0.951 ppm2 4.139 CV 1
ASSI { 1196}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 13 and name HA1 ))
4.000 2.000 2.000 peak 1196 spectrum 1 weight 0.10000E+01 volume 0.32913E-03 ppm1 0.911 ppm2 4.019 CV 1
ASSI { 1197}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 62 and name HA ))
4.200 2.200 1.800 peak 1197 spectrum 1 weight 0.10000E+01 volume 0.36958E-03 ppm1 0.951 ppm2 3.936 CV 1
ASSI { 1198}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 68 and name HA ))
5.600 3.900 0.400 peak 1198 spectrum 1 weight 0.10000E+01 volume 0.88414E-04 ppm1 0.861 ppm2 4.083 CV 1
ASSI { 1204}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 65 and name HA ))
2.800 1.000 1.000 peak 1204 spectrum 1 weight 0.10000E+01 volume 0.33471E-02 ppm1 0.942 ppm2 3.614 CV 1
ASSI { 1211}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 30 and name HA ))
2.300 2.300 3.700 peak 1211 spectrum 1 weight 0.10000E+01 volume 0.17276E-02 ppm1 0.754 ppm2 4.879 CV 1
ASSI { 1219}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 19 and name HN ))
2.500 0.800 0.800 peak 1219 spectrum 1 weight 0.10000E+01 volume 0.35347E-02 ppm1 0.826 ppm2 9.115 CV 1
ASSI { 1232}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 61 and name HA ))
4.000 2.000 2.000 peak 1232 spectrum 1 weight 0.10000E+01 volume 0.74172E-03 ppm1 0.817 ppm2 3.813 CV 1
ASSI { 1244}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 67 and name HA ))
4.800 2.800 1.200 peak 1244 spectrum 1 weight 0.10000E+01 volume 0.46282E-03 ppm1 0.735 ppm2 4.197 CV 1
ASSI { 1258}
( segid " " and resid 64 and name HD1%)
( segid " " and resid 27 and name HB% )
4.100 2.100 1.900 peak 1258 spectrum 1 weight 0.10000E+01 volume 0.72058E-03 ppm1 0.628 ppm2 1.150 CV 1
ASSI { 1262}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 61 and name HB% )
4.300 2.300 1.700 peak 1262 spectrum 1 weight 0.10000E+01 volume 0.40019E-03 ppm1 0.402 ppm2 1.436 CV 1
ASSI { 1264}
( segid " " and resid 10 and name HD1%)
(( segid " " and resid 10 and name HG ))
2.800 1.000 1.000 peak 1264 spectrum 1 weight 0.10000E+01 volume 0.19881E-02 ppm1 0.481 ppm2 1.443 CV 1
OR { 1264}
( segid " " and resid 10 and name HD2%)
(( segid " " and resid 10 and name HG ))
ASSI { 1280}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 45 and name HN ))
4.100 2.100 1.900 peak 1280 spectrum 1 weight 0.10000E+01 volume 0.49833E-03 ppm1 9.161 ppm2 8.875 CV 1
ASSI { 1281}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 44 and name HN ))
3.200 3.200 2.800 peak 1281 spectrum 1 weight 0.10000E+01 volume 0.15457E-02 ppm1 8.758 ppm2 9.095 CV 1
ASSI { 1282}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HN ))
3.400 1.500 1.500 peak 1282 spectrum 1 weight 0.10000E+01 volume 0.18330E-02 ppm1 8.452 ppm2 8.013 CV 1
ASSI { 1287}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 21 and name HA ))
2.300 2.300 3.700 peak 1287 spectrum 1 weight 0.10000E+01 volume 0.20268E-02 ppm1 4.071 ppm2 3.540 CV 1
ASSI { 1288}
(( segid " " and resid 13 and name HA2 ))
(( segid " " and resid 14 and name HD1 ))
2.700 0.900 0.900 peak 1288 spectrum 1 weight 0.10000E+01 volume 0.30271E-02 ppm1 4.282 ppm2 3.616 CV 1
ASSI { 1290}
(( segid " " and resid 68 and name HA ))
(( segid " " and resid 65 and name HA ))
3.300 3.300 2.700 peak 1290 spectrum 1 weight 0.10000E+01 volume 0.23353E-02 ppm1 4.074 ppm2 3.623 CV 1
ASSI { 1291}
(( segid " " and resid 13 and name HA1 ))
(( segid " " and resid 14 and name HD1 ))
2.800 1.000 1.000 peak 1291 spectrum 1 weight 0.10000E+01 volume 0.27786E-02 ppm1 4.022 ppm2 3.611 CV 1
ASSI { 1293}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 14 and name HD1 ))
3.200 1.200 1.200 peak 1293 spectrum 1 weight 0.10000E+01 volume 0.18952E-02 ppm1 4.214 ppm2 3.628 CV 1
ASSI { 1300}
(( segid " " and resid 12 and name HG11))
( segid " " and resid 12 and name HD1%)
2.400 0.700 0.700 peak 1300 spectrum 1 weight 0.10000E+01 volume 0.55898E-02 ppm1 1.181 ppm2 0.864 CV 1
OR { 1300}
(( segid " " and resid 12 and name HG12))
( segid " " and resid 12 and name HD1%)
ASSI { 1304}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 21 and name HB ))
2.800 1.000 1.000 peak 1304 spectrum 1 weight 0.10000E+01 volume 0.21286E-02 ppm1 1.055 ppm2 2.050 CV 1
OR { 1304}
( segid " " and resid 21 and name HG1%)
(( segid " " and resid 21 and name HB ))
ASSI { 1307}
( segid " " and resid 24 and name HG2%)
( segid " " and resid 44 and name HG2%)
3.300 1.300 1.300 peak 1307 spectrum 1 weight 0.10000E+01 volume 0.15756E-02 ppm1 0.695 ppm2 1.268 CV 1
OR { 1307}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 44 and name HG1 ))
ASSI { 1308}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HN ))
3.200 1.300 1.300 peak 1308 spectrum 1 weight 0.10000E+01 volume 0.18337E-02 ppm1 9.065 ppm2 9.407 CV 1
ASSI { 1310}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 45 and name HN ))
3.000 1.200 1.200 peak 1310 spectrum 1 weight 0.10000E+01 volume 0.23967E-02 ppm1 8.509 ppm2 8.864 CV 1
ASSI { 1314}
(( segid " " and resid 50 and name HA2 ))
(( segid " " and resid 50 and name HA1 ))
2.000 0.500 0.500 peak 1314 spectrum 1 weight 0.10000E+01 volume 0.49315E-02 ppm1 4.456 ppm2 3.805 CV 1
ASSI { 1318}
(( segid " " and resid 21 and name HA ))
(( segid " " and resid 70 and name HD1 ))
3.300 3.300 2.700 peak 1318 spectrum 1 weight 0.10000E+01 volume 0.22942E-02 ppm1 3.534 ppm2 3.222 CV 1
ASSI { 1326}
(( segid " " and resid 32 and name HB1 ))
(( segid " " and resid 32 and name HG1 ))
1.900 0.400 0.400 peak 1326 spectrum 1 weight 0.10000E+01 volume 0.17551E-01 ppm1 2.207 ppm2 1.647 CV 1
OR { 1326}
(( segid " " and resid 32 and name HB2 ))
(( segid " " and resid 32 and name HG1 ))
ASSI { 1328}
(( segid " " and resid 68 and name HB ))
( segid " " and resid 68 and name HG1%)
2.300 0.700 0.700 peak 1328 spectrum 1 weight 0.10000E+01 volume 0.62281E-02 ppm1 2.244 ppm2 1.044 CV 1
OR { 1328}
(( segid " " and resid 68 and name HB ))
( segid " " and resid 68 and name HG2%)
ASSI { 1329}
(( segid " " and resid 68 and name HB ))
( segid " " and resid 65 and name HG2%)
3.400 1.500 1.500 peak 1329 spectrum 1 weight 0.10000E+01 volume 0.13115E-02 ppm1 2.242 ppm2 0.963 CV 1
ASSI { 1332}
(( segid " " and resid 64 and name HG12))
(( segid " " and resid 64 and name HB ))
2.500 0.800 0.800 peak 1332 spectrum 1 weight 0.10000E+01 volume 0.31776E-02 ppm1 1.058 ppm2 1.870 CV 1
OR { 1332}
(( segid " " and resid 64 and name HG11))
(( segid " " and resid 64 and name HB ))
ASSI { 1333}
( segid " " and resid 68 and name HG1%)
( segid " " and resid 29 and name HG2%)
2.200 2.200 3.800 peak 1333 spectrum 1 weight 0.10000E+01 volume 0.26373E-02 ppm1 1.058 ppm2 0.394 CV 1
OR { 1333}
( segid " " and resid 68 and name HG2%)
( segid " " and resid 29 and name HG2%)
ASSI { 1335}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 23 and name HN ))
2.600 0.800 0.800 peak 1335 spectrum 1 weight 0.10000E+01 volume 0.18382E-02 ppm1 8.222 ppm2 7.649 CV 1
ASSI { 1336}
(( segid " " and resid 62 and name HN ))
(( segid " " and resid 63 and name HN ))
2.600 0.900 0.900 peak 1336 spectrum 1 weight 0.10000E+01 volume 0.23341E-02 ppm1 7.907 ppm2 7.646 CV 1
ASSI { 1337}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 66 and name HN ))
3.600 1.600 1.600 peak 1337 spectrum 1 weight 0.10000E+01 volume 0.18840E-02 ppm1 8.036 ppm2 7.648 CV 1
ASSI { 1351}
(( segid " " and resid 52 and name HD1 ))
(( segid " " and resid 52 and name HD2 ))
1.800 0.400 0.400 peak 1351 spectrum 1 weight 0.10000E+01 volume 0.64837E-02 ppm1 3.079 ppm2 3.525 CV 1
ASSI { 1355}
(( segid " " and resid 29 and name HB ))
( segid " " and resid 29 and name HG2%)
2.500 0.800 0.800 peak 1355 spectrum 1 weight 0.10000E+01 volume 0.38151E-02 ppm1 1.720 ppm2 0.394 CV 1
ASSI { 1357}
(( segid " " and resid 10 and name HB1 ))
( segid " " and resid 10 and name HD2%)
2.500 0.800 0.800 peak 1357 spectrum 1 weight 0.10000E+01 volume 0.62043E-02 ppm1 1.775 ppm2 0.455 CV 1
OR { 1357}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 10 and name HD1%)
OR { 1357}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 10 and name HD2%)
OR { 1357}
(( segid " " and resid 10 and name HB1 ))
( segid " " and resid 10 and name HD1%)
ASSI { 1358}
(( segid " " and resid 12 and name HG12))
(( segid " " and resid 12 and name HB ))
2.400 0.700 0.700 peak 1358 spectrum 1 weight 0.10000E+01 volume 0.50671E-02 ppm1 1.180 ppm2 1.874 CV 1
OR { 1358}
(( segid " " and resid 12 and name HG11))
(( segid " " and resid 12 and name HB ))
ASSI { 1360}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 64 and name HG12))
2.500 0.800 0.800 peak 1360 spectrum 1 weight 0.10000E+01 volume 0.32043E-02 ppm1 0.631 ppm2 1.044 CV 1
OR { 1360}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 64 and name HG11))
ASSI { 1363}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 44 and name HN ))
2.700 0.900 0.900 peak 1363 spectrum 1 weight 0.10000E+01 volume 0.31265E-02 ppm1 9.251 ppm2 9.065 CV 1
ASSI { 1366}
(( segid " " and resid 43 and name HB ))
( segid " " and resid 43 and name HG2%)
2.100 0.500 0.500 peak 1366 spectrum 1 weight 0.10000E+01 volume 0.54779E-02 ppm1 2.041 ppm2 0.863 CV 1
ASSI { 1372}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 69 and name HB1 ))
2.700 0.900 0.900 peak 1372 spectrum 1 weight 0.10000E+01 volume 0.38726E-02 ppm1 0.947 ppm2 2.123 CV 1
OR { 1372}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 69 and name HB2 ))
ASSI { 1374}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 12 and name HG11))
2.700 0.900 0.900 peak 1374 spectrum 1 weight 0.10000E+01 volume 0.33806E-02 ppm1 0.924 ppm2 1.190 CV 1
OR { 1374}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 12 and name HG12))
ASSI { 1379}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 67 and name HN ))
2.300 0.700 0.700 peak 1379 spectrum 1 weight 0.10000E+01 volume 0.77404E-02 ppm1 8.180 ppm2 7.807 CV 1
ASSI { 1414}
(( segid " " and resid 15 and name HA2 ))
(( segid " " and resid 13 and name HA2 ))
2.000 2.000 4.000 peak 1414 spectrum 1 weight 0.10000E+01 volume 0.44050E-02 ppm1 3.889 ppm2 4.303 CV 1
OR { 1414}
(( segid " " and resid 15 and name HA1 ))
(( segid " " and resid 13 and name HA2 ))
ASSI { 1416}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 13 and name HA2 ))
2.500 0.800 0.800 peak 1416 spectrum 1 weight 0.10000E+01 volume 0.49315E-02 ppm1 3.781 ppm2 4.279 CV 1
ASSI { 1418}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 31 and name HB1 ))
1.600 0.300 0.600 peak 1418 spectrum 1 weight 0.10000E+01 volume 0.15748E-01 ppm1 3.219 ppm2 2.729 CV 1
ASSI { 1420}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HG2 ))
2.100 0.500 0.500 peak 1420 spectrum 1 weight 0.10000E+01 volume 0.96835E-02 ppm1 1.786 ppm2 2.220 CV 1
OR { 1420}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 25 and name HG1 ))
OR { 1420}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 25 and name HG2 ))
OR { 1420}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 25 and name HG1 ))
ASSI { 1425}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 69 and name HB1 ))
2.200 2.200 3.800 peak 1425 spectrum 1 weight 0.10000E+01 volume 0.13023E-01 ppm1 0.823 ppm2 2.120 CV 1
OR { 1425}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 69 and name HB2 ))
ASSI { 1429}
(( segid " " and resid 13 and name HA2 ))
(( segid " " and resid 13 and name HA1 ))
1.600 0.300 0.600 peak 1429 spectrum 1 weight 0.10000E+01 volume 0.20404E-01 ppm1 4.297 ppm2 4.025 CV 1
ASSI { 1432}
(( segid " " and resid 67 and name HB1 ))
( segid " " and resid 64 and name HG2%)
1.900 0.500 0.500 peak 1432 spectrum 1 weight 0.10000E+01 volume 0.15293E-01 ppm1 1.948 ppm2 0.742 CV 1
OR { 1432}
(( segid " " and resid 67 and name HB2 ))
( segid " " and resid 64 and name HG2%)
ASSI { 1437}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 54 and name HB2 ))
1.900 1.900 4.100 peak 1437 spectrum 1 weight 0.10000E+01 volume 0.21968E-01 ppm1 0.744 ppm2 1.532 CV 1
ASSI { 1439}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 19 and name HB ))
2.000 0.500 0.500 peak 1439 spectrum 1 weight 0.10000E+01 volume 0.10134E-01 ppm1 0.835 ppm2 1.844 CV 1
ASSI { 1441}
( segid " " and resid 41 and name HG2%)
( segid " " and resid 61 and name HB% )
2.100 0.600 0.600 peak 1441 spectrum 1 weight 0.10000E+01 volume 0.12145E-01 ppm1 0.814 ppm2 1.438 CV 1
ASSI { 1442}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 25 and name HB2 ))
2.900 1.000 1.000 peak 1442 spectrum 1 weight 0.10000E+01 volume 0.69383E-02 ppm1 0.867 ppm2 1.782 CV 1
OR { 1442}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 25 and name HB1 ))
ASSI { 1446}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 42 and name HB ))
2.400 0.700 0.700 peak 1446 spectrum 1 weight 0.10000E+01 volume 0.43488E-02 ppm1 0.731 ppm2 1.719 CV 1
ASSI { 1450}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 36 and name HB2 ))
1.600 0.300 0.600 peak 1450 spectrum 1 weight 0.10000E+01 volume 0.18202E-01 ppm1 3.946 ppm2 4.111 CV 1
ASSI { 1451}
(( segid " " and resid 32 and name HD1 ))
(( segid " " and resid 32 and name HD2 ))
1.600 0.300 0.600 peak 1451 spectrum 1 weight 0.10000E+01 volume 0.12161E-01 ppm1 3.666 ppm2 3.872 CV 1
ASSI { 1453}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 34 and name HB1 ))
1.700 0.400 0.500 peak 1453 spectrum 1 weight 0.10000E+01 volume 0.16027E-01 ppm1 3.129 ppm2 2.863 CV 1
ASSI { 1456}
(( segid " " and resid 69 and name HG2 ))
(( segid " " and resid 69 and name HG1 ))
1.700 0.400 0.500 peak 1456 spectrum 1 weight 0.10000E+01 volume 0.13223E-01 ppm1 2.523 ppm2 2.354 CV 1
ASSI { 1458}
(( segid " " and resid 10 and name HB1 ))
( segid " " and resid 12 and name HG2%)
2.300 2.300 3.700 peak 1458 spectrum 1 weight 0.10000E+01 volume 0.15349E-01 ppm1 1.776 ppm2 0.925 CV 1
OR { 1458}
(( segid " " and resid 10 and name HB2 ))
( segid " " and resid 12 and name HG2%)
ASSI { 1459}
(( segid " " and resid 39 and name HG12))
( segid " " and resid 39 and name HG2%)
2.200 0.600 0.600 peak 1459 spectrum 1 weight 0.10000E+01 volume 0.14404E-01 ppm1 1.665 ppm2 0.735 CV 1
OR { 1459}
(( segid " " and resid 39 and name HG11))
( segid " " and resid 39 and name HG2%)
ASSI { 1461}
(( segid " " and resid 52 and name HG1 ))
( segid " " and resid 43 and name HD1%)
1.800 1.800 4.200 peak 1461 spectrum 1 weight 0.10000E+01 volume 0.25012E-01 ppm1 1.540 ppm2 0.740 CV 1
ASSI { 1465}
(( segid " " and resid 23 and name HB2 ))
(( segid " " and resid 23 and name HB1 ))
1.500 0.300 0.700 peak 1465 spectrum 1 weight 0.10000E+01 volume 0.24434E-01 ppm1 2.981 ppm2 2.673 CV 1
ASSI { 1466}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 37 and name HB1 ))
1.600 0.300 0.600 peak 1466 spectrum 1 weight 0.10000E+01 volume 0.27881E-01 ppm1 2.938 ppm2 2.718 CV 1
ASSI { 1470}
(( segid " " and resid 35 and name HB1 ))
(( segid " " and resid 35 and name HB2 ))
1.500 0.300 0.700 peak 1470 spectrum 1 weight 0.10000E+01 volume 0.39029E-01 ppm1 2.563 ppm2 2.746 CV 1
ASSI { 1482}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 19 and name HG2%)
3.900 1.900 1.900 peak 1482 spectrum 1 weight 0.10000E+01 volume 0.65713E-03 ppm1 9.250 ppm2 0.800 CV 1
ASSI { 1489}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB1 ))
3.900 1.900 1.900 peak 1489 spectrum 1 weight 0.10000E+01 volume 0.69545E-03 ppm1 9.172 ppm2 1.837 CV 1
ASSI { 1499}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 68 and name HB ))
4.200 2.200 1.800 peak 1499 spectrum 1 weight 0.10000E+01 volume 0.39444E-03 ppm1 8.827 ppm2 2.265 CV 1
ASSI { 1515}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 52 and name HB1 ))
3.500 1.500 1.500 peak 1515 spectrum 1 weight 0.10000E+01 volume 0.86662E-03 ppm1 8.870 ppm2 1.458 CV 1
ASSI { 1521}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 41 and name HA ))
3.700 1.700 1.700 peak 1521 spectrum 1 weight 0.10000E+01 volume 0.28005E-03 ppm1 8.754 ppm2 4.524 CV 1
ASSI { 1522}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 41 and name HG2%)
4.200 2.200 1.800 peak 1522 spectrum 1 weight 0.10000E+01 volume 0.46644E-03 ppm1 8.754 ppm2 0.807 CV 1
ASSI { 1534}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 16 and name HG1%)
3.500 1.500 1.500 peak 1534 spectrum 1 weight 0.10000E+01 volume 0.97472E-03 ppm1 8.492 ppm2 0.834 CV 1
ASSI { 1536}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 63 and name HD2%)
2.800 2.800 3.200 peak 1536 spectrum 1 weight 0.10000E+01 volume 0.50471E-03 ppm1 8.420 ppm2 0.910 CV 1
OR { 1536}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 63 and name HD1%)
ASSI { 1540}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 69 and name HA ))
3.500 1.600 1.600 peak 1540 spectrum 1 weight 0.10000E+01 volume 0.59810E-03 ppm1 8.177 ppm2 4.307 CV 1
ASSI { 1547}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 14 and name HD2 ))
3.400 1.500 1.500 peak 1547 spectrum 1 weight 0.10000E+01 volume 0.10773E-02 ppm1 8.276 ppm2 3.778 CV 1
ASSI { 1561}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HB ))
3.800 1.800 1.800 peak 1561 spectrum 1 weight 0.10000E+01 volume 0.40298E-03 ppm1 8.420 ppm2 1.871 CV 1
ASSI { 1566}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB2 ))
4.300 2.300 1.700 peak 1566 spectrum 1 weight 0.10000E+01 volume 0.69383E-03 ppm1 8.374 ppm2 2.123 CV 1
OR { 1566}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 30 and name HB1 ))
ASSI { 1591}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 14 and name HB2 ))
3.500 1.500 1.500 peak 1591 spectrum 1 weight 0.10000E+01 volume 0.11076E-02 ppm1 8.276 ppm2 2.052 CV 1
OR { 1591}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 14 and name HB1 ))
ASSI { 1597}
(( segid " " and resid 69 and name HN ))
( segid " " and resid 65 and name HG2%)
4.300 2.300 1.700 peak 1597 spectrum 1 weight 0.10000E+01 volume 0.31300E-03 ppm1 8.177 ppm2 0.938 CV 1
ASSI { 1601}
(( segid " " and resid 35 and name HN ))
(( segid " " and resid 35 and name HA ))
3.300 1.400 1.400 peak 1601 spectrum 1 weight 0.10000E+01 volume 0.75290E-03 ppm1 8.092 ppm2 4.707 CV 1
ASSI { 1610}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 65 and name HA ))
3.700 1.700 1.700 peak 1610 spectrum 1 weight 0.10000E+01 volume 0.35754E-03 ppm1 8.039 ppm2 3.614 CV 1
ASSI { 1611}
(( segid " " and resid 39 and name HN ))
( segid " " and resid 39 and name HD1%)
4.100 2.100 1.900 peak 1611 spectrum 1 weight 0.10000E+01 volume 0.44726E-03 ppm1 8.039 ppm2 0.938 CV 1
ASSI { 1618}
(( segid " " and resid 26 and name HN ))
( segid " " and resid 44 and name HG2%)
3.500 1.600 1.600 peak 1618 spectrum 1 weight 0.10000E+01 volume 0.27462E-03 ppm1 7.748 ppm2 1.282 CV 1
ASSI { 1621}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HG1 ))
4.600 2.600 1.400 peak 1621 spectrum 1 weight 0.10000E+01 volume 0.33950E-03 ppm1 7.748 ppm2 2.227 CV 1
OR { 1621}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HG2 ))
ASSI { 1650}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 34 and name HB1 ))
4.100 2.100 1.900 peak 1650 spectrum 1 weight 0.10000E+01 volume 0.56816E-03 ppm1 7.260 ppm2 2.863 CV 1
ASSI { 1656}
( segid " " and resid 31 and name HD% )
(( segid " " and resid 32 and name HD1 ))
4.900 3.000 1.100 peak 1656 spectrum 1 weight 0.10000E+01 volume 0.34429E-03 ppm1 7.215 ppm2 3.663 CV 1
ASSI { 1682}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 54 and name HB2 ))
4.300 2.300 1.700 peak 1682 spectrum 1 weight 0.10000E+01 volume 0.56578E-03 ppm1 5.410 ppm2 1.512 CV 1
ASSI { 1693}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 12 and name HD1%)
4.100 2.100 1.900 peak 1693 spectrum 1 weight 0.10000E+01 volume 0.67946E-03 ppm1 4.246 ppm2 0.862 CV 1
ASSI { 1695}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 52 and name HB2 ))
2.500 0.800 0.800 peak 1695 spectrum 1 weight 0.10000E+01 volume 0.30945E-02 ppm1 4.783 ppm2 1.663 CV 1
ASSI { 1698}
(( segid " " and resid 67 and name HA ))
( segid " " and resid 65 and name HG2%)
3.800 3.800 2.200 peak 1698 spectrum 1 weight 0.10000E+01 volume 0.82392E-03 ppm1 4.172 ppm2 0.938 CV 1
ASSI { 1700}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 51 and name HB2 ))
2.900 1.100 1.100 peak 1700 spectrum 1 weight 0.10000E+01 volume 0.15593E-02 ppm1 4.783 ppm2 1.957 CV 1
ASSI { 1703}
(( segid " " and resid 13 and name HA2 ))
( segid " " and resid 12 and name HG2%)
2.200 2.200 3.800 peak 1703 spectrum 1 weight 0.10000E+01 volume 0.21988E-02 ppm1 4.275 ppm2 0.938 CV 1
ASSI { 1705}
(( segid " " and resid 45 and name HA ))
(( segid " " and resid 25 and name HA ))
3.400 1.400 1.400 peak 1705 spectrum 1 weight 0.10000E+01 volume 0.57654E-03 ppm1 4.997 ppm2 4.405 CV 1
ASSI { 1707}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 41 and name HN ))
2.700 0.900 0.900 peak 1707 spectrum 1 weight 0.10000E+01 volume 0.20675E-02 ppm1 4.757 ppm2 9.167 CV 1
ASSI { 1709}
(( segid " " and resid 38 and name HA ))
(( segid " " and resid 37 and name HN ))
3.700 1.700 1.700 peak 1709 spectrum 1 weight 0.10000E+01 volume 0.15696E-02 ppm1 4.739 ppm2 8.792 CV 1
ASSI { 1723}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 69 and name HN ))
3.200 1.300 1.300 peak 1723 spectrum 1 weight 0.10000E+01 volume 0.89533E-03 ppm1 4.142 ppm2 8.159 CV 1
ASSI { 1724}
(( segid " " and resid 36 and name HB2 ))
(( segid " " and resid 39 and name HN ))
3.800 1.800 1.800 peak 1724 spectrum 1 weight 0.10000E+01 volume 0.16466E-02 ppm1 4.118 ppm2 8.018 CV 1
ASSI { 1742}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HB ))
2.600 0.900 0.900 peak 1742 spectrum 1 weight 0.10000E+01 volume 0.32737E-02 ppm1 4.235 ppm2 1.871 CV 1
ASSI { 1743}
(( segid " " and resid 49 and name HA ))
(( segid " " and resid 49 and name HB1 ))
2.200 0.600 0.600 peak 1743 spectrum 1 weight 0.10000E+01 volume 0.72815E-02 ppm1 4.214 ppm2 1.797 CV 1
ASSI { 1757}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 23 and name HB1 ))
4.900 3.000 1.100 peak 1757 spectrum 1 weight 0.10000E+01 volume 0.60206E-03 ppm1 4.246 ppm2 2.698 CV 1
ASSI { 1759}
(( segid " " and resid 32 and name HD2 ))
(( segid " " and resid 31 and name HB1 ))
2.800 1.000 1.000 peak 1759 spectrum 1 weight 0.10000E+01 volume 0.11160E-02 ppm1 3.878 ppm2 2.720 CV 1
ASSI { 1763}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 61 and name HN ))
4.100 2.100 1.900 peak 1763 spectrum 1 weight 0.10000E+01 volume 0.43331E-03 ppm1 4.018 ppm2 7.737 CV 1
ASSI { 1764}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 38 and name HG1 ))
3.400 1.400 1.400 peak 1764 spectrum 1 weight 0.10000E+01 volume 0.87181E-03 ppm1 3.997 ppm2 1.351 CV 1
OR { 1764}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 38 and name HG1 ))
ASSI { 1769}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 60 and name HB1 ))
3.100 1.200 1.200 peak 1769 spectrum 1 weight 0.10000E+01 volume 0.10761E-02 ppm1 3.815 ppm2 2.036 CV 1
ASSI { 1770}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 14 and name HG1 ))
3.400 1.500 1.500 peak 1770 spectrum 1 weight 0.10000E+01 volume 0.14284E-02 ppm1 3.781 ppm2 2.123 CV 1
OR { 1770}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 14 and name HB2 ))
ASSI { 1790}
(( segid " " and resid 53 and name HB2 ))
(( segid " " and resid 11 and name HB1 ))
3.900 1.900 1.900 peak 1790 spectrum 1 weight 0.10000E+01 volume 0.38574E-03 ppm1 3.587 ppm2 3.152 CV 1
ASSI { 1793}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HN ))
4.400 2.400 1.600 peak 1793 spectrum 1 weight 0.10000E+01 volume 0.41535E-03 ppm1 3.620 ppm2 8.822 CV 1
ASSI { 1806}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 12 and name HB ))
4.000 2.000 2.000 peak 1806 spectrum 1 weight 0.10000E+01 volume 0.59249E-03 ppm1 3.149 ppm2 1.871 CV 1
ASSI { 1807}
(( segid " " and resid 52 and name HD1 ))
( segid " " and resid 16 and name HG2%)
4.100 2.100 1.900 peak 1807 spectrum 1 weight 0.10000E+01 volume 0.35961E-03 ppm1 3.075 ppm2 1.044 CV 1
ASSI { 1827}
(( segid " " and resid 34 and name HB1 ))
(( segid " " and resid 34 and name HA ))
3.100 1.200 1.200 peak 1827 spectrum 1 weight 0.10000E+01 volume 0.11774E-02 ppm1 2.872 ppm2 4.734 CV 1
ASSI { 1831}
(( segid " " and resid 37 and name HB2 ))
( segid " " and resid 39 and name HG2%)
4.200 2.200 1.800 peak 1831 spectrum 1 weight 0.10000E+01 volume 0.45007E-03 ppm1 2.950 ppm2 0.746 CV 1
ASSI { 1845}
(( segid " " and resid 23 and name HB1 ))
(( segid " " and resid 23 and name HA ))
3.000 1.100 1.100 peak 1845 spectrum 1 weight 0.10000E+01 volume 0.16742E-02 ppm1 2.683 ppm2 4.734 CV 1
ASSI { 1863}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 20 and name HA ))
2.600 0.900 0.900 peak 1863 spectrum 1 weight 0.10000E+01 volume 0.23784E-02 ppm1 1.831 ppm2 4.241 CV 1
OR { 1863}
(( segid " " and resid 20 and name HB1 ))
(( segid " " and resid 20 and name HA ))
ASSI { 1873}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 14 and name HD2 ))
3.100 1.200 1.200 peak 1873 spectrum 1 weight 0.10000E+01 volume 0.42293E-02 ppm1 2.086 ppm2 3.778 CV 1
ASSI { 1885}
(( segid " " and resid 69 and name HB1 ))
(( segid " " and resid 65 and name HA ))
3.600 1.700 1.700 peak 1885 spectrum 1 weight 0.10000E+01 volume 0.70183E-03 ppm1 2.139 ppm2 3.614 CV 1
OR { 1885}
(( segid " " and resid 69 and name HB2 ))
(( segid " " and resid 65 and name HA ))
ASSI { 1891}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 60 and name HN ))
4.100 2.100 1.900 peak 1891 spectrum 1 weight 0.10000E+01 volume 0.10629E-02 ppm1 1.904 ppm2 8.626 CV 1
ASSI { 1896}
(( segid " " and resid 39 and name HG11))
(( segid " " and resid 39 and name HN ))
2.700 0.900 0.900 peak 1896 spectrum 1 weight 0.10000E+01 volume 0.31293E-02 ppm1 1.639 ppm2 8.008 CV 1
OR { 1896}
(( segid " " and resid 39 and name HG12))
(( segid " " and resid 39 and name HN ))
ASSI { 1900}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 31 and name HN ))
3.300 1.300 1.300 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.94759E-03 ppm1 1.965 ppm2 8.365 CV 1
ASSI { 1919}
(( segid " " and resid 65 and name HB ))
(( segid " " and resid 62 and name HN ))
2.500 2.500 3.500 peak 1919 spectrum 1 weight 0.10000E+01 volume 0.11303E-02 ppm1 1.831 ppm2 7.903 CV 1
ASSI { 1930}
(( segid " " and resid 52 and name HB1 ))
(( segid " " and resid 52 and name HD1 ))
3.300 1.400 1.400 peak 1930 spectrum 1 weight 0.10000E+01 volume 0.11822E-02 ppm1 1.432 ppm2 3.060 CV 1
ASSI { 1933}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 70 and name HD1 ))
2.800 0.900 0.900 peak 1933 spectrum 1 weight 0.10000E+01 volume 0.25703E-02 ppm1 1.931 ppm2 3.218 CV 1
ASSI { 1936}
(( segid " " and resid 20 and name HG1 ))
(( segid " " and resid 23 and name HB2 ))
2.700 0.900 0.900 peak 1936 spectrum 1 weight 0.10000E+01 volume 0.23868E-02 ppm1 1.393 ppm2 3.009 CV 1
ASSI { 1942}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 24 and name HA ))
3.300 1.400 1.400 peak 1942 spectrum 1 weight 0.10000E+01 volume 0.17484E-02 ppm1 1.766 ppm2 3.614 CV 1
OR { 1942}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 24 and name HA ))
ASSI { 1944}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 45 and name HN ))
3.500 1.600 1.600 peak 1944 spectrum 1 weight 0.10000E+01 volume 0.13206E-02 ppm1 1.766 ppm2 8.861 CV 1
OR { 1944}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 45 and name HN ))
ASSI { 1951}
(( segid " " and resid 20 and name HG2 ))
(( segid " " and resid 20 and name HN ))
3.900 1.900 1.900 peak 1951 spectrum 1 weight 0.10000E+01 volume 0.88376E-03 ppm1 1.546 ppm2 8.645 CV 1
ASSI { 1961}
(( segid " " and resid 49 and name HG1 ))
(( segid " " and resid 50 and name HN ))
4.100 2.100 1.900 peak 1961 spectrum 1 weight 0.10000E+01 volume 0.57374E-03 ppm1 1.467 ppm2 8.538 CV 1
ASSI { 1963}
( segid " " and resid 61 and name HB% )
(( segid " " and resid 43 and name HN ))
2.900 2.900 3.100 peak 1963 spectrum 1 weight 0.10000E+01 volume 0.47601E-03 ppm1 1.419 ppm2 9.408 CV 1
ASSI { 1971}
(( segid " " and resid 29 and name HG12))
(( segid " " and resid 31 and name HB1 ))
3.600 1.600 1.600 peak 1971 spectrum 1 weight 0.10000E+01 volume 0.10677E-02 ppm1 1.373 ppm2 2.741 CV 1
OR { 1971}
(( segid " " and resid 29 and name HG11))
(( segid " " and resid 31 and name HB1 ))
ASSI { 1973}
( segid " " and resid 18 and name HB% )
(( segid " " and resid 19 and name HA ))
4.200 2.200 1.800 peak 1973 spectrum 1 weight 0.10000E+01 volume 0.35119E-03 ppm1 1.332 ppm2 4.307 CV 1
ASSI { 1985}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 13 and name HA2 ))
4.600 2.700 1.400 peak 1985 spectrum 1 weight 0.10000E+01 volume 0.28384E-03 ppm1 0.860 ppm2 4.270 CV 1
ASSI { 1988}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 19 and name HA ))
3.500 1.500 1.500 peak 1988 spectrum 1 weight 0.10000E+01 volume 0.13318E-02 ppm1 0.825 ppm2 4.307 CV 1
ASSI { 2005}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 53 and name HA ))
4.700 2.800 1.300 peak 2005 spectrum 1 weight 0.10000E+01 volume 0.39400E-03 ppm1 0.868 ppm2 5.404 CV 1
ASSI { 2010}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 27 and name HA ))
4.300 2.400 1.700 peak 2010 spectrum 1 weight 0.10000E+01 volume 0.36707E-03 ppm1 0.868 ppm2 5.221 CV 1
ASSI { 2011}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 65 and name HN ))
3.900 1.900 1.900 peak 2011 spectrum 1 weight 0.10000E+01 volume 0.76566E-03 ppm1 0.804 ppm2 8.414 CV 1
ASSI { 2017}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 28 and name HN ))
4.100 2.100 1.900 peak 2017 spectrum 1 weight 0.10000E+01 volume 0.40258E-03 ppm1 0.766 ppm2 8.852 CV 1
ASSI { 2020}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 61 and name HA ))
4.500 2.600 1.500 peak 2020 spectrum 1 weight 0.10000E+01 volume 0.33826E-03 ppm1 0.766 ppm2 3.810 CV 1
ASSI { 2021}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 61 and name HA ))
3.900 1.900 1.900 peak 2021 spectrum 1 weight 0.10000E+01 volume 0.60925E-03 ppm1 0.732 ppm2 3.810 CV 1
ASSI { 2030}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 31 and name HD% )
4.500 2.500 1.500 peak 2030 spectrum 1 weight 0.10000E+01 volume 0.21358E-03 ppm1 0.390 ppm2 7.211 CV 1
ASSI { 2035}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 52 and name HN ))
3.400 1.500 1.500 peak 2035 spectrum 1 weight 0.10000E+01 volume 0.54141E-03 ppm1 9.414 ppm2 9.167 CV 1
ASSI { 2036}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 39 and name HN ))
3.800 1.800 1.800 peak 2036 spectrum 1 weight 0.10000E+01 volume 0.81355E-03 ppm1 7.575 ppm2 8.018 CV 1
ASSI { 2050}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 20 and name HN ))
3.900 1.900 1.900 peak 2050 spectrum 1 weight 0.10000E+01 volume 0.11551E-02 ppm1 8.242 ppm2 8.645 CV 1
ASSI { 2054}
(( segid " " and resid 25 and name HG2 ))
(( segid " " and resid 52 and name HG2 ))
3.300 1.400 1.400 peak 2054 spectrum 1 weight 0.10000E+01 volume 0.19886E-02 ppm1 2.208 ppm2 1.607 CV 1
OR { 2054}
(( segid " " and resid 25 and name HG1 ))
(( segid " " and resid 52 and name HG2 ))
ASSI { 2057}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 66 and name HN ))
3.400 1.400 1.400 peak 2057 spectrum 1 weight 0.10000E+01 volume 0.16163E-02 ppm1 8.192 ppm2 7.636 CV 1
ASSI { 2058}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 65 and name HN ))
3.300 1.300 1.300 peak 2058 spectrum 1 weight 0.10000E+01 volume 0.92284E-03 ppm1 7.811 ppm2 8.414 CV 1
ASSI { 2075}
(( segid " " and resid 24 and name HB ))
( segid " " and resid 24 and name HG2%)
2.100 0.500 0.500 peak 2075 spectrum 1 weight 0.10000E+01 volume 0.89494E-02 ppm1 1.944 ppm2 0.688 CV 1
ASSI { 2076}
( segid " " and resid 65 and name HG2%)
(( segid " " and resid 65 and name HB ))
2.000 0.500 0.500 peak 2076 spectrum 1 weight 0.10000E+01 volume 0.13578E-01 ppm1 0.950 ppm2 1.837 CV 1
ASSI { 2080}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 52 and name HG2 ))
3.000 3.000 3.000 peak 2080 spectrum 1 weight 0.10000E+01 volume 0.76247E-02 ppm1 0.766 ppm2 1.586 CV 1
ASSI { 2081}
( segid " " and resid 43 and name HD1%)
(( segid " " and resid 52 and name HG2 ))
2.600 0.800 0.800 peak 2081 spectrum 1 weight 0.10000E+01 volume 0.68507E-02 ppm1 0.732 ppm2 1.586 CV 1
ASSI { 2083}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 64 and name HB ))
2.200 0.600 0.600 peak 2083 spectrum 1 weight 0.10000E+01 volume 0.68426E-02 ppm1 0.732 ppm2 1.871 CV 1
ASSI { 2085}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HB ))
2.400 0.700 0.700 peak 2085 spectrum 1 weight 0.10000E+01 volume 0.64118E-02 ppm1 0.868 ppm2 1.871 CV 1
ASSI { 2093}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 43 and name HG2%)
2.900 2.900 3.100 peak 2093 spectrum 1 weight 0.10000E+01 volume 0.71497E-02 ppm1 0.398 ppm2 0.862 CV 1
! strongcutoff: 1.500 medcutoff: 0.750
! pseudo atoms:
! 15 HA# 1.0
! 16 HG2# 1.0
! 16 HG1# 1.0
! 17 HB# 1.0
! 18 HB# 1.0
! 19 HG1# 1.0
! 20 HB# 1.0
! 20 HG# 1.0
! 21 HG## 3.0
! 22 HB# 1.0
! 24 HG## 3.0
! 24 HD## 3.0
! 25 HG# 1.0
! 25 HB# 1.0
! 29 HG2# 1.0
! 30 HB# 1.0
! 31 HD# 1.0
! 32 HB# 1.0
! 41 HG2# 1.0
! 61 HB# 1.0
! 63 HD2# 1.0
! 67 HB# 1.0
! intra: 0 seq: 112 med: 34 long: 42 or: 0
! Intra
! Sequential
assign (resid 11 and name HB1) (resid 12 and name HN) 5.0 3.2 0.0 ! peak: 6 intensity: 0.37 order:1 {?}
assign (resid 11 and name HB1) (resid 12 and name HN) 5.0 3.2 0.0 ! peak: 6 intensity: 0.37 order:1 {?}
assign (resid 12 and name HA) (resid 13 and name HN) 5.0 3.2 0.0 ! peak: 8 intensity: 0.66 order:1 {?}
assign (resid 13 and name HA2) (resid 14 and name HD1) 3.4 1.6 0.0 ! peak: 9 intensity: 1.37 order:0 {?}
assign (resid 13 and name HA1) (resid 14 and name HD1) 2.8 1.0 0.0 ! peak: 10 intensity: 2.31 order:0 {?}
assign (resid 13 and name HA1) (resid 14 and name HD2) 2.8 1.0 0.0 ! peak: 11 intensity: 2.86 order:0 {?}
assign (resid 14 and name HA) (resid 15 and name HN) 2.8 1.0 0.0 ! peak: 12 intensity: 3.84 order:0 {?}
assign (resid 14 and name HD1) (resid 15 and name HN) 5.0 3.2 0.0 ! peak: 13 intensity: 0.46 order:1 {?}
assign (resid 14 and name HD2) (resid 15 and name HN) 5.0 3.2 0.0 ! peak: 14 intensity: 0.60 order:1 {?}
assign (resid 14 and name HD1) (resid 15 and name HA%) 2.8 1.0 1.0 ! peak: 18 intensity: 1.80 order:1 {?}
assign (resid 15 and name HA%) (resid 16 and name HN) 3.4 1.6 1.0 ! peak: 17 intensity: 0.87 order:0 {?}
assign (resid 15 and name HA%) (resid 16 and name HN) 3.4 1.6 1.0 ! peak: 17 intensity: 0.87 order:0 {?}
assign (resid 16 and name HB) (resid 17 and name HN) 3.4 1.6 0.0 ! peak: 21 intensity: 1.32 order:1 {?}
assign (resid 16 and name HG2%) (resid 17 and name HN) 5.0 3.2 1.0 ! peak: 22 intensity: 0.39 order:1 {?}
assign (resid 16 and name HG1%) (resid 17 and name HN) 2.8 1.0 1.0 ! peak: 23 intensity: 1.91 order:1 {?}
assign (resid 17 and name HA) (resid 18 and name HN) 5.0 3.2 0.0 ! peak: 26 intensity: 0.71 order:1 {?}
assign (resid 17 and name HB%) (resid 18 and name HN) 5.0 3.2 1.0 ! peak: 28 intensity: 0.46 order:1 {?}
assign (resid 17 and name HN) (resid 18 and name HN) 3.4 1.6 0.0 ! peak: 31 intensity: 0.76 order:1 {?}
assign (resid 17 and name HA) (resid 18 and name HB%) 3.4 1.6 1.0 ! peak: 37 intensity: 0.80 order:1 {?}
assign (resid 18 and name HN) (resid 19 and name HG1%) 5.0 3.2 1.0 ! peak: 43 intensity: 0.44 order:0 {?}
assign (resid 18 and name HB%) (resid 19 and name HN) 3.4 1.6 1.0 ! peak: 45 intensity: 1.27 order:1 {?}
assign (resid 19 and name HA) (resid 20 and name HN) 2.8 1.0 0.0 ! peak: 46 intensity: 4.47 order:1 {?}
assign (resid 19 and name HN) (resid 20 and name HN) 5.0 3.2 0.0 ! peak: 47 intensity: 0.17 order:1 {?}
assign (resid 20 and name HA) (resid 21 and name HN) 2.8 1.0 0.0 ! peak: 58 intensity: 5.61 order:1 {?}
assign (resid 20 and name HB%) (resid 21 and name HN) 3.4 1.6 1.0 ! peak: 59 intensity: 1.40 order:1 {?}
assign (resid 20 and name HG%) (resid 21 and name HN) 5.0 3.2 1.0 ! peak: 60 intensity: 0.40 order:1 {?}
assign (resid 21 and name HN) (resid 22 and name HN) 2.8 1.0 0.0 ! peak: 72 intensity: 2.27 order:1 {?}
assign (resid 21 and name HA) (resid 22 and name HN) 5.0 3.2 0.0 ! peak: 74 intensity: 0.72 order:1 {?}
assign (resid 21 and name HG%%) (resid 22 and name HN) 5.0 3.2 3.0 ! peak: 75 intensity: 0.58 order:1 {?}
assign (resid 22 and name HN) (resid 23 and name HN) 2.8 1.0 0.0 ! peak: 81 intensity: 1.77 order:1 {?}
assign (resid 22 and name HA) (resid 23 and name HN) 5.0 3.2 0.0 ! peak: 83 intensity: 0.54 order:1 {?}
assign (resid 22 and name HB%) (resid 23 and name HN) 2.8 1.0 1.0 ! peak: 86 intensity: 1.53 order:1 {?}
assign (resid 23 and name HB1) (resid 24 and name HN) 5.0 3.2 0.0 ! peak: 92 intensity: 0.25 order:1 {?}
assign (resid 23 and name HB2) (resid 24 and name HN) 5.0 3.2 0.0 ! peak: 93 intensity: 0.25 order:1 {?}
assign (resid 24 and name HA) (resid 25 and name HN) 2.8 1.0 0.0 ! peak: 101 intensity: 3.30 order:1 {?}
assign (resid 24 and name HB) (resid 25 and name HN) 5.0 3.2 0.0 ! peak: 114 intensity: 0.29 order:1 {?}
assign (resid 24 and name HG%%) (resid 25 and name HN) 3.4 1.6 3.0 ! peak: 115 intensity: 0.93 order:1 {?}
assign (resid 25 and name HA) (resid 26 and name HN) 5.0 3.2 0.0 ! peak: 122 intensity: 0.29 order:1 {?}
assign (resid 25 and name HN) (resid 26 and name HN) 2.8 1.0 0.0 ! peak: 123 intensity: 2.18 order:1 {?}
assign (resid 25 and name HB%) (resid 26 and name HN) 2.8 1.0 1.0 ! peak: 125 intensity: 2.02 order:1 {?}
assign (resid 25 and name HG%) (resid 26 and name HN) 5.0 3.2 1.0 ! peak: 126 intensity: 0.45 order:1 {?}
assign (resid 26 and name HN) (resid 27 and name HN) 3.4 1.6 0.0 ! peak: 130 intensity: 1.00 order:1 {?}
assign (resid 27 and name HA) (resid 28 and name HN) 2.8 1.0 0.0 ! peak: 132 intensity: 2.54 order:0 {?}
assign (resid 27 and name HA) (resid 28 and name HN) 2.8 1.0 0.0 ! peak: 132 intensity: 2.54 order:0 {?}
assign (resid 27 and name HB1) (resid 28 and name HN) 3.4 1.6 0.0 ! peak: 143 intensity: 1.00 order:1 {?}
assign (resid 28 and name HA) (resid 29 and name HN) 5.0 3.2 0.0 ! peak: 149 intensity: 0.69 order:1 {?}
assign (resid 28 and name HB1) (resid 29 and name HN) 5.0 3.2 0.0 ! peak: 150 intensity: 0.33 order:1 {?}
assign (resid 28 and name HB2) (resid 29 and name HN) 5.0 3.2 0.0 ! peak: 151 intensity: 0.50 order:1 {?}
assign (resid 28 and name HB1) (resid 29 and name HB) 3.4 1.6 0.0 ! peak: 243 intensity: 0.77 order:1 {?}
assign (resid 28 and name HB2) (resid 29 and name HB) 5.0 3.2 0.0 ! peak: 244 intensity: 0.57 order:1 {?}
assign (resid 29 and name HN) (resid 30 and name HN) 5.0 3.2 0.0 ! peak: 154 intensity: 0.63 order:1 {?}
assign (resid 29 and name HN) (resid 30 and name HN) 5.0 3.2 0.0 ! peak: 154 intensity: 0.63 order:1 {?}
assign (resid 29 and name HG2%) (resid 30 and name HN) 5.0 3.2 1.0 ! peak: 155 intensity: 0.75 order:1 {?}
assign (resid 30 and name HA) (resid 31 and name HN) 3.4 1.6 0.0 ! peak: 158 intensity: 1.12 order:1 {?}
assign (resid 30 and name HB%) (resid 31 and name HN) 5.0 3.2 1.0 ! peak: 159 intensity: 0.56 order:1 {?}
assign (resid 31 and name HB2) (resid 32 and name HD2) 3.4 1.6 0.0 ! peak: 161 intensity: 1.19 order:0 {?}
assign (resid 31 and name HD%) (resid 32 and name HD2) 5.0 3.2 1.0 ! peak: 169 intensity: 0.36 order:1 {?}
assign (resid 31 and name HB2) (resid 32 and name HD1) 5.0 3.2 0.0 ! peak: 170 intensity: 0.33 order:1 {?}
assign (resid 32 and name HA) (resid 33 and name HN) 5.0 3.2 0.0 ! peak: 175 intensity: 0.63 order:1 {?}
assign (resid 32 and name HB%) (resid 33 and name HN) 5.0 3.2 1.0 ! peak: 177 intensity: 0.39 order:1 {?}
assign (resid 34 and name HN) (resid 35 and name HN) 3.4 1.6 0.0 ! peak: 182 intensity: 1.07 order:0 {?}
assign (resid 34 and name HN) (resid 35 and name HN) 3.4 1.6 0.0 ! peak: 182 intensity: 1.07 order:0 {?}
assign (resid 35 and name HN) (resid 36 and name HB2) 2.8 1.0 0.0 ! peak: 187 intensity: 1.54 order:0 {?}
assign (resid 35 and name HN) (resid 36 and name HB2) 2.8 1.0 0.0 ! peak: 187 intensity: 1.54 order:0 {?}
assign (resid 36 and name HN) (resid 37 and name HN) 5.0 3.2 0.0 ! peak: 190 intensity: 0.50 order:0 {?}
assign (resid 37 and name HN) (resid 38 and name HN) 5.0 3.2 0.0 ! peak: 194 intensity: 0.38 order:1 {?}
assign (resid 37 and name HA) (resid 38 and name HN) 5.0 3.2 0.0 ! peak: 196 intensity: 0.50 order:1 {?}
assign (resid 38 and name HN) (resid 39 and name HN) 5.0 3.2 0.0 ! peak: 198 intensity: 0.48 order:0 {?}
assign (resid 38 and name HA) (resid 39 and name HN) 3.4 1.6 0.0 ! peak: 206 intensity: 1.26 order:1 {?}
assign (resid 38 and name HG2) (resid 39 and name HN) 3.4 1.6 0.0 ! peak: 210 intensity: 1.43 order:1 {?}
assign (resid 39 and name HA) (resid 40 and name HN) 2.8 1.0 0.0 ! peak: 212 intensity: 2.70 order:0 {?}
assign (resid 40 and name HA) (resid 41 and name HN) 3.4 1.6 0.0 ! peak: 226 intensity: 1.16 order:1 {?}
assign (resid 41 and name HA) (resid 42 and name HN) 5.0 3.2 0.0 ! peak: 241 intensity: 0.21 order:1 {?}
assign (resid 43 and name HN) (resid 44 and name HN) 5.0 3.2 0.0 ! peak: 245 intensity: 0.60 order:0 {?}
assign (resid 43 and name HA) (resid 44 and name HN) 2.8 1.0 0.0 ! peak: 251 intensity: 2.03 order:0 {?}
assign (resid 43 and name HN) (resid 44 and name HB) 5.0 3.2 0.0 ! peak: 253 intensity: 0.32 order:0 {?}
assign (resid 43 and name HB) (resid 44 and name HN) 5.0 3.2 0.0 ! peak: 264 intensity: 0.21 order:1 {?}
assign (resid 44 and name HB) (resid 45 and name HN) 5.0 3.2 0.0 ! peak: 271 intensity: 0.29 order:1 {?}
assign (resid 44 and name HB) (resid 45 and name HN) 5.0 3.2 0.0 ! peak: 271 intensity: 0.29 order:1 {?}
assign (resid 44 and name HG1) (resid 45 and name HN) 3.4 1.6 0.0 ! peak: 272 intensity: 1.25 order:1 {?}
assign (resid 44 and name HG1) (resid 45 and name HA) 5.0 3.2 0.0 ! peak: 278 intensity: 0.33 order:1 {?}
assign (resid 49 and name HA) (resid 50 and name HN) 5.0 3.2 0.0 ! peak: 296 intensity: 0.66 order:0 {?}
assign (resid 50 and name HA1) (resid 51 and name HA) 5.0 3.2 0.0 ! peak: 293 intensity: 0.49 order:0 {?}
assign (resid 53 and name HB2) (resid 54 and name HN) 5.0 3.2 0.0 ! peak: 299 intensity: 0.46 order:1 {?}
assign (resid 53 and name HN) (resid 54 and name HN) 5.0 3.2 0.0 ! peak: 304 intensity: 0.34 order:1 {?}
assign (resid 53 and name HA) (resid 54 and name HN) 2.8 1.0 0.0 ! peak: 305 intensity: 2.60 order:1 {?}
assign (resid 60 and name HN) (resid 61 and name HN) 3.4 1.6 0.0 ! peak: 306 intensity: 1.11 order:0 {?}
assign (resid 60 and name HA) (resid 61 and name HN) 5.0 3.2 0.0 ! peak: 307 intensity: 0.47 order:0 {?}
assign (resid 61 and name HA) (resid 62 and name HN) 5.0 3.2 0.0 ! peak: 315 intensity: 0.43 order:1 {?}
assign (resid 61 and name HN) (resid 62 and name HN) 2.8 1.0 0.0 ! peak: 318 intensity: 1.87 order:1 {?}
assign (resid 61 and name HB%) (resid 62 and name HN) 2.8 1.0 1.0 ! peak: 322 intensity: 2.29 order:1 {?}
assign (resid 61 and name HB%) (resid 62 and name HA) 5.0 3.2 1.0 ! peak: 323 intensity: 0.31 order:1 {?}
assign (resid 61 and name HN) (resid 62 and name HA) 5.0 3.2 0.0 ! peak: 326 intensity: 0.20 order:1 {?}
assign (resid 62 and name HN) (resid 63 and name HN) 2.8 1.0 0.0 ! peak: 331 intensity: 2.45 order:1 {?}
assign (resid 62 and name HA) (resid 63 and name HN) 5.0 3.2 0.0 ! peak: 333 intensity: 0.66 order:1 {?}
assign (resid 63 and name HA) (resid 64 and name HN) 5.0 3.2 0.0 ! peak: 340 intensity: 0.72 order:1 {?}
assign (resid 63 and name HA) (resid 64 and name HN) 5.0 3.2 0.0 ! peak: 340 intensity: 0.72 order:1 {?}
assign (resid 63 and name HD2%) (resid 64 and name HN) 5.0 3.2 1.0 ! peak: 341 intensity: 0.29 order:1 {?}
assign (resid 64 and name HN) (resid 65 and name HN) 2.8 1.0 0.0 ! peak: 346 intensity: 1.90 order:1 {?}
assign (resid 64 and name HA) (resid 65 and name HN) 5.0 3.2 0.0 ! peak: 347 intensity: 0.64 order:1 {?}
assign (resid 65 and name HN) (resid 66 and name HN) 3.4 1.6 0.0 ! peak: 335 intensity: 1.37 order:1 {?}
assign (resid 65 and name HN) (resid 66 and name HN) 3.4 1.6 0.0 ! peak: 335 intensity: 1.37 order:1 {?}
assign (resid 65 and name HN) (resid 66 and name HN) 3.4 1.6 0.0 ! peak: 335 intensity: 1.37 order:1 {?}
assign (resid 65 and name HA) (resid 66 and name HN) 5.0 3.2 0.0 ! peak: 349 intensity: 0.69 order:1 {?}
assign (resid 67 and name HN) (resid 68 and name HN) 2.8 1.0 0.0 ! peak: 357 intensity: 2.53 order:0 {?}
assign (resid 67 and name HN) (resid 68 and name HN) 2.8 1.0 0.0 ! peak: 357 intensity: 2.53 order:0 {?}
assign (resid 67 and name HN) (resid 68 and name HN) 2.8 1.0 0.0 ! peak: 357 intensity: 2.53 order:0 {?}
assign (resid 67 and name HB%) (resid 68 and name HN) 2.8 1.0 1.0 ! peak: 364 intensity: 1.70 order:1 {?}
assign (resid 68 and name HN) (resid 69 and name HN) 2.8 1.0 0.0 ! peak: 370 intensity: 3.68 order:1 {?}
assign (resid 68 and name HA) (resid 69 and name HN) 3.4 1.6 0.0 ! peak: 372 intensity: 1.47 order:1 {?}
assign (resid 69 and name HB1) (resid 70 and name HN) 5.0 3.2 0.0 ! peak: 375 intensity: 0.65 order:1 {?}
assign (resid 69 and name HN) (resid 70 and name HN) 2.8 1.0 0.0 ! peak: 377 intensity: 2.30 order:1 {?}
! Medium
assign (resid 16 and name HB) (resid 18 and name HN) 5.0 3.2 0.0 ! peak: 27 intensity: 0.74 order:1 {?}
assign (resid 16 and name HG2%) (resid 18 and name HN) 5.0 3.2 1.0 ! peak: 29 intensity: 0.43 order:1 {?}
assign (resid 20 and name HN) (resid 23 and name HB1) 5.0 3.2 0.0 ! peak: 52 intensity: 0.23 order:0 {?}
assign (resid 20 and name HN) (resid 23 and name HB2) 5.0 3.2 0.0 ! peak: 53 intensity: 0.10 order:0 {?}
assign (resid 20 and name HB%) (resid 22 and name HN) 2.8 1.0 1.0 ! peak: 71 intensity: 1.90 order:1 {?}
assign (resid 21 and name HA) (resid 24 and name HD%%) 5.0 3.2 3.0 ! peak: 70 intensity: 0.40 order:0 {?}
assign (resid 21 and name HN) (resid 23 and name HN) 5.0 3.2 0.0 ! peak: 80 intensity: 0.30 order:1 {?}
assign (resid 21 and name HA) (resid 23 and name HN) 5.0 3.2 0.0 ! peak: 84 intensity: 0.36 order:1 {?}
assign (resid 21 and name HA) (resid 24 and name HN) 5.0 3.2 0.0 ! peak: 90 intensity: 0.42 order:1 {?}
assign (resid 22 and name HA) (resid 24 and name HN) 5.0 3.2 0.0 ! peak: 77 intensity: 0.28 order:0 {?}
assign (resid 22 and name HA) (resid 24 and name HN) 5.0 3.2 0.0 ! peak: 77 intensity: 0.28 order:0 {?}
assign (resid 22 and name HB%) (resid 24 and name HN) 5.0 3.2 1.0 ! peak: 79 intensity: 0.56 order:0 {?}
assign (resid 24 and name HA) (resid 26 and name HN) 5.0 3.2 0.0 ! peak: 121 intensity: 0.43 order:1 {?}
assign (resid 24 and name HG%%) (resid 26 and name HN) 2.8 1.0 3.0 ! peak: 129 intensity: 1.62 order:1 {?}
assign (resid 34 and name HN) (resid 36 and name HN) 5.0 3.2 0.0 ! peak: 183 intensity: 0.57 order:0 {?}
assign (resid 34 and name HA) (resid 36 and name HN) 3.4 1.6 0.0 ! peak: 189 intensity: 0.83 order:1 {?}
assign (resid 60 and name HA) (resid 63 and name HN) 5.0 3.2 0.0 ! peak: 308 intensity: 0.43 order:0 {?}
assign (resid 60 and name HA) (resid 62 and name HN) 5.0 3.2 0.0 ! peak: 316 intensity: 0.39 order:1 {?}
assign (resid 60 and name HN) (resid 62 and name HN) 5.0 3.2 0.0 ! peak: 321 intensity: 0.15 order:1 {?}
assign (resid 61 and name HA) (resid 64 and name HB) 2.8 1.0 0.0 ! peak: 314 intensity: 1.77 order:0 {?}
assign (resid 61 and name HA) (resid 63 and name HN) 5.0 3.2 0.0 ! peak: 330 intensity: 0.13 order:1 {?}
assign (resid 61 and name HA) (resid 64 and name HN) 5.0 3.2 0.0 ! peak: 336 intensity: 0.57 order:1 {?}
assign (resid 62 and name HA) (resid 64 and name HN) 5.0 3.2 0.0 ! peak: 328 intensity: 0.37 order:0 {?}
assign (resid 62 and name HA) (resid 64 and name HN) 5.0 3.2 0.0 ! peak: 328 intensity: 0.37 order:0 {?}
assign (resid 62 and name HA) (resid 65 and name HN) 5.0 3.2 0.0 ! peak: 329 intensity: 0.64 order:0 {?}
assign (resid 63 and name HA) (resid 65 and name HN) 5.0 3.2 0.0 ! peak: 345 intensity: 0.72 order:1 {?}
assign (resid 64 and name HA) (resid 67 and name HN) 5.0 3.2 0.0 ! peak: 352 intensity: 0.56 order:1 {?}
assign (resid 64 and name HA) (resid 68 and name HN) 5.0 3.2 0.0 ! peak: 359 intensity: 0.26 order:1 {?}
assign (resid 65 and name HN) (resid 67 and name HN) 3.4 1.6 0.0 ! peak: 353 intensity: 0.82 order:1 {?}
assign (resid 65 and name HA) (resid 67 and name HN) 5.0 3.2 0.0 ! peak: 354 intensity: 0.26 order:1 {?}
assign (resid 65 and name HA) (resid 68 and name HN) 5.0 3.2 0.0 ! peak: 360 intensity: 0.25 order:1 {?}
assign (resid 65 and name HA) (resid 69 and name HN) 5.0 3.2 0.0 ! peak: 365 intensity: 0.30 order:1 {?}
assign (resid 66 and name HA) (resid 69 and name HN) 3.4 1.6 0.0 ! peak: 366 intensity: 0.90 order:1 {?}
assign (resid 67 and name HN) (resid 69 and name HN) 2.8 1.0 0.0 ! peak: 368 intensity: 2.45 order:1 {?}
! Long
assign (resid 20 and name HB%) (resid 46 and name HN) 5.0 3.2 1.0 ! peak: 119 intensity: 0.69 order:0 {?}
assign (resid 24 and name HA) (resid 45 and name HA) 5.0 3.2 0.0 ! peak: 99 intensity: 0.60 order:0 {?}
assign (resid 24 and name HA) (resid 44 and name HN) 5.0 3.2 0.0 ! peak: 258 intensity: 0.34 order:1 {?}
assign (resid 24 and name HA) (resid 46 and name HN) 5.0 3.2 0.0 ! peak: 279 intensity: 0.73 order:1 {?}
assign (resid 25 and name HN) (resid 44 and name HB) 5.0 3.2 0.0 ! peak: 109 intensity: 0.33 order:0 {?}
assign (resid 25 and name HN) (resid 44 and name HB) 5.0 3.2 0.0 ! peak: 109 intensity: 0.33 order:0 {?}
assign (resid 25 and name HN) (resid 44 and name HN) 2.8 1.0 0.0 ! peak: 111 intensity: 1.93 order:0 {?}
assign (resid 25 and name HN) (resid 46 and name HN) 3.4 1.6 0.0 ! peak: 113 intensity: 1.21 order:0 {?}
assign (resid 25 and name HB%) (resid 44 and name HB) 3.4 1.6 1.0 ! peak: 116 intensity: 0.93 order:0 {?}
assign (resid 25 and name HB%) (resid 46 and name HN) 2.8 1.0 1.0 ! peak: 118 intensity: 2.22 order:0 {?}
assign (resid 25 and name HN) (resid 45 and name HN) 5.0 3.2 0.0 ! peak: 270 intensity: 0.23 order:1 {?}
assign (resid 25 and name HN) (resid 45 and name HA) 5.0 3.2 0.0 ! peak: 273 intensity: 0.68 order:1 {?}
assign (resid 26 and name HN) (resid 44 and name HG1) 5.0 3.2 0.0 ! peak: 128 intensity: 0.36 order:0 {?}
assign (resid 26 and name HN) (resid 44 and name HG1) 5.0 3.2 0.0 ! peak: 128 intensity: 0.36 order:0 {?}
assign (resid 26 and name HN) (resid 44 and name HN) 5.0 3.2 0.0 ! peak: 260 intensity: 0.55 order:1 {?}
assign (resid 26 and name HN) (resid 45 and name HA) 5.0 3.2 0.0 ! peak: 274 intensity: 0.33 order:1 {?}
assign (resid 27 and name HA) (resid 43 and name HA) 3.4 1.6 0.0 ! peak: 135 intensity: 0.75 order:0 {?}
assign (resid 27 and name HB3) (resid 41 and name HG2%) 3.4 1.6 1.0 ! peak: 235 intensity: 1.11 order:1 {?}
assign (resid 27 and name HA) (resid 42 and name HN) 5.0 3.2 0.0 ! peak: 237 intensity: 0.13 order:1 {?}
assign (resid 27 and name HA) (resid 33 and name HA) 3.4 1.6 0.0 ! peak: 249 intensity: 1.29 order:1 {?}
assign (resid 27 and name HA) (resid 44 and name HN) 5.0 3.2 0.0 ! peak: 261 intensity: 0.22 order:1 {?}
assign (resid 27 and name HB1) (resid 44 and name HN) 5.0 3.2 0.0 ! peak: 262 intensity: 0.14 order:1 {?}
assign (resid 28 and name HB2) (resid 42 and name HB) 5.0 3.2 0.0 ! peak: 147 intensity: 0.66 order:0 {?}
assign (resid 28 and name HB2) (resid 42 and name HB) 5.0 3.2 0.0 ! peak: 147 intensity: 0.66 order:0 {?}
assign (resid 28 and name HB1) (resid 42 and name HN) 5.0 3.2 0.0 ! peak: 238 intensity: 0.12 order:1 {?}
assign (resid 28 and name HB2) (resid 42 and name HN) 5.0 3.2 0.0 ! peak: 239 intensity: 0.14 order:1 {?}
assign (resid 28 and name HN) (resid 43 and name HA) 5.0 3.2 0.0 ! peak: 250 intensity: 0.64 order:1 {?}
assign (resid 29 and name HG2%) (resid 41 and name HG2%) 2.8 1.0 2.0 ! peak: 236 intensity: 3.55 order:1 {?}
assign (resid 32 and name HA) (resid 38 and name HN) 3.4 1.6 0.0 ! peak: 165 intensity: 0.90 order:0 {?}
assign (resid 32 and name HA) (resid 38 and name HN) 3.4 1.6 0.0 ! peak: 165 intensity: 0.90 order:0 {?}
assign (resid 32 and name HB%) (resid 38 and name HN) 5.0 3.2 1.0 ! peak: 193 intensity: 0.30 order:1 {?}
assign (resid 32 and name HD1) (resid 39 and name HA) 3.4 1.6 0.0 ! peak: 213 intensity: 1.02 order:1 {?}
assign (resid 32 and name HD2) (resid 39 and name HA) 5.0 3.2 0.0 ! peak: 214 intensity: 0.73 order:1 {?}
assign (resid 32 and name HD2) (resid 39 and name HB) 5.0 3.2 0.0 ! peak: 215 intensity: 0.56 order:1 {?}
assign (resid 41 and name HN) (resid 53 and name HA) 5.0 3.2 0.0 ! peak: 232 intensity: 0.32 order:0 {?}
assign (resid 41 and name HN) (resid 54 and name HN) 5.0 3.2 0.0 ! peak: 301 intensity: 0.24 order:1 {?}
assign (resid 41 and name HB) (resid 54 and name HN) 5.0 3.2 0.0 ! peak: 302 intensity: 0.51 order:1 {?}
assign (resid 42 and name HG21) (resid 53 and name HA) 5.0 3.2 0.0 ! peak: 218 intensity: 0.28 order:0 {?}
assign (resid 42 and name HG21) (resid 53 and name HA) 5.0 3.2 0.0 ! peak: 218 intensity: 0.28 order:0 {?}
assign (resid 43 and name HN) (resid 52 and name HN) 5.0 3.2 0.0 ! peak: 229 intensity: 0.54 order:1 {?}
assign (resid 43 and name HN) (resid 53 and name HA) 5.0 3.2 0.0 ! peak: 247 intensity: 0.23 order:0 {?}
assign (resid 43 and name HN) (resid 54 and name HN) 5.0 3.2 0.0 ! peak: 303 intensity: 0.13 order:1 {?}
! Or
ASSI { 11}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 42 and name HG2%)
3.300 1.400 1.400 peak 11 spectrum 1 weight 0.10000E+01 volume 0.23508E-02 ppm1 9.407 ppm2 0.721 CV 1
OR { 11}
(( segid " " and resid 43 and name HN ))
( segid " " and resid 43 and name HD1%)
ASSI { 14}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 51 and name HB1 ))
3.600 3.600 2.400 peak 14 spectrum 1 weight 0.10000E+01 volume 0.10290E-02 ppm1 9.407 ppm2 1.851 CV 1
OR { 14}
(( segid " " and resid 43 and name HN ))
(( segid " " and resid 64 and name HB ))
ASSI { 23}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 52 and name HB1 ))
3.400 3.400 2.600 peak 23 spectrum 1 weight 0.10000E+01 volume 0.22463E-02 ppm1 9.250 ppm2 1.458 CV 1
OR { 23}
(( segid " " and resid 25 and name HN ))
(( segid " " and resid 49 and name HG1 ))
ASSI { 34}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 43 and name HD1%)
4.700 2.700 1.300 peak 34 spectrum 1 weight 0.10000E+01 volume 0.76566E-03 ppm1 9.250 ppm2 0.745 CV 1
OR { 34}
(( segid " " and resid 25 and name HN ))
( segid " " and resid 64 and name HG2%)
ASSI { 42}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HA ))
2.700 0.900 0.900 peak 42 spectrum 1 weight 0.10000E+01 volume 0.23337E-02 ppm1 9.170 ppm2 4.771 CV 1
OR { 42}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HA ))
ASSI { 43}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 43 and name HA ))
2.300 0.700 0.700 peak 43 spectrum 1 weight 0.10000E+01 volume 0.36504E-02 ppm1 9.068 ppm2 4.831 CV 1
OR { 43}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 30 and name HA ))
ASSI { 50}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB2 ))
2.800 1.000 1.000 peak 50 spectrum 1 weight 0.10000E+01 volume 0.31217E-02 ppm1 9.169 ppm2 1.946 CV 1
OR { 50}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB2 ))
ASSI { 53}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 40 and name HB1 ))
3.500 1.600 1.600 peak 53 spectrum 1 weight 0.10000E+01 volume 0.12776E-02 ppm1 9.171 ppm2 1.865 CV 1
OR { 53}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 51 and name HB1 ))
ASSI { 55}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 14 and name HG1 ))
3.700 1.700 1.700 peak 55 spectrum 1 weight 0.10000E+01 volume 0.60168E-03 ppm1 9.166 ppm2 2.122 CV 1
OR { 55}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 14 and name HB2 ))
OR { 55}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 60 and name HB2 ))
ASSI { 60}
(( segid " " and resid 41 and name HN ))
(( segid " " and resid 54 and name HB2 ))
3.500 1.500 1.500 peak 60 spectrum 1 weight 0.10000E+01 volume 0.95440E-03 ppm1 9.172 ppm2 1.515 CV 1
OR { 60}
(( segid " " and resid 52 and name HN ))
(( segid " " and resid 52 and name HG1 ))
ASSI { 70}
(( segid " " and resid 41 and name HN ))
( segid " " and resid 41 and name HG1%)
3.500 1.500 1.500 peak 70 spectrum 1 weight 0.10000E+01 volume 0.10873E-02 ppm1 9.171 ppm2 0.735 CV 1
OR { 70}
(( segid " " and resid 52 and name HN ))
( segid " " and resid 42 and name HG2%)
ASSI { 72}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 43 and name HD1%)
3.900 1.900 1.900 peak 72 spectrum 1 weight 0.10000E+01 volume 0.12269E-02 ppm1 9.070 ppm2 0.723 CV 1
OR { 72}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 42 and name HG2%)
OR { 72}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 24 and name HG2%)
OR { 72}
(( segid " " and resid 44 and name HN ))
( segid " " and resid 41 and name HG1%)
ASSI { 81}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 11 and name HB2 ))
3.500 1.600 1.600 peak 81 spectrum 1 weight 0.10000E+01 volume 0.84344E-03 ppm1 9.059 ppm2 3.195 CV 1
OR { 81}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 31 and name HB2 ))
ASSI { 83}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 29 and name HN ))
3.900 1.900 1.900 peak 83 spectrum 1 weight 0.10000E+01 volume 0.76128E-03 ppm1 9.068 ppm2 8.456 CV 1
OR { 83}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 27 and name HN ))
ASSI { 84}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HB1 ))
3.900 1.900 1.900 peak 84 spectrum 1 weight 0.10000E+01 volume 0.72615E-03 ppm1 9.062 ppm2 1.778 CV 1
OR { 84}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 10 and name HB2 ))
OR { 84}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 25 and name HB2 ))
OR { 84}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 25 and name HB1 ))
ASSI { 85}
(( segid " " and resid 11 and name HN ))
(( segid " " and resid 12 and name HB ))
3.400 1.500 1.500 peak 85 spectrum 1 weight 0.10000E+01 volume 0.14096E-02 ppm1 9.062 ppm2 1.866 CV 1
OR { 85}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 19 and name HB ))
OR { 85}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 40 and name HB1 ))
ASSI { 118}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 43 and name HD1%)
3.100 3.100 2.900 peak 118 spectrum 1 weight 0.10000E+01 volume 0.35458E-02 ppm1 8.866 ppm2 0.740 CV 1
OR { 118}
(( segid " " and resid 45 and name HN ))
( segid " " and resid 42 and name HG2%)
ASSI { 122}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 45 and name HG ))
2.400 0.700 0.700 peak 122 spectrum 1 weight 0.10000E+01 volume 0.29665E-02 ppm1 8.866 ppm2 1.665 CV 1
OR { 122}
(( segid " " and resid 45 and name HN ))
(( segid " " and resid 52 and name HB2 ))
ASSI { 131}
(( segid " " and resid 53 and name HN ))
(( segid " " and resid 53 and name HB2 ))
3.800 1.800 1.800 peak 131 spectrum 1 weight 0.10000E+01 volume 0.78161E-03 ppm1 8.827 ppm2 3.616 CV 1
OR { 131}
(( segid " " and resid 28 and name HN ))
(( segid " " and resid 28 and name HB1 ))
ASSI { 140}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 29 and name HN ))
4.100 2.100 1.900 peak 140 spectrum 1 weight 0.10000E+01 volume 0.30854E-03 ppm1 8.771 ppm2 8.452 CV 1
OR { 140}
(( segid " " and resid 42 and name HN ))
(( segid " " and resid 27 and name HN ))
ASSI { 144}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 41 and name HG1%)
3.500 1.500 1.500 peak 144 spectrum 1 weight 0.10000E+01 volume 0.87338E-03 ppm1 8.750 ppm2 0.750 CV 1
OR { 144}
(( segid " " and resid 42 and name HN ))
( segid " " and resid 42 and name HG2%)
ASSI { 164}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HG2 ))
3.800 1.800 1.800 peak 164 spectrum 1 weight 0.10000E+01 volume 0.10466E-02 ppm1 8.653 ppm2 1.549 CV 1
OR { 164}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 54 and name HB2 ))
ASSI { 169}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 19 and name HG1%)
3.900 1.900 1.900 peak 169 spectrum 1 weight 0.10000E+01 volume 0.78280E-03 ppm1 8.630 ppm2 0.723 CV 1
OR { 169}
(( segid " " and resid 60 and name HN ))
( segid " " and resid 43 and name HD1%)
OR { 169}
(( segid " " and resid 60 and name HN ))
( segid " " and resid 41 and name HG1%)
ASSI { 184}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 42 and name HG2%)
3.300 3.300 2.700 peak 184 spectrum 1 weight 0.10000E+01 volume 0.14583E-02 ppm1 8.295 ppm2 0.740 CV 1
OR { 184}
(( segid " " and resid 36 and name HN ))
( segid " " and resid 39 and name HG2%)
OR { 184}
(( segid " " and resid 51 and name HN ))
( segid " " and resid 43 and name HD1%)
ASSI { 187}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 39 and name HG2%)
3.800 1.800 1.800 peak 187 spectrum 1 weight 0.10000E+01 volume 0.10102E-02 ppm1 8.445 ppm2 0.723 CV 1
OR { 187}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 41 and name HG1%)
ASSI { 189}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 41 and name HG2%)
3.700 1.700 1.700 peak 189 spectrum 1 weight 0.10000E+01 volume 0.23102E-02 ppm1 8.482 ppm2 0.805 CV 1
OR { 189}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 19 and name HG2%)
ASSI { 191}
(( segid " " and resid 16 and name HN ))
( segid " " and resid 43 and name HD1%)
3.500 1.500 1.500 peak 191 spectrum 1 weight 0.10000E+01 volume 0.98710E-03 ppm1 8.518 ppm2 0.742 CV 1
OR { 191}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 42 and name HG2%)
OR { 191}
(( segid " " and resid 50 and name HN ))
( segid " " and resid 43 and name HD1%)
ASSI { 195}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 45 and name HG ))
3.700 1.700 1.700 peak 195 spectrum 1 weight 0.10000E+01 volume 0.98510E-03 ppm1 8.512 ppm2 1.654 CV 1
OR { 195}
(( segid " " and resid 50 and name HN ))
(( segid " " and resid 52 and name HB2 ))
OR { 195}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 52 and name HB2 ))
OR { 195}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 45 and name HG ))
ASSI { 197}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 52 and name HG1 ))
3.500 1.500 1.500 peak 197 spectrum 1 weight 0.10000E+01 volume 0.10888E-02 ppm1 8.505 ppm2 1.509 CV 1
OR { 197}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 17 and name HD1 ))
OR { 197}
(( segid " " and resid 16 and name HN ))
(( segid " " and resid 17 and name HD2 ))
ASSI { 208}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HG12))
4.700 2.800 1.300 peak 208 spectrum 1 weight 0.10000E+01 volume 0.32063E-03 ppm1 8.423 ppm2 1.048 CV 1
OR { 208}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 64 and name HG11))
OR { 208}
(( segid " " and resid 65 and name HN ))
( segid " " and resid 68 and name HG2%)
ASSI { 222}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 67 and name HA ))
2.700 0.900 0.900 peak 222 spectrum 1 weight 0.10000E+01 volume 0.25384E-02 ppm1 7.810 ppm2 4.157 CV 1
OR { 222}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 66 and name HA ))
ASSI { 229}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 63 and name HA ))
3.500 1.500 1.500 peak 229 spectrum 1 weight 0.10000E+01 volume 0.76085E-03 ppm1 8.418 ppm2 4.144 CV 1
OR { 229}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 66 and name HA ))
ASSI { 233}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 25 and name HA ))
2.300 2.300 3.700 peak 233 spectrum 1 weight 0.10000E+01 volume 0.57854E-02 ppm1 8.277 ppm2 4.404 CV 1
OR { 233}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 14 and name HA ))
OR { 233}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 39 and name HA ))
ASSI { 245}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HA ))
3.400 1.400 1.400 peak 245 spectrum 1 weight 0.10000E+01 volume 0.11152E-02 ppm1 8.036 ppm2 4.165 CV 1
OR { 245}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 66 and name HA ))
ASSI { 250}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 14 and name HA ))
3.300 1.300 1.300 peak 250 spectrum 1 weight 0.10000E+01 volume 0.96954E-03 ppm1 8.305 ppm2 4.418 CV 1
OR { 250}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 25 and name HA ))
ASSI { 259}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB1 ))
3.200 1.300 1.300 peak 259 spectrum 1 weight 0.10000E+01 volume 0.22028E-02 ppm1 7.749 ppm2 1.778 CV 1
OR { 259}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB1 ))
OR { 259}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 25 and name HB2 ))
ASSI { 261}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 44 and name HG1 ))
2.700 0.900 0.900 peak 261 spectrum 1 weight 0.10000E+01 volume 0.28556E-02 ppm1 8.294 ppm2 1.289 CV 1
OR { 261}
(( segid " " and resid 46 and name HN ))
( segid " " and resid 44 and name HG2%)
OR { 261}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 44 and name HG1 ))
ASSI { 270}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HB1 ))
2.900 1.100 1.100 peak 270 spectrum 1 weight 0.10000E+01 volume 0.13143E-02 ppm1 7.742 ppm2 2.018 CV 1
OR { 270}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 43 and name HB ))
ASSI { 271}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 64 and name HB ))
2.300 0.600 0.600 peak 271 spectrum 1 weight 0.10000E+01 volume 0.50671E-02 ppm1 7.840 ppm2 1.871 CV 1
OR { 271}
(( segid " " and resid 64 and name HN ))
(( segid " " and resid 63 and name HB2 ))
ASSI { 273}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB ))
2.700 0.900 0.900 peak 273 spectrum 1 weight 0.10000E+01 volume 0.51471E-02 ppm1 8.018 ppm2 1.879 CV 1
OR { 273}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HB2 ))
ASSI { 279}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 25 and name HB2 ))
1.700 1.700 4.300 peak 279 spectrum 1 weight 0.10000E+01 volume 0.15952E-01 ppm1 8.292 ppm2 1.800 CV 1
OR { 279}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 25 and name HB1 ))
OR { 279}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 49 and name HB1 ))
OR { 279}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 49 and name HB1 ))
ASSI { 284}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HG11))
2.200 0.600 0.600 peak 284 spectrum 1 weight 0.10000E+01 volume 0.10809E-01 ppm1 8.021 ppm2 1.678 CV 1
OR { 284}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 38 and name HB1 ))
OR { 284}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HG12))
ASSI { 286}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 24 and name HB ))
2.200 0.600 0.600 peak 286 spectrum 1 weight 0.10000E+01 volume 0.85144E-02 ppm1 8.300 ppm2 1.950 CV 1
OR { 286}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 51 and name HB2 ))
ASSI { 290}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HB2 ))
2.900 1.100 1.100 peak 290 spectrum 1 weight 0.10000E+01 volume 0.25268E-02 ppm1 8.295 ppm2 1.661 CV 1
OR { 290}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HG ))
OR { 290}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 32 and name HG1 ))
OR { 290}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 45 and name HG ))
ASSI { 298}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HB1 ))
2.900 2.900 3.100 peak 298 spectrum 1 weight 0.10000E+01 volume 0.31440E-02 ppm1 8.292 ppm2 1.461 CV 1
OR { 298}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 38 and name HG2 ))
OR { 298}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 52 and name HB1 ))
ASSI { 299}
(( segid " " and resid 12 and name HN ))
(( segid " " and resid 10 and name HG ))
2.900 2.900 3.100 peak 299 spectrum 1 weight 0.10000E+01 volume 0.15437E-02 ppm1 8.280 ppm2 1.416 CV 1
OR { 299}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 38 and name HG2 ))
OR { 299}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 52 and name HB1 ))
ASSI { 300}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 70 and name HB2 ))
3.300 1.400 1.400 peak 300 spectrum 1 weight 0.10000E+01 volume 0.20600E-02 ppm1 8.195 ppm2 1.948 CV 1
OR { 300}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 307}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 39 and name HB ))
3.200 1.300 1.300 peak 307 spectrum 1 weight 0.10000E+01 volume 0.13713E-02 ppm1 8.445 ppm2 1.937 CV 1
OR { 307}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 311}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 64 and name HB ))
4.000 2.000 2.000 peak 311 spectrum 1 weight 0.10000E+01 volume 0.67669E-03 ppm1 7.801 ppm2 1.881 CV 1
OR { 311}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 70 and name HB1 ))
ASSI { 314}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 26 and name HB2 ))
3.200 1.300 1.300 peak 314 spectrum 1 weight 0.10000E+01 volume 0.77604E-03 ppm1 7.749 ppm2 1.897 CV 1
OR { 314}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 64 and name HB ))
OR { 314}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 62 and name HB1 ))
ASSI { 316}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 26 and name HB1 ))
4.500 2.500 1.500 peak 316 spectrum 1 weight 0.10000E+01 volume 0.49196E-03 ppm1 8.451 ppm2 1.775 CV 1
OR { 316}
(( segid " " and resid 27 and name HN ))
(( segid " " and resid 25 and name HB1 ))
ASSI { 322}
(( segid " " and resid 29 and name HN ))
(( segid " " and resid 28 and name HA ))
3.200 1.300 1.300 peak 322 spectrum 1 weight 0.10000E+01 volume 0.93245E-03 ppm1 8.452 ppm2 4.784 CV 1
OR { 322}
(( segid " " and resid 40 and name HN ))
(( segid " " and resid 40 and name HA ))
ASSI { 328}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 66 and name HN ))
3.100 1.200 1.200 peak 328 spectrum 1 weight 0.10000E+01 volume 0.10346E-02 ppm1 8.420 ppm2 7.634 CV 1
OR { 328}
(( segid " " and resid 65 and name HN ))
(( segid " " and resid 63 and name HN ))
ASSI { 330}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 41 and name HN ))
3.700 1.700 1.700 peak 330 spectrum 1 weight 0.10000E+01 volume 0.79955E-03 ppm1 8.369 ppm2 9.168 CV 1
OR { 330}
(( segid " " and resid 21 and name HN ))
(( segid " " and resid 19 and name HN ))
ASSI { 336}
(( segid " " and resid 46 and name HN ))
(( segid " " and resid 45 and name HN ))
3.200 1.300 1.300 peak 336 spectrum 1 weight 0.10000E+01 volume 0.12464E-02 ppm1 8.292 ppm2 8.857 CV 1
OR { 336}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 45 and name HN ))
ASSI { 342}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 35 and name HA ))
3.300 1.400 1.400 peak 342 spectrum 1 weight 0.10000E+01 volume 0.14136E-02 ppm1 8.269 ppm2 4.736 CV 1
OR { 342}
(( segid " " and resid 36 and name HN ))
(( segid " " and resid 34 and name HA ))
ASSI { 344}
(( segid " " and resid 15 and name HN ))
(( segid " " and resid 14 and name HD1 ))
4.100 2.100 1.900 peak 344 spectrum 1 weight 0.10000E+01 volume 0.48838E-03 ppm1 8.244 ppm2 3.619 CV 1
OR { 344}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 24 and name HA ))
ASSI { 395}
(( segid " " and resid 23 and name HN ))
( segid " " and resid 22 and name HB% )
2.700 0.900 0.900 peak 395 spectrum 1 weight 0.10000E+01 volume 0.32613E-02 ppm1 7.665 ppm2 1.378 CV 1
OR { 395}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 20 and name HG1 ))
ASSI { 399}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 68 and name HA ))
4.500 2.500 1.500 peak 399 spectrum 1 weight 0.10000E+01 volume 0.35179E-03 ppm1 7.746 ppm2 4.109 CV 1
OR { 399}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 63 and name HA ))
ASSI { 401}
(( segid " " and resid 61 and name HN ))
(( segid " " and resid 60 and name HA ))
3.500 1.500 1.500 peak 401 spectrum 1 weight 0.10000E+01 volume 0.13633E-02 ppm1 7.747 ppm2 3.997 CV 1
OR { 401}
(( segid " " and resid 26 and name HN ))
(( segid " " and resid 44 and name HB ))
ASSI { 416}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HA ))
2.700 0.900 0.900 peak 416 spectrum 1 weight 0.10000E+01 volume 0.25767E-02 ppm1 7.640 ppm2 4.137 CV 1
OR { 416}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HA ))
ASSI { 419}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 62 and name HB2 ))
2.200 0.600 0.600 peak 419 spectrum 1 weight 0.10000E+01 volume 0.54103E-02 ppm1 7.640 ppm2 1.953 CV 1
OR { 419}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 423}
(( segid " " and resid 66 and name HN ))
( segid " " and resid 65 and name HG2%)
3.200 1.300 1.300 peak 423 spectrum 1 weight 0.10000E+01 volume 0.10489E-02 ppm1 7.642 ppm2 0.940 CV 1
OR { 423}
(( segid " " and resid 63 and name HN ))
( segid " " and resid 63 and name HD1%)
ASSI { 432}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HA ))
3.100 1.200 1.200 peak 432 spectrum 1 weight 0.10000E+01 volume 0.10932E-02 ppm1 7.575 ppm2 4.750 CV 1
OR { 432}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 37 and name HA ))
ASSI { 434}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 38 and name HB1 ))
2.600 0.900 0.900 peak 434 spectrum 1 weight 0.10000E+01 volume 0.46401E-02 ppm1 7.573 ppm2 1.688 CV 1
OR { 434}
(( segid " " and resid 38 and name HN ))
(( segid " " and resid 32 and name HG1 ))
ASSI { 453}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 19 and name HG2%)
3.400 1.400 1.400 peak 453 spectrum 1 weight 0.10000E+01 volume 0.13973E-02 ppm1 7.367 ppm2 0.836 CV 1
OR { 453}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 16 and name HG1%)
ASSI { 471}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 35 and name HB2 ))
3.900 1.900 1.900 peak 471 spectrum 1 weight 0.10000E+01 volume 0.56259E-03 ppm1 7.267 ppm2 2.742 CV 1
OR { 471}
(( segid " " and resid 34 and name HN ))
(( segid " " and resid 9 and name HB1 ))
ASSI { 545}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 65 and name HG2%)
4.100 2.100 1.900 peak 545 spectrum 1 weight 0.10000E+01 volume 0.51228E-03 ppm1 3.940 ppm2 0.932 CV 1
OR { 545}
(( segid " " and resid 62 and name HA ))
( segid " " and resid 63 and name HD1%)
ASSI { 554}
(( segid " " and resid 13 and name HA2 ))
( segid " " and resid 12 and name HD1%)
1.800 1.800 4.200 peak 554 spectrum 1 weight 0.10000E+01 volume 0.93322E-02 ppm1 4.275 ppm2 0.856 CV 1
OR { 554}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 19 and name HG2%)
OR { 554}
(( segid " " and resid 13 and name HA2 ))
( segid " " and resid 16 and name HG1%)
ASSI { 560}
(( segid " " and resid 43 and name HA ))
(( segid " " and resid 52 and name HB1 ))
3.200 3.200 2.800 peak 560 spectrum 1 weight 0.10000E+01 volume 0.20073E-02 ppm1 4.837 ppm2 1.460 CV 1
OR { 560}
(( segid " " and resid 43 and name HA ))
( segid " " and resid 61 and name HB% )
ASSI { 592}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB1 ))
2.800 1.000 1.000 peak 592 spectrum 1 weight 0.10000E+01 volume 0.37561E-02 ppm1 4.781 ppm2 2.724 CV 1
OR { 592}
(( segid " " and resid 40 and name HA ))
(( segid " " and resid 40 and name HG2 ))
ASSI { 597}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HB1 ))
3.100 1.200 1.200 peak 597 spectrum 1 weight 0.10000E+01 volume 0.18210E-02 ppm1 4.755 ppm2 2.713 CV 1
OR { 597}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 23 and name HB1 ))
ASSI { 610}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 30 and name HN ))
2.400 2.400 3.600 peak 610 spectrum 1 weight 0.10000E+01 volume 0.22124E-02 ppm1 4.529 ppm2 9.064 CV 1
OR { 610}
(( segid " " and resid 41 and name HA ))
(( segid " " and resid 44 and name HN ))
ASSI { 616}
(( segid " " and resid 70 and name HA ))
(( segid " " and resid 70 and name HN ))
2.600 0.800 0.800 peak 616 spectrum 1 weight 0.10000E+01 volume 0.36488E-02 ppm1 4.309 ppm2 7.955 CV 1
OR { 616}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 70 and name HN ))
ASSI { 641}
(( segid " " and resid 13 and name HA2 ))
(( segid " " and resid 13 and name HN ))
2.600 0.900 0.900 peak 641 spectrum 1 weight 0.10000E+01 volume 0.31596E-02 ppm1 4.278 ppm2 8.285 CV 1
OR { 641}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 46 and name HN ))
ASSI { 652}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HN ))
3.000 1.100 1.100 peak 652 spectrum 1 weight 0.10000E+01 volume 0.14814E-02 ppm1 4.146 ppm2 7.812 CV 1
OR { 652}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HN ))
ASSI { 655}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 13 and name HN ))
3.200 1.300 1.300 peak 655 spectrum 1 weight 0.10000E+01 volume 0.12508E-02 ppm1 3.778 ppm2 8.276 CV 1
OR { 655}
(( segid " " and resid 14 and name HD2 ))
(( segid " " and resid 15 and name HN ))
ASSI { 669}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 62 and name HB2 ))
2.600 2.600 3.400 peak 669 spectrum 1 weight 0.10000E+01 volume 0.78242E-02 ppm1 4.143 ppm2 1.948 CV 1
OR { 669}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 70 and name HB2 ))
OR { 669}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HB1 ))
OR { 669}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 671}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 39 and name HB ))
2.600 0.900 0.900 peak 671 spectrum 1 weight 0.10000E+01 volume 0.27734E-02 ppm1 4.410 ppm2 1.916 CV 1
OR { 671}
(( segid " " and resid 25 and name HA ))
(( segid " " and resid 24 and name HB ))
ASSI { 676}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB2 ))
2.500 0.800 0.800 peak 676 spectrum 1 weight 0.10000E+01 volume 0.33467E-02 ppm1 4.172 ppm2 1.958 CV 1
OR { 676}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 70 and name HB2 ))
OR { 676}
(( segid " " and resid 67 and name HA ))
(( segid " " and resid 67 and name HB1 ))
ASSI { 690}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 49 and name HG1 ))
2.600 2.600 3.400 peak 690 spectrum 1 weight 0.10000E+01 volume 0.63119E-02 ppm1 4.269 ppm2 1.449 CV 1
OR { 690}
(( segid " " and resid 13 and name HA2 ))
(( segid " " and resid 52 and name HB1 ))
OR { 690}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 52 and name HB1 ))
ASSI { 706}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 9 and name HB1 ))
2.400 0.700 0.700 peak 706 spectrum 1 weight 0.10000E+01 volume 0.66951E-02 ppm1 4.011 ppm2 2.729 CV 1
OR { 706}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 9 and name HB1 ))
OR { 706}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 35 and name HB2 ))
ASSI { 708}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 9 and name HB1 ))
3.900 1.900 1.900 peak 708 spectrum 1 weight 0.10000E+01 volume 0.57892E-03 ppm1 3.958 ppm2 2.732 CV 1
OR { 708}
(( segid " " and resid 36 and name HB1 ))
(( segid " " and resid 37 and name HB1 ))
ASSI { 710}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 26 and name HB1 ))
3.600 1.600 1.600 peak 710 spectrum 1 weight 0.10000E+01 volume 0.18876E-02 ppm1 3.999 ppm2 1.777 CV 1
OR { 710}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 49 and name HB1 ))
OR { 710}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 25 and name HB2 ))
ASSI { 714}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 63 and name HB2 ))
2.800 1.000 1.000 peak 714 spectrum 1 weight 0.10000E+01 volume 0.48838E-02 ppm1 3.998 ppm2 1.881 CV 1
OR { 714}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 26 and name HB2 ))
OR { 714}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 62 and name HB1 ))
OR { 714}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 64 and name HB ))
OR { 714}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 32 and name HG2 ))
ASSI { 716}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 62 and name HB2 ))
2.600 0.900 0.900 peak 716 spectrum 1 weight 0.10000E+01 volume 0.36384E-02 ppm1 3.997 ppm2 1.956 CV 1
OR { 716}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 24 and name HB ))
OR { 716}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 32 and name HG2 ))
OR { 716}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 32 and name HG2 ))
ASSI { 729}
(( segid " " and resid 33 and name HB1 ))
(( segid " " and resid 31 and name HB2 ))
2.800 2.800 3.200 peak 729 spectrum 1 weight 0.10000E+01 volume 0.68626E-03 ppm1 3.998 ppm2 3.206 CV 1
OR { 729}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 31 and name HB2 ))
OR { 729}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 11 and name HB2 ))
OR { 729}
(( segid " " and resid 44 and name HB ))
(( segid " " and resid 11 and name HB2 ))
ASSI { 735}
(( segid " " and resid 9 and name HB2 ))
(( segid " " and resid 37 and name HN ))
3.500 1.600 1.600 peak 735 spectrum 1 weight 0.10000E+01 volume 0.17819E-02 ppm1 3.888 ppm2 8.795 CV 1
OR { 735}
(( segid " " and resid 32 and name HD2 ))
(( segid " " and resid 37 and name HN ))
ASSI { 745}
(( segid " " and resid 50 and name HA1 ))
(( segid " " and resid 51 and name HB2 ))
3.300 1.300 1.300 peak 745 spectrum 1 weight 0.10000E+01 volume 0.17727E-02 ppm1 3.826 ppm2 1.982 CV 1
OR { 745}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 62 and name HB2 ))
OR { 745}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 60 and name HB1 ))
OR { 745}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 746}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 41 and name HB ))
4.200 2.200 1.800 peak 746 spectrum 1 weight 0.10000E+01 volume 0.63000E-03 ppm1 3.818 ppm2 2.218 CV 1
OR { 746}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 25 and name HG2 ))
OR { 746}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 25 and name HG1 ))
ASSI { 749}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 64 and name HG2%)
3.100 1.200 1.200 peak 749 spectrum 1 weight 0.10000E+01 volume 0.25368E-02 ppm1 3.814 ppm2 0.737 CV 1
OR { 749}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 41 and name HG1%)
ASSI { 752}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 41 and name HG2%)
3.500 1.500 1.500 peak 752 spectrum 1 weight 0.10000E+01 volume 0.18162E-02 ppm1 3.815 ppm2 0.812 CV 1
OR { 752}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 65 and name HD1%)
ASSI { 771}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 68 and name HB ))
3.500 1.500 1.500 peak 771 spectrum 1 weight 0.10000E+01 volume 0.11164E-02 ppm1 3.625 ppm2 2.228 CV 1
OR { 771}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HG1 ))
OR { 771}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HG2 ))
ASSI { 773}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 67 and name HB1 ))
3.100 1.200 1.200 peak 773 spectrum 1 weight 0.10000E+01 volume 0.91927E-03 ppm1 3.671 ppm2 1.958 CV 1
OR { 773}
(( segid " " and resid 32 and name HD1 ))
(( segid " " and resid 32 and name HG2 ))
OR { 773}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 67 and name HB2 ))
ASSI { 776}
(( segid " " and resid 14 and name HD1 ))
(( segid " " and resid 52 and name HG2 ))
3.700 1.700 1.700 peak 776 spectrum 1 weight 0.10000E+01 volume 0.62643E-03 ppm1 3.619 ppm2 1.599 CV 1
OR { 776}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 52 and name HG2 ))
ASSI { 783}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 64 and name HD1%)
3.700 1.700 1.700 peak 783 spectrum 1 weight 0.10000E+01 volume 0.75448E-03 ppm1 3.546 ppm2 0.615 CV 1
OR { 783}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 24 and name HD1%)
ASSI { 788}
(( segid " " and resid 24 and name HA ))
( segid " " and resid 43 and name HG2%)
3.200 1.300 1.300 peak 788 spectrum 1 weight 0.10000E+01 volume 0.23891E-02 ppm1 3.626 ppm2 0.869 CV 1
OR { 788}
(( segid " " and resid 28 and name HB1 ))
( segid " " and resid 43 and name HG2%)
ASSI { 798}
(( segid " " and resid 14 and name HD1 ))
(( segid " " and resid 13 and name HN ))
3.800 1.800 1.800 peak 798 spectrum 1 weight 0.10000E+01 volume 0.83949E-03 ppm1 3.629 ppm2 8.282 CV 1
OR { 798}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 46 and name HN ))
ASSI { 800}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HB1 ))
2.800 1.000 1.000 peak 800 spectrum 1 weight 0.10000E+01 volume 0.43250E-02 ppm1 3.621 ppm2 1.754 CV 1
OR { 800}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 25 and name HB2 ))
OR { 800}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 29 and name HB ))
OR { 800}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 26 and name HB1 ))
ASSI { 802}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 66 and name HN ))
3.300 1.300 1.300 peak 802 spectrum 1 weight 0.10000E+01 volume 0.13135E-02 ppm1 3.613 ppm2 7.632 CV 1
OR { 802}
(( segid " " and resid 24 and name HA ))
(( segid " " and resid 23 and name HN ))
ASSI { 825}
(( segid " " and resid 70 and name HD1 ))
(( segid " " and resid 70 and name HB1 ))
2.200 0.600 0.600 peak 825 spectrum 1 weight 0.10000E+01 volume 0.97034E-02 ppm1 3.212 ppm2 1.881 CV 1
OR { 825}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 32 and name HG2 ))
ASSI { 831}
(( segid " " and resid 31 and name HB2 ))
( segid " " and resid 31 and name HD% )
2.800 1.000 1.000 peak 831 spectrum 1 weight 0.10000E+01 volume 0.18134E-02 ppm1 3.219 ppm2 7.214 CV 1
OR { 831}
(( segid " " and resid 70 and name HD1 ))
(( segid " " and resid 70 and name HE ))
ASSI { 835}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 54 and name HA ))
3.100 1.200 1.200 peak 835 spectrum 1 weight 0.10000E+01 volume 0.21266E-02 ppm1 3.207 ppm2 4.739 CV 1
OR { 835}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 34 and name HA ))
OR { 835}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 40 and name HA ))
OR { 835}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 38 and name HA ))
ASSI { 856}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 38 and name HB1 ))
3.100 3.100 2.900 peak 856 spectrum 1 weight 0.10000E+01 volume 0.30411E-02 ppm1 2.933 ppm2 1.656 CV 1
OR { 856}
(( segid " " and resid 37 and name HB2 ))
(( segid " " and resid 32 and name HG1 ))
ASSI { 878}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 38 and name HN ))
3.800 1.800 1.800 peak 878 spectrum 1 weight 0.10000E+01 volume 0.85305E-03 ppm1 2.755 ppm2 7.560 CV 1
OR { 878}
(( segid " " and resid 35 and name HB2 ))
(( segid " " and resid 38 and name HN ))
ASSI { 879}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 38 and name HN ))
3.900 1.900 1.900 peak 879 spectrum 1 weight 0.10000E+01 volume 0.55698E-03 ppm1 2.730 ppm2 7.569 CV 1
OR { 879}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 38 and name HN ))
ASSI { 897}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 37 and name HN ))
3.300 1.400 1.400 peak 897 spectrum 1 weight 0.10000E+01 volume 0.10593E-02 ppm1 2.724 ppm2 8.780 CV 1
OR { 897}
(( segid " " and resid 9 and name HB1 ))
(( segid " " and resid 37 and name HN ))
ASSI { 925}
(( segid " " and resid 40 and name HG1 ))
(( segid " " and resid 32 and name HA ))
2.900 2.900 3.100 peak 925 spectrum 1 weight 0.10000E+01 volume 0.56378E-03 ppm1 2.338 ppm2 4.497 CV 1
OR { 925}
(( segid " " and resid 14 and name HG2 ))
(( segid " " and resid 50 and name HA2 ))
ASSI { 928}
(( segid " " and resid 40 and name HG1 ))
(( segid " " and resid 41 and name HN ))
4.000 2.000 2.000 peak 928 spectrum 1 weight 0.10000E+01 volume 0.79598E-03 ppm1 2.327 ppm2 9.165 CV 1
OR { 928}
(( segid " " and resid 51 and name HG1 ))
(( segid " " and resid 52 and name HN ))
ASSI { 932}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 44 and name HB ))
4.000 2.000 2.000 peak 932 spectrum 1 weight 0.10000E+01 volume 0.11575E-02 ppm1 1.786 ppm2 3.995 CV 1
OR { 932}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 44 and name HB ))
OR { 932}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 44 and name HB ))
ASSI { 949}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 20 and name HA ))
2.000 2.000 4.000 peak 949 spectrum 1 weight 0.10000E+01 volume 0.14284E-01 ppm1 1.794 ppm2 4.271 CV 1
OR { 949}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 20 and name HA ))
OR { 949}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 46 and name HA ))
OR { 949}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 46 and name HA ))
OR { 949}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 69 and name HA ))
ASSI { 950}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HA ))
2.200 0.600 0.600 peak 950 spectrum 1 weight 0.10000E+01 volume 0.69821E-02 ppm1 1.972 ppm2 4.208 CV 1
OR { 950}
(( segid " " and resid 49 and name HB2 ))
(( segid " " and resid 49 and name HA ))
OR { 950}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 67 and name HA ))
ASSI { 952}
(( segid " " and resid 19 and name HB ))
(( segid " " and resid 19 and name HA ))
2.200 0.600 0.600 peak 952 spectrum 1 weight 0.10000E+01 volume 0.10146E-01 ppm1 1.861 ppm2 4.296 CV 1
OR { 952}
(( segid " " and resid 70 and name HB1 ))
(( segid " " and resid 70 and name HA ))
ASSI { 954}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 46 and name HA ))
3.000 1.100 1.100 peak 954 spectrum 1 weight 0.10000E+01 volume 0.47082E-02 ppm1 1.961 ppm2 4.295 CV 1
OR { 954}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 19 and name HA ))
OR { 954}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 69 and name HA ))
OR { 954}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 70 and name HA ))
ASSI { 960}
(( segid " " and resid 62 and name HB2 ))
(( segid " " and resid 60 and name HA ))
2.700 0.900 0.900 peak 960 spectrum 1 weight 0.10000E+01 volume 0.27199E-02 ppm1 1.965 ppm2 3.993 CV 1
OR { 960}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 44 and name HB ))
ASSI { 985}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 40 and name HN ))
4.000 2.000 2.000 peak 985 spectrum 1 weight 0.10000E+01 volume 0.47720E-03 ppm1 2.135 ppm2 8.439 CV 1
OR { 985}
(( segid " " and resid 30 and name HB1 ))
(( segid " " and resid 40 and name HN ))
OR { 985}
(( segid " " and resid 30 and name HB2 ))
(( segid " " and resid 29 and name HN ))
ASSI { 988}
(( segid " " and resid 45 and name HG ))
(( segid " " and resid 50 and name HN ))
3.900 1.900 1.900 peak 988 spectrum 1 weight 0.10000E+01 volume 0.59092E-03 ppm1 1.660 ppm2 8.507 CV 1
OR { 988}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 16 and name HN ))
OR { 988}
(( segid " " and resid 45 and name HG ))
(( segid " " and resid 16 and name HN ))
ASSI { 997}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 51 and name HN ))
3.000 1.100 1.100 peak 997 spectrum 1 weight 0.10000E+01 volume 0.19961E-02 ppm1 1.664 ppm2 8.288 CV 1
OR { 997}
(( segid " " and resid 45 and name HG ))
(( segid " " and resid 46 and name HN ))
OR { 997}
(( segid " " and resid 32 and name HG1 ))
(( segid " " and resid 36 and name HN ))
ASSI { 1000}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 46 and name HN ))
2.800 1.000 1.000 peak 1000 spectrum 1 weight 0.10000E+01 volume 0.74172E-02 ppm1 1.803 ppm2 8.287 CV 1
OR { 1000}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 46 and name HN ))
OR { 1000}
(( segid " " and resid 20 and name HB2 ))
(( segid " " and resid 46 and name HN ))
OR { 1000}
(( segid " " and resid 20 and name HB1 ))
(( segid " " and resid 46 and name HN ))
ASSI { 1008}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 23 and name HN ))
2.300 2.300 3.700 peak 1008 spectrum 1 weight 0.10000E+01 volume 0.33818E-02 ppm1 1.791 ppm2 7.647 CV 1
OR { 1008}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 23 and name HN ))
OR { 1008}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 66 and name HN ))
OR { 1008}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 63 and name HN ))
OR { 1008}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 63 and name HN ))
ASSI { 1010}
(( segid " " and resid 65 and name HB ))
(( segid " " and resid 65 and name HN ))
2.500 0.800 0.800 peak 1010 spectrum 1 weight 0.10000E+01 volume 0.35538E-02 ppm1 1.833 ppm2 8.414 CV 1
OR { 1010}
(( segid " " and resid 20 and name HB1 ))
(( segid " " and resid 21 and name HN ))
ASSI { 1013}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 63 and name HN ))
2.300 0.700 0.700 peak 1013 spectrum 1 weight 0.10000E+01 volume 0.43488E-02 ppm1 1.904 ppm2 7.646 CV 1
OR { 1013}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 63 and name HN ))
ASSI { 1015}
(( segid " " and resid 40 and name HB1 ))
(( segid " " and resid 40 and name HN ))
2.800 1.000 1.000 peak 1015 spectrum 1 weight 0.10000E+01 volume 0.25368E-02 ppm1 1.877 ppm2 8.416 CV 1
OR { 1015}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 65 and name HN ))
ASSI { 1016}
(( segid " " and resid 12 and name HB ))
(( segid " " and resid 13 and name HN ))
2.700 0.900 0.900 peak 1016 spectrum 1 weight 0.10000E+01 volume 0.42213E-02 ppm1 1.879 ppm2 8.279 CV 1
OR { 1016}
(( segid " " and resid 12 and name HB ))
(( segid " " and resid 12 and name HN ))
ASSI { 1018}
(( segid " " and resid 70 and name HB2 ))
(( segid " " and resid 69 and name HN ))
3.000 1.100 1.100 peak 1018 spectrum 1 weight 0.10000E+01 volume 0.45525E-02 ppm1 1.949 ppm2 8.178 CV 1
OR { 1018}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 69 and name HN ))
OR { 1018}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 69 and name HN ))
ASSI { 1023}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 40 and name HN ))
3.300 1.300 1.300 peak 1023 spectrum 1 weight 0.10000E+01 volume 0.14886E-02 ppm1 1.947 ppm2 8.436 CV 1
OR { 1023}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 65 and name HN ))
OR { 1023}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 65 and name HN ))
ASSI { 1028}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 15 and name HN ))
3.900 1.900 1.900 peak 1028 spectrum 1 weight 0.10000E+01 volume 0.10486E-02 ppm1 2.040 ppm2 8.271 CV 1
OR { 1028}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 13 and name HN ))
ASSI { 1064}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 52 and name HN ))
3.600 1.600 1.600 peak 1064 spectrum 1 weight 0.10000E+01 volume 0.92127E-03 ppm1 2.039 ppm2 9.167 CV 1
OR { 1064}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 52 and name HN ))
ASSI { 1068}
(( segid " " and resid 40 and name HB1 ))
(( segid " " and resid 40 and name HA ))
2.800 1.000 1.000 peak 1068 spectrum 1 weight 0.10000E+01 volume 0.20911E-02 ppm1 1.867 ppm2 4.747 CV 1
OR { 1068}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 38 and name HA ))
ASSI { 1072}
(( segid " " and resid 32 and name HG2 ))
(( segid " " and resid 32 and name HD1 ))
2.900 1.000 1.000 peak 1072 spectrum 1 weight 0.10000E+01 volume 0.23453E-02 ppm1 1.934 ppm2 3.626 CV 1
OR { 1072}
(( segid " " and resid 24 and name HB ))
(( segid " " and resid 24 and name HA ))
ASSI { 1077}
(( segid " " and resid 12 and name HB ))
(( segid " " and resid 11 and name HN ))
2.300 2.300 3.700 peak 1077 spectrum 1 weight 0.10000E+01 volume 0.19040E-02 ppm1 1.874 ppm2 9.055 CV 1
OR { 1077}
(( segid " " and resid 40 and name HB1 ))
(( segid " " and resid 30 and name HN ))
OR { 1077}
(( segid " " and resid 40 and name HB1 ))
(( segid " " and resid 11 and name HN ))
OR { 1077}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 44 and name HN ))
ASSI { 1079}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 45 and name HN ))
2.800 2.800 3.200 peak 1079 spectrum 1 weight 0.10000E+01 volume 0.56059E-02 ppm1 1.803 ppm2 8.861 CV 1
OR { 1079}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 28 and name HN ))
OR { 1079}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 45 and name HN ))
ASSI { 1085}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 52 and name HA ))
2.800 1.000 1.000 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.14631E-02 ppm1 1.666 ppm2 4.776 CV 1
OR { 1085}
(( segid " " and resid 32 and name HG1 ))
(( segid " " and resid 37 and name HA ))
ASSI { 1095}
(( segid " " and resid 52 and name HB2 ))
(( segid " " and resid 53 and name HN ))
4.100 2.100 1.900 peak 1095 spectrum 1 weight 0.10000E+01 volume 0.85182E-03 ppm1 1.667 ppm2 8.796 CV 1
OR { 1095}
(( segid " " and resid 32 and name HG1 ))
(( segid " " and resid 37 and name HN ))
ASSI { 1098}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 44 and name HB ))
2.900 2.900 3.100 peak 1098 spectrum 1 weight 0.10000E+01 volume 0.47082E-03 ppm1 1.604 ppm2 3.995 CV 1
OR { 1098}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 13 and name HA1 ))
ASSI { 1106}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 36 and name HB2 ))
2.400 2.400 3.600 peak 1106 spectrum 1 weight 0.10000E+01 volume 0.37964E-02 ppm1 1.431 ppm2 4.091 CV 1
OR { 1106}
( segid " " and resid 61 and name HB% )
(( segid " " and resid 68 and name HA ))
ASSI { 1111}
(( segid " " and resid 49 and name HG1 ))
(( segid " " and resid 49 and name HA ))
2.300 0.700 0.700 peak 1111 spectrum 1 weight 0.10000E+01 volume 0.11288E-01 ppm1 1.463 ppm2 4.213 CV 1
OR { 1111}
(( segid " " and resid 17 and name HD2 ))
(( segid " " and resid 17 and name HA ))
ASSI { 1133}
(( segid " " and resid 20 and name HG1 ))
(( segid " " and resid 24 and name HN ))
4.400 2.500 1.600 peak 1133 spectrum 1 weight 0.10000E+01 volume 0.49676E-03 ppm1 1.397 ppm2 7.479 CV 1
OR { 1133}
( segid " " and resid 22 and name HB% )
(( segid " " and resid 24 and name HN ))
ASSI { 1140}
(( segid " " and resid 10 and name HG ))
(( segid " " and resid 12 and name HN ))
3.500 1.500 1.500 peak 1140 spectrum 1 weight 0.10000E+01 volume 0.82273E-03 ppm1 1.418 ppm2 8.272 CV 1
OR { 1140}
(( segid " " and resid 10 and name HG ))
(( segid " " and resid 13 and name HN ))
ASSI { 1154}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 24 and name HG2%)
3.100 1.200 1.200 peak 1154 spectrum 1 weight 0.10000E+01 volume 0.22455E-02 ppm1 1.271 ppm2 0.692 CV 1
OR { 1154}
(( segid " " and resid 44 and name HG1 ))
( segid " " and resid 24 and name HG2%)
OR { 1154}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 42 and name HG2%)
OR { 1154}
( segid " " and resid 44 and name HG2%)
( segid " " and resid 43 and name HD1%)
ASSI { 1162}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 16 and name HN ))
3.300 1.400 1.400 peak 1162 spectrum 1 weight 0.10000E+01 volume 0.71459E-03 ppm1 1.058 ppm2 8.502 CV 1
OR { 1162}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 27 and name HN ))
ASSI { 1167}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 12 and name HN ))
3.700 1.700 1.700 peak 1167 spectrum 1 weight 0.10000E+01 volume 0.64556E-03 ppm1 0.912 ppm2 8.279 CV 1
OR { 1167}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 13 and name HN ))
ASSI { 1169}
(( segid " " and resid 64 and name HG12))
(( segid " " and resid 64 and name HN ))
3.600 1.600 1.600 peak 1169 spectrum 1 weight 0.10000E+01 volume 0.55541E-03 ppm1 1.052 ppm2 7.824 CV 1
OR { 1169}
(( segid " " and resid 64 and name HG11))
(( segid " " and resid 64 and name HN ))
OR { 1169}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 67 and name HN ))
ASSI { 1176}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 22 and name HA ))
4.100 2.100 1.900 peak 1176 spectrum 1 weight 0.10000E+01 volume 0.45245E-03 ppm1 1.052 ppm2 4.155 CV 1
OR { 1176}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 67 and name HA ))
OR { 1176}
( segid " " and resid 21 and name HG1%)
(( segid " " and resid 67 and name HA ))
OR { 1176}
( segid " " and resid 21 and name HG1%)
(( segid " " and resid 22 and name HA ))
OR { 1176}
(( segid " " and resid 64 and name HG12))
(( segid " " and resid 63 and name HA ))
OR { 1176}
( segid " " and resid 68 and name HG1%)
(( segid " " and resid 67 and name HA ))
OR { 1176}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 67 and name HA ))
OR { 1176}
(( segid " " and resid 64 and name HG11))
(( segid " " and resid 63 and name HA ))
ASSI { 1179}
( segid " " and resid 68 and name HG1%)
(( segid " " and resid 65 and name HA ))
3.600 1.600 1.600 peak 1179 spectrum 1 weight 0.10000E+01 volume 0.61167E-03 ppm1 1.051 ppm2 3.614 CV 1
OR { 1179}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 65 and name HA ))
OR { 1179}
(( segid " " and resid 64 and name HG12))
(( segid " " and resid 65 and name HA ))
ASSI { 1195}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 20 and name HA ))
4.000 2.000 2.000 peak 1195 spectrum 1 weight 0.10000E+01 volume 0.72777E-03 ppm1 0.810 ppm2 4.269 CV 1
OR { 1195}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 17 and name HA ))
OR { 1195}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 69 and name HA ))
ASSI { 1202}
( segid " " and resid 63 and name HD2%)
(( segid " " and resid 64 and name HA ))
2.700 2.700 3.300 peak 1202 spectrum 1 weight 0.10000E+01 volume 0.71977E-03 ppm1 0.921 ppm2 3.678 CV 1
OR { 1202}
( segid " " and resid 63 and name HD1%)
(( segid " " and resid 64 and name HA ))
OR { 1202}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 32 and name HD1 ))
ASSI { 1206}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 14 and name HD1 ))
3.700 1.700 1.700 peak 1206 spectrum 1 weight 0.10000E+01 volume 0.14711E-02 ppm1 0.872 ppm2 3.624 CV 1
OR { 1206}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 24 and name HA ))
ASSI { 1210}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 43 and name HA ))
4.000 2.000 2.000 peak 1210 spectrum 1 weight 0.10000E+01 volume 0.11698E-02 ppm1 0.694 ppm2 4.827 CV 1
OR { 1210}
( segid " " and resid 19 and name HG1%)
(( segid " " and resid 43 and name HA ))
OR { 1210}
( segid " " and resid 19 and name HG1%)
(( segid " " and resid 52 and name HA ))
ASSI { 1217}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 44 and name HN ))
4.400 2.400 1.600 peak 1217 spectrum 1 weight 0.10000E+01 volume 0.58135E-03 ppm1 0.692 ppm2 9.066 CV 1
OR { 1217}
( segid " " and resid 19 and name HG1%)
(( segid " " and resid 44 and name HN ))
ASSI { 1222}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 16 and name HN ))
2.900 1.000 1.000 peak 1222 spectrum 1 weight 0.10000E+01 volume 0.32450E-02 ppm1 0.811 ppm2 8.491 CV 1
OR { 1222}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 29 and name HN ))
ASSI { 1224}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 21 and name HA ))
2.800 2.800 3.200 peak 1224 spectrum 1 weight 0.10000E+01 volume 0.41854E-02 ppm1 0.749 ppm2 3.536 CV 1
OR { 1224}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 52 and name HD2 ))
ASSI { 1227}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 65 and name HA ))
2.900 1.100 1.100 peak 1227 spectrum 1 weight 0.10000E+01 volume 0.14762E-02 ppm1 0.744 ppm2 3.621 CV 1
OR { 1227}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 32 and name HD1 ))
ASSI { 1228}
( segid " " and resid 19 and name HG1%)
(( segid " " and resid 52 and name HD2 ))
4.300 2.300 1.700 peak 1228 spectrum 1 weight 0.10000E+01 volume 0.44445E-03 ppm1 0.694 ppm2 3.538 CV 1
OR { 1228}
( segid " " and resid 19 and name HG1%)
(( segid " " and resid 21 and name HA ))
OR { 1228}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 21 and name HA ))
ASSI { 1233}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 68 and name HA ))
4.100 2.100 1.900 peak 1233 spectrum 1 weight 0.10000E+01 volume 0.73853E-03 ppm1 0.811 ppm2 4.090 CV 1
OR { 1233}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 68 and name HA ))
ASSI { 1235}
( segid " " and resid 65 and name HD1%)
(( segid " " and resid 62 and name HA ))
3.200 1.300 1.300 peak 1235 spectrum 1 weight 0.10000E+01 volume 0.14292E-02 ppm1 0.802 ppm2 3.936 CV 1
OR { 1235}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 15 and name HA2 ))
ASSI { 1250}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 40 and name HN ))
4.000 2.000 2.000 peak 1250 spectrum 1 weight 0.10000E+01 volume 0.64956E-03 ppm1 0.730 ppm2 8.430 CV 1
OR { 1250}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 65 and name HN ))
OR { 1250}
( segid " " and resid 43 and name HD1%)
(( segid " " and resid 27 and name HN ))
ASSI { 1254}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 26 and name HN ))
4.100 2.100 1.900 peak 1254 spectrum 1 weight 0.10000E+01 volume 0.94321E-03 ppm1 0.691 ppm2 7.744 CV 1
OR { 1254}
( segid " " and resid 19 and name HG1%)
(( segid " " and resid 26 and name HN ))
ASSI { 1330}
(( segid " " and resid 41 and name HB ))
( segid " " and resid 41 and name HG1%)
2.600 0.800 0.800 peak 1330 spectrum 1 weight 0.10000E+01 volume 0.34544E-02 ppm1 2.208 ppm2 0.749 CV 1
OR { 1330}
(( segid " " and resid 25 and name HG1 ))
( segid " " and resid 64 and name HG2%)
OR { 1330}
(( segid " " and resid 25 and name HG2 ))
( segid " " and resid 64 and name HG2%)
OR { 1330}
(( segid " " and resid 25 and name HG1 ))
( segid " " and resid 43 and name HD1%)
ASSI { 1334}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 68 and name HG1%)
2.500 2.500 3.500 peak 1334 spectrum 1 weight 0.10000E+01 volume 0.15110E-02 ppm1 0.398 ppm2 1.054 CV 1
OR { 1334}
( segid " " and resid 29 and name HG2%)
( segid " " and resid 68 and name HG2%)
OR { 1334}
( segid " " and resid 29 and name HG2%)
(( segid " " and resid 64 and name HG11))
ASSI { 1349}
(( segid " " and resid 70 and name HD1 ))
(( segid " " and resid 21 and name HA ))
2.400 2.400 3.600 peak 1349 spectrum 1 weight 0.10000E+01 volume 0.26082E-02 ppm1 3.228 ppm2 3.525 CV 1
OR { 1349}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 52 and name HD2 ))
ASSI { 1367}
(( segid " " and resid 30 and name HB1 ))
( segid " " and resid 39 and name HD1%)
2.900 1.100 1.100 peak 1367 spectrum 1 weight 0.10000E+01 volume 0.28384E-02 ppm1 2.128 ppm2 0.940 CV 1
OR { 1367}
(( segid " " and resid 30 and name HB2 ))
( segid " " and resid 39 and name HD1%)
OR { 1367}
(( segid " " and resid 69 and name HB2 ))
( segid " " and resid 65 and name HG2%)
ASSI { 1369}
(( segid " " and resid 69 and name HB1 ))
( segid " " and resid 65 and name HD1%)
2.600 0.800 0.800 peak 1369 spectrum 1 weight 0.10000E+01 volume 0.54184E-02 ppm1 2.126 ppm2 0.815 CV 1
OR { 1369}
(( segid " " and resid 69 and name HB2 ))
( segid " " and resid 65 and name HD1%)
OR { 1369}
(( segid " " and resid 30 and name HB2 ))
( segid " " and resid 41 and name HG2%)
ASSI { 1375}
( segid " " and resid 43 and name HG2%)
( segid " " and resid 27 and name HB% )
2.200 0.600 0.600 peak 1375 spectrum 1 weight 0.10000E+01 volume 0.63038E-02 ppm1 0.868 ppm2 1.166 CV 1
OR { 1375}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HG11))
OR { 1375}
( segid " " and resid 12 and name HD1%)
(( segid " " and resid 12 and name HG12))
ASSI { 1377}
( segid " " and resid 24 and name HD1%)
(( segid " " and resid 19 and name HB ))
2.800 1.000 1.000 peak 1377 spectrum 1 weight 0.10000E+01 volume 0.27534E-02 ppm1 0.628 ppm2 1.869 CV 1
OR { 1377}
( segid " " and resid 64 and name HD1%)
(( segid " " and resid 64 and name HB ))
ASSI { 1393}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 67 and name HA ))
3.000 1.100 1.100 peak 1393 spectrum 1 weight 0.10000E+01 volume 0.46682E-02 ppm1 3.670 ppm2 4.163 CV 1
OR { 1393}
(( segid " " and resid 64 and name HA ))
(( segid " " and resid 63 and name HA ))
ASSI { 1394}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 66 and name HA ))
2.600 2.600 3.400 peak 1394 spectrum 1 weight 0.10000E+01 volume 0.55579E-02 ppm1 3.616 ppm2 4.163 CV 1
OR { 1394}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 63 and name HA ))
OR { 1394}
(( segid " " and resid 65 and name HA ))
(( segid " " and resid 67 and name HA ))
ASSI { 1422}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 68 and name HG1%)
2.200 2.200 3.800 peak 1422 spectrum 1 weight 0.10000E+01 volume 0.12700E-01 ppm1 1.720 ppm2 1.046 CV 1
OR { 1422}
(( segid " " and resid 42 and name HB ))
( segid " " and resid 68 and name HG2%)
OR { 1422}
(( segid " " and resid 29 and name HB ))
( segid " " and resid 68 and name HG2%)
ASSI { 1424}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 41 and name HB ))
2.500 0.800 0.800 peak 1424 spectrum 1 weight 0.10000E+01 volume 0.33934E-02 ppm1 0.756 ppm2 2.200 CV 1
OR { 1424}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 25 and name HG2 ))
ASSI { 1426}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 41 and name HB ))
2.400 0.700 0.700 peak 1426 spectrum 1 weight 0.10000E+01 volume 0.54703E-02 ppm1 0.814 ppm2 2.202 CV 1
OR { 1426}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 25 and name HG1 ))
ASSI { 1433}
(( segid " " and resid 62 and name HB2 ))
( segid " " and resid 64 and name HD1%)
2.300 2.300 3.700 peak 1433 spectrum 1 weight 0.10000E+01 volume 0.17061E-01 ppm1 1.932 ppm2 0.612 CV 1
OR { 1433}
(( segid " " and resid 17 and name HB2 ))
( segid " " and resid 64 and name HD1%)
OR { 1433}
(( segid " " and resid 26 and name HB2 ))
( segid " " and resid 24 and name HD1%)
ASSI { 1434}
( segid " " and resid 68 and name HG1%)
(( segid " " and resid 29 and name HB ))
1.600 1.600 4.400 peak 1434 spectrum 1 weight 0.10000E+01 volume 0.18673E-01 ppm1 1.051 ppm2 1.715 CV 1
OR { 1434}
( segid " " and resid 68 and name HG1%)
(( segid " " and resid 42 and name HB ))
OR { 1434}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 42 and name HB ))
OR { 1434}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 29 and name HB ))
OR { 1434}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 42 and name HB ))
OR { 1434}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 49 and name HG2 ))
ASSI { 1435}
( segid " " and resid 43 and name HG2%)
(( segid " " and resid 52 and name HB1 ))
2.300 0.700 0.700 peak 1435 spectrum 1 weight 0.10000E+01 volume 0.18581E-01 ppm1 0.868 ppm2 1.446 CV 1
OR { 1435}
( segid " " and resid 43 and name HG2%)
( segid " " and resid 61 and name HB% )
ASSI { 1438}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 25 and name HB1 ))
2.200 2.200 3.800 peak 1438 spectrum 1 weight 0.10000E+01 volume 0.10090E-01 ppm1 0.744 ppm2 1.805 CV 1
OR { 1438}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 65 and name HB ))
OR { 1438}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 26 and name HB1 ))
OR { 1438}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 26 and name HB1 ))
OR { 1438}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 25 and name HB2 ))
OR { 1438}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 25 and name HB1 ))
ASSI { 1440}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 10 and name HB1 ))
1.700 1.700 4.300 peak 1440 spectrum 1 weight 0.10000E+01 volume 0.18421E-01 ppm1 0.921 ppm2 1.766 CV 1
OR { 1440}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 10 and name HB2 ))
OR { 1440}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 29 and name HB ))
ASSI { 1445}
( segid " " and resid 16 and name HG1%)
(( segid " " and resid 17 and name HG2 ))
2.400 2.400 3.600 peak 1445 spectrum 1 weight 0.10000E+01 volume 0.14228E-01 ppm1 0.805 ppm2 1.743 CV 1
OR { 1445}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 29 and name HB ))
OR { 1445}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 42 and name HB ))
ASSI { 1447}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 39 and name HB ))
2.200 0.600 0.600 peak 1447 spectrum 1 weight 0.10000E+01 volume 0.71220E-02 ppm1 0.749 ppm2 1.942 CV 1
OR { 1447}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 67 and name HB2 ))
ASSI { 1464}
(( segid " " and resid 28 and name HB1 ))
(( segid " " and resid 28 and name HB2 ))
1.400 0.200 0.800 peak 1464 spectrum 1 weight 0.10000E+01 volume 0.47801E-01 ppm1 3.622 ppm2 3.781 CV 1
OR { 1464}
(( segid " " and resid 14 and name HD1 ))
(( segid " " and resid 14 and name HD2 ))
ASSI { 1488}
(( segid " " and resid 30 and name HN ))
(( segid " " and resid 28 and name HA ))
4.500 2.500 1.500 peak 1488 spectrum 1 weight 0.10000E+01 volume 0.39795E-03 ppm1 9.066 ppm2 4.781 CV 1
OR { 1488}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 52 and name HA ))
ASSI { 1496}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 26 and name HB2 ))
4.000 2.000 2.000 peak 1496 spectrum 1 weight 0.10000E+01 volume 0.81831E-03 ppm1 9.066 ppm2 1.928 CV 1
OR { 1496}
(( segid " " and resid 44 and name HN ))
(( segid " " and resid 24 and name HB ))
ASSI { 1523}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 46 and name HN ))
4.000 2.000 2.000 peak 1523 spectrum 1 weight 0.10000E+01 volume 0.10238E-02 ppm1 8.654 ppm2 8.273 CV 1
OR { 1523}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 15 and name HN ))
ASSI { 1527}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 19 and name HB ))
2.200 0.600 0.600 peak 1527 spectrum 1 weight 0.10000E+01 volume 0.32314E-02 ppm1 8.654 ppm2 1.837 CV 1
OR { 1527}
(( segid " " and resid 20 and name HN ))
(( segid " " and resid 20 and name HB2 ))
ASSI { 1529}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HB2 ))
3.600 1.700 1.700 peak 1529 spectrum 1 weight 0.10000E+01 volume 0.63000E-03 ppm1 8.630 ppm2 1.939 CV 1
OR { 1529}
(( segid " " and resid 17 and name HN ))
(( segid " " and resid 17 and name HB1 ))
OR { 1529}
(( segid " " and resid 60 and name HN ))
(( segid " " and resid 62 and name HB2 ))
ASSI { 1530}
(( segid " " and resid 20 and name HN ))
( segid " " and resid 19 and name HG2%)
4.300 2.300 1.700 peak 1530 spectrum 1 weight 0.10000E+01 volume 0.64157E-03 ppm1 8.654 ppm2 0.834 CV 1
OR { 1530}
(( segid " " and resid 17 and name HN ))
( segid " " and resid 16 and name HG1%)
ASSI { 1533}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 41 and name HG1%)
3.600 1.700 1.700 peak 1533 spectrum 1 weight 0.10000E+01 volume 0.60287E-03 ppm1 8.542 ppm2 0.738 CV 1
OR { 1533}
(( segid " " and resid 54 and name HN ))
( segid " " and resid 43 and name HD1%)
ASSI { 1535}
(( segid " " and resid 29 and name HN ))
( segid " " and resid 41 and name HG2%)
3.600 1.600 1.600 peak 1535 spectrum 1 weight 0.10000E+01 volume 0.88657E-03 ppm1 8.454 ppm2 0.807 CV 1
OR { 1535}
(( segid " " and resid 40 and name HN ))
( segid " " and resid 41 and name HG2%)
OR { 1535}
(( segid " " and resid 27 and name HN ))
( segid " " and resid 41 and name HG2%)
ASSI { 1553}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 67 and name HA ))
3.700 1.700 1.700 peak 1553 spectrum 1 weight 0.10000E+01 volume 0.52189E-03 ppm1 7.960 ppm2 4.160 CV 1
OR { 1553}
(( segid " " and resid 70 and name HN ))
(( segid " " and resid 66 and name HA ))
ASSI { 1555}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 66 and name HA ))
3.600 1.600 1.600 peak 1555 spectrum 1 weight 0.10000E+01 volume 0.48715E-03 ppm1 8.177 ppm2 4.137 CV 1
OR { 1555}
(( segid " " and resid 69 and name HN ))
(( segid " " and resid 67 and name HA ))
ASSI { 1575}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 24 and name HB ))
3.700 1.700 1.700 peak 1575 spectrum 1 weight 0.10000E+01 volume 0.79598E-03 ppm1 8.221 ppm2 1.969 CV 1
OR { 1575}
(( segid " " and resid 22 and name HN ))
(( segid " " and resid 67 and name HB1 ))
ASSI { 1583}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB1 ))
2.900 1.100 1.100 peak 1583 spectrum 1 weight 0.10000E+01 volume 0.13522E-02 ppm1 8.026 ppm2 1.939 CV 1
OR { 1583}
(( segid " " and resid 68 and name HN ))
(( segid " " and resid 67 and name HB2 ))
OR { 1583}
(( segid " " and resid 39 and name HN ))
(( segid " " and resid 39 and name HB ))
ASSI { 1584}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 39 and name HB ))
4.000 2.000 2.000 peak 1584 spectrum 1 weight 0.10000E+01 volume 0.42651E-03 ppm1 8.371 ppm2 1.939 CV 1
OR { 1584}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 40 and name HB2 ))
OR { 1584}
(( segid " " and resid 31 and name HN ))
(( segid " " and resid 32 and name HG2 ))
ASSI { 1587}
(( segid " " and resid 51 and name HN ))
(( segid " " and resid 52 and name HG1 ))
4.000 2.000 2.000 peak 1587 spectrum 1 weight 0.10000E+01 volume 0.49276E-03 ppm1 8.294 ppm2 1.512 CV 1
OR { 1587}
(( segid " " and resid 13 and name HN ))
(( segid " " and resid 52 and name HG1 ))
ASSI { 1616}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 68 and name HG1%)
5.100 3.200 0.900 peak 1616 spectrum 1 weight 0.10000E+01 volume 0.25356E-03 ppm1 7.811 ppm2 1.045 CV 1
OR { 1616}
(( segid " " and resid 67 and name HN ))
( segid " " and resid 68 and name HG2%)
OR { 1616}
(( segid " " and resid 67 and name HN ))
(( segid " " and resid 64 and name HG11))
ASSI { 1624}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 66 and name HA ))
3.200 1.300 1.300 peak 1624 spectrum 1 weight 0.10000E+01 volume 0.92684E-03 ppm1 7.651 ppm2 4.137 CV 1
OR { 1624}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 63 and name HA ))
OR { 1624}
(( segid " " and resid 23 and name HN ))
(( segid " " and resid 22 and name HA ))
ASSI { 1638}
(( segid " " and resid 18 and name HN ))
( segid " " and resid 19 and name HG1%)
3.800 1.800 1.800 peak 1638 spectrum 1 weight 0.10000E+01 volume 0.39029E-03 ppm1 7.368 ppm2 0.726 CV 1
OR { 1638}
(( segid " " and resid 52 and name HE ))
( segid " " and resid 43 and name HD1%)
ASSI { 1678}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 43 and name HB ))
4.100 2.100 1.900 peak 1678 spectrum 1 weight 0.10000E+01 volume 0.67108E-03 ppm1 5.578 ppm2 2.052 CV 1
OR { 1678}
(( segid " " and resid 51 and name HA ))
(( segid " " and resid 14 and name HB1 ))
ASSI { 1683}
(( segid " " and resid 53 and name HA ))
(( segid " " and resid 52 and name HB1 ))
3.500 1.500 1.500 peak 1683 spectrum 1 weight 0.10000E+01 volume 0.68307E-03 ppm1 5.410 ppm2 1.427 CV 1
OR { 1683}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 61 and name HB% )
ASSI { 1685}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 43 and name HD1%)
3.600 1.600 1.600 peak 1685 spectrum 1 weight 0.10000E+01 volume 0.68588E-03 ppm1 5.410 ppm2 0.746 CV 1
OR { 1685}
(( segid " " and resid 53 and name HA ))
( segid " " and resid 41 and name HG1%)
ASSI { 1691}
(( segid " " and resid 46 and name HA ))
( segid " " and resid 19 and name HG2%)
2.900 2.900 3.100 peak 1691 spectrum 1 weight 0.10000E+01 volume 0.95197E-03 ppm1 4.275 ppm2 0.807 CV 1
OR { 1691}
(( segid " " and resid 13 and name HA2 ))
( segid " " and resid 16 and name HG1%)
ASSI { 1692}
(( segid " " and resid 12 and name HA ))
( segid " " and resid 12 and name HD1%)
3.600 1.600 1.600 peak 1692 spectrum 1 weight 0.10000E+01 volume 0.15764E-02 ppm1 4.246 ppm2 0.834 CV 1
OR { 1692}
(( segid " " and resid 17 and name HA ))
( segid " " and resid 16 and name HG1%)
ASSI { 1696}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 25 and name HB1 ))
2.500 2.500 3.500 peak 1696 spectrum 1 weight 0.10000E+01 volume 0.93245E-02 ppm1 4.757 ppm2 1.776 CV 1
OR { 1696}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 25 and name HB2 ))
OR { 1696}
(( segid " " and resid 23 and name HA ))
(( segid " " and resid 26 and name HB1 ))
ASSI { 1704}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HG12))
4.200 2.200 1.800 peak 1704 spectrum 1 weight 0.10000E+01 volume 0.59849E-03 ppm1 4.142 ppm2 1.045 CV 1
OR { 1704}
(( segid " " and resid 66 and name HA ))
( segid " " and resid 68 and name HG2%)
OR { 1704}
(( segid " " and resid 66 and name HA ))
( segid " " and resid 68 and name HG1%)
OR { 1704}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HG11))
ASSI { 1708}
(( segid " " and resid 52 and name HA ))
(( segid " " and resid 53 and name HN ))
3.000 1.100 1.100 peak 1708 spectrum 1 weight 0.10000E+01 volume 0.10593E-02 ppm1 4.783 ppm2 8.792 CV 1
OR { 1708}
(( segid " " and resid 37 and name HA ))
(( segid " " and resid 37 and name HN ))
ASSI { 1722}
(( segid " " and resid 28 and name HB2 ))
(( segid " " and resid 29 and name HN ))
4.800 2.900 1.200 peak 1722 spectrum 1 weight 0.10000E+01 volume 0.23704E-03 ppm1 3.795 ppm2 8.450 CV 1
OR { 1722}
(( segid " " and resid 61 and name HA ))
(( segid " " and resid 65 and name HN ))
ASSI { 1731}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 12 and name HN ))
3.300 1.400 1.400 peak 1731 spectrum 1 weight 0.10000E+01 volume 0.93403E-03 ppm1 4.214 ppm2 8.289 CV 1
OR { 1731}
(( segid " " and resid 12 and name HA ))
(( segid " " and resid 13 and name HN ))
ASSI { 1736}
(( segid " " and resid 14 and name HA ))
(( segid " " and resid 14 and name HD1 ))
2.900 1.100 1.100 peak 1736 spectrum 1 weight 0.10000E+01 volume 0.17109E-02 ppm1 4.417 ppm2 3.625 CV 1
OR { 1736}
(( segid " " and resid 39 and name HA ))
(( segid " " and resid 32 and name HD1 ))
ASSI { 1737}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HB2 ))
3.200 1.300 1.300 peak 1737 spectrum 1 weight 0.10000E+01 volume 0.45802E-02 ppm1 4.316 ppm2 1.796 CV 1
OR { 1737}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 20 and name HB1 ))
OR { 1737}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 25 and name HB2 ))
ASSI { 1738}
(( segid " " and resid 13 and name HA2 ))
(( segid " " and resid 12 and name HB ))
2.100 2.100 3.900 peak 1738 spectrum 1 weight 0.10000E+01 volume 0.45564E-02 ppm1 4.275 ppm2 1.871 CV 1
OR { 1738}
(( segid " " and resid 46 and name HA ))
(( segid " " and resid 19 and name HB ))
OR { 1738}
(( segid " " and resid 13 and name HA2 ))
(( segid " " and resid 51 and name HB1 ))
ASSI { 1739}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 32 and name HG2 ))
2.700 2.700 3.300 peak 1739 spectrum 1 weight 0.10000E+01 volume 0.18868E-02 ppm1 4.346 ppm2 1.939 CV 1
OR { 1739}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 39 and name HB ))
OR { 1739}
(( segid " " and resid 36 and name HA ))
(( segid " " and resid 40 and name HB2 ))
ASSI { 1744}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HB1 ))
3.500 1.600 1.600 peak 1744 spectrum 1 weight 0.10000E+01 volume 0.65513E-03 ppm1 4.172 ppm2 1.776 CV 1
OR { 1744}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 26 and name HB1 ))
OR { 1744}
(( segid " " and resid 22 and name HA ))
(( segid " " and resid 25 and name HB2 ))
ASSI { 1752}
(( segid " " and resid 10 and name HA ))
(( segid " " and resid 10 and name HG ))
3.100 1.200 1.200 peak 1752 spectrum 1 weight 0.10000E+01 volume 0.27853E-02 ppm1 4.246 ppm2 1.458 CV 1
OR { 1752}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HD1 ))
OR { 1752}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HD2 ))
ASSI { 1755}
(( segid " " and resid 20 and name HA ))
(( segid " " and resid 20 and name HN ))
3.100 1.200 1.200 peak 1755 spectrum 1 weight 0.10000E+01 volume 0.83068E-03 ppm1 4.246 ppm2 8.657 CV 1
OR { 1755}
(( segid " " and resid 17 and name HA ))
(( segid " " and resid 17 and name HN ))
ASSI { 1760}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 63 and name HB2 ))
3.400 1.500 1.500 peak 1760 spectrum 1 weight 0.10000E+01 volume 0.11838E-02 ppm1 4.018 ppm2 1.899 CV 1
OR { 1760}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 62 and name HB1 ))
OR { 1760}
(( segid " " and resid 60 and name HA ))
(( segid " " and resid 64 and name HB ))
OR { 1760}
(( segid " " and resid 33 and name HB2 ))
(( segid " " and resid 32 and name HG2 ))
ASSI { 1775}
(( segid " " and resid 61 and name HA ))
( segid " " and resid 43 and name HG2%)
3.800 1.800 1.800 peak 1775 spectrum 1 weight 0.10000E+01 volume 0.66151E-03 ppm1 3.815 ppm2 0.862 CV 1
OR { 1775}
(( segid " " and resid 28 and name HB2 ))
( segid " " and resid 43 and name HG2%)
ASSI { 1783}
(( segid " " and resid 14 and name HD1 ))
( segid " " and resid 12 and name HG2%)
2.600 2.600 3.400 peak 1783 spectrum 1 weight 0.10000E+01 volume 0.12305E-02 ppm1 3.620 ppm2 0.910 CV 1
OR { 1783}
(( segid " " and resid 65 and name HA ))
( segid " " and resid 63 and name HD1%)
OR { 1783}
(( segid " " and resid 28 and name HB1 ))
( segid " " and resid 39 and name HD1%)
ASSI { 1784}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 64 and name HG2%)
4.000 2.000 2.000 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.58330E-03 ppm1 3.543 ppm2 0.726 CV 1
OR { 1784}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 19 and name HG1%)
OR { 1784}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 24 and name HG2%)
ASSI { 1785}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 19 and name HG1%)
4.300 2.300 1.700 peak 1785 spectrum 1 weight 0.10000E+01 volume 0.54622E-03 ppm1 3.543 ppm2 0.688 CV 1
OR { 1785}
(( segid " " and resid 21 and name HA ))
( segid " " and resid 24 and name HG2%)
ASSI { 1786}
(( segid " " and resid 64 and name HA ))
( segid " " and resid 43 and name HG2%)
3.900 1.900 1.900 peak 1786 spectrum 1 weight 0.10000E+01 volume 0.76923E-03 ppm1 3.669 ppm2 0.881 CV 1
OR { 1786}
(( segid " " and resid 32 and name HD1 ))
( segid " " and resid 39 and name HD1%)
ASSI { 1797}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 29 and name HB ))
2.300 2.300 3.700 peak 1797 spectrum 1 weight 0.10000E+01 volume 0.39133E-02 ppm1 3.219 ppm2 1.714 CV 1
OR { 1797}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 38 and name HB1 ))
OR { 1797}
(( segid " " and resid 11 and name HB2 ))
(( segid " " and resid 42 and name HB ))
ASSI { 1798}
(( segid " " and resid 70 and name HD1 ))
(( segid " " and resid 70 and name HB2 ))
2.800 0.900 0.900 peak 1798 spectrum 1 weight 0.10000E+01 volume 0.25607E-02 ppm1 3.219 ppm2 1.939 CV 1
OR { 1798}
(( segid " " and resid 31 and name HB2 ))
(( segid " " and resid 32 and name HG2 ))
ASSI { 1804}
(( segid " " and resid 34 and name HB2 ))
(( segid " " and resid 35 and name HA ))
4.000 2.000 2.000 peak 1804 spectrum 1 weight 0.10000E+01 volume 0.49914E-03 ppm1 3.149 ppm2 4.707 CV 1
OR { 1804}
(( segid " " and resid 11 and name HB1 ))
(( segid " " and resid 54 and name HA ))
ASSI { 1821}
(( segid " " and resid 52 and name HD1 ))
( segid " " and resid 43 and name HD1%)
4.200 2.200 1.800 peak 1821 spectrum 1 weight 0.10000E+01 volume 0.32119E-03 ppm1 3.075 ppm2 0.738 CV 1
OR { 1821}
(( segid " " and resid 53 and name HB1 ))
( segid " " and resid 43 and name HD1%)
ASSI { 1822}
(( segid " " and resid 52 and name HD1 ))
(( segid " " and resid 52 and name HA ))
3.700 1.700 1.700 peak 1822 spectrum 1 weight 0.10000E+01 volume 0.33766E-03 ppm1 3.075 ppm2 4.793 CV 1
OR { 1822}
(( segid " " and resid 53 and name HB1 ))
(( segid " " and resid 52 and name HA ))
ASSI { 1838}
(( segid " " and resid 37 and name HB1 ))
(( segid " " and resid 32 and name HD2 ))
2.900 2.900 3.100 peak 1838 spectrum 1 weight 0.10000E+01 volume 0.12392E-02 ppm1 2.716 ppm2 3.872 CV 1
OR { 1838}
(( segid " " and resid 40 and name HG2 ))
(( segid " " and resid 9 and name HB2 ))
ASSI { 1860}
(( segid " " and resid 40 and name HG1 ))
( segid " " and resid 41 and name HG2%)
3.600 1.600 1.600 peak 1860 spectrum 1 weight 0.10000E+01 volume 0.13450E-02 ppm1 2.331 ppm2 0.800 CV 1
OR { 1860}
(( segid " " and resid 14 and name HG2 ))
( segid " " and resid 16 and name HG1%)
ASSI { 1864}
(( segid " " and resid 65 and name HB ))
(( segid " " and resid 63 and name HA ))
3.600 1.600 1.600 peak 1864 spectrum 1 weight 0.10000E+01 volume 0.12241E-02 ppm1 1.831 ppm2 4.160 CV 1
OR { 1864}
(( segid " " and resid 65 and name HB ))
(( segid " " and resid 66 and name HA ))
OR { 1864}
(( segid " " and resid 20 and name HB1 ))
(( segid " " and resid 22 and name HA ))
ASSI { 1866}
(( segid " " and resid 25 and name HB2 ))
(( segid " " and resid 19 and name HA ))
2.100 2.100 3.900 peak 1866 spectrum 1 weight 0.10000E+01 volume 0.71939E-02 ppm1 1.778 ppm2 4.329 CV 1
OR { 1866}
(( segid " " and resid 25 and name HB1 ))
(( segid " " and resid 19 and name HA ))
OR { 1866}
(( segid " " and resid 17 and name HG2 ))
(( segid " " and resid 19 and name HA ))
OR { 1866}
(( segid " " and resid 26 and name HB1 ))
(( segid " " and resid 69 and name HA ))
ASSI { 1869}
(( segid " " and resid 17 and name HB1 ))
(( segid " " and resid 17 and name HA ))
2.900 1.000 1.000 peak 1869 spectrum 1 weight 0.10000E+01 volume 0.15313E-02 ppm1 1.944 ppm2 4.210 CV 1
OR { 1869}
(( segid " " and resid 17 and name HB2 ))
(( segid " " and resid 17 and name HA ))
OR { 1869}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 67 and name HA ))
OR { 1869}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 67 and name HA ))
ASSI { 1871}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 25 and name HA ))
2.600 2.600 3.400 peak 1871 spectrum 1 weight 0.10000E+01 volume 0.89414E-03 ppm1 1.612 ppm2 4.405 CV 1
OR { 1871}
(( segid " " and resid 52 and name HG2 ))
(( segid " " and resid 14 and name HA ))
ASSI { 1879}
(( segid " " and resid 38 and name HB2 ))
(( segid " " and resid 36 and name HB1 ))
3.200 1.300 1.300 peak 1879 spectrum 1 weight 0.10000E+01 volume 0.12101E-02 ppm1 1.878 ppm2 3.938 CV 1
OR { 1879}
(( segid " " and resid 64 and name HB ))
(( segid " " and resid 62 and name HA ))
ASSI { 1880}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 60 and name HA ))
3.100 1.200 1.200 peak 1880 spectrum 1 weight 0.10000E+01 volume 0.30331E-02 ppm1 1.904 ppm2 4.006 CV 1
OR { 1880}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 44 and name HB ))
OR { 1880}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 60 and name HA ))
ASSI { 1890}
(( segid " " and resid 63 and name HB2 ))
(( segid " " and resid 64 and name HN ))
3.100 1.200 1.200 peak 1890 spectrum 1 weight 0.10000E+01 volume 0.18896E-02 ppm1 1.904 ppm2 7.834 CV 1
OR { 1890}
(( segid " " and resid 62 and name HB1 ))
(( segid " " and resid 64 and name HN ))
ASSI { 1898}
(( segid " " and resid 39 and name HB ))
(( segid " " and resid 40 and name HN ))
3.500 1.600 1.600 peak 1898 spectrum 1 weight 0.10000E+01 volume 0.89175E-03 ppm1 1.904 ppm2 8.437 CV 1
OR { 1898}
(( segid " " and resid 26 and name HB2 ))
(( segid " " and resid 27 and name HN ))
ASSI { 1917}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 13 and name HN ))
4.200 2.200 1.800 peak 1917 spectrum 1 weight 0.10000E+01 volume 0.55898E-03 ppm1 2.079 ppm2 8.289 CV 1
OR { 1917}
(( segid " " and resid 14 and name HB2 ))
(( segid " " and resid 12 and name HN ))
ASSI { 1932}
(( segid " " and resid 67 and name HB2 ))
(( segid " " and resid 70 and name HD1 ))
3.400 3.400 2.600 peak 1932 spectrum 1 weight 0.10000E+01 volume 0.10090E-02 ppm1 1.965 ppm2 3.199 CV 1
OR { 1932}
(( segid " " and resid 40 and name HB2 ))
(( segid " " and resid 11 and name HB2 ))
OR { 1932}
(( segid " " and resid 67 and name HB1 ))
(( segid " " and resid 70 and name HD1 ))
ASSI { 1940}
(( segid " " and resid 14 and name HB1 ))
(( segid " " and resid 52 and name HA ))
3.800 1.800 1.800 peak 1940 spectrum 1 weight 0.10000E+01 volume 0.72496E-03 ppm1 2.038 ppm2 4.793 CV 1
OR { 1940}
(( segid " " and resid 43 and name HB ))
(( segid " " and resid 52 and name HA ))
ASSI { 1954}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 36 and name HA ))
2.500 2.500 3.500 peak 1954 spectrum 1 weight 0.10000E+01 volume 0.16494E-02 ppm1 1.453 ppm2 4.307 CV 1
OR { 1954}
(( segid " " and resid 49 and name HG1 ))
(( segid " " and resid 46 and name HA ))
OR { 1954}
( segid " " and resid 61 and name HB% )
(( segid " " and resid 69 and name HA ))
ASSI { 1956}
(( segid " " and resid 38 and name HG2 ))
(( segid " " and resid 36 and name HA ))
2.900 2.900 3.100 peak 1956 spectrum 1 weight 0.10000E+01 volume 0.96673E-03 ppm1 1.432 ppm2 4.307 CV 1
OR { 1956}
(( segid " " and resid 10 and name HG ))
(( segid " " and resid 13 and name HA2 ))
OR { 1956}
( segid " " and resid 61 and name HB% )
(( segid " " and resid 69 and name HA ))
ASSI { 1976}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 52 and name HE ))
4.100 2.100 1.900 peak 1976 spectrum 1 weight 0.10000E+01 volume 0.29956E-03 ppm1 1.060 ppm2 7.362 CV 1
OR { 1976}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 18 and name HN ))
ASSI { 1977}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 40 and name HN ))
3.900 1.900 1.900 peak 1977 spectrum 1 weight 0.10000E+01 volume 0.61762E-03 ppm1 0.921 ppm2 8.414 CV 1
OR { 1977}
( segid " " and resid 39 and name HD1%)
(( segid " " and resid 31 and name HN ))
ASSI { 1980}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 22 and name HN ))
4.300 2.400 1.700 peak 1980 spectrum 1 weight 0.10000E+01 volume 0.27877E-03 ppm1 1.060 ppm2 8.216 CV 1
OR { 1980}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 69 and name HN ))
OR { 1980}
( segid " " and resid 68 and name HG1%)
(( segid " " and resid 69 and name HN ))
OR { 1980}
( segid " " and resid 21 and name HG1%)
(( segid " " and resid 22 and name HN ))
ASSI { 1993}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 14 and name HD1 ))
3.500 1.500 1.500 peak 1993 spectrum 1 weight 0.10000E+01 volume 0.11515E-02 ppm1 0.921 ppm2 3.614 CV 1
OR { 1993}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 53 and name HB2 ))
ASSI { 1998}
( segid " " and resid 43 and name HD1%)
(( segid " " and resid 52 and name HA ))
4.100 2.100 1.900 peak 1998 spectrum 1 weight 0.10000E+01 volume 0.50709E-03 ppm1 0.732 ppm2 4.793 CV 1
OR { 1998}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 40 and name HA ))
ASSI { 1999}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 18 and name HA ))
3.600 1.600 1.600 peak 1999 spectrum 1 weight 0.10000E+01 volume 0.13067E-02 ppm1 0.825 ppm2 4.734 CV 1
OR { 1999}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 40 and name HA ))
ASSI { 2001}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 28 and name HA ))
4.000 2.000 2.000 peak 2001 spectrum 1 weight 0.10000E+01 volume 0.61205E-03 ppm1 0.756 ppm2 4.764 CV 1
OR { 2001}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 40 and name HA ))
ASSI { 2002}
( segid " " and resid 39 and name HG2%)
(( segid " " and resid 38 and name HA ))
4.100 2.100 1.900 peak 2002 spectrum 1 weight 0.10000E+01 volume 0.59810E-03 ppm1 0.732 ppm2 4.764 CV 1
OR { 2002}
( segid " " and resid 43 and name HD1%)
(( segid " " and resid 52 and name HA ))
ASSI { 2006}
( segid " " and resid 19 and name HG2%)
(( segid " " and resid 19 and name HN ))
3.300 1.400 1.400 peak 2006 spectrum 1 weight 0.10000E+01 volume 0.66113E-03 ppm1 0.813 ppm2 9.167 CV 1
OR { 2006}
( segid " " and resid 41 and name HG2%)
(( segid " " and resid 41 and name HN ))
ASSI { 2009}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 52 and name HN ))
4.000 2.000 2.000 peak 2009 spectrum 1 weight 0.10000E+01 volume 0.41016E-03 ppm1 0.732 ppm2 9.167 CV 1
OR { 2009}
( segid " " and resid 43 and name HD1%)
(( segid " " and resid 52 and name HN ))
OR { 2009}
( segid " " and resid 43 and name HD1%)
(( segid " " and resid 41 and name HN ))
ASSI { 2012}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 65 and name HA ))
3.700 1.800 1.800 peak 2012 spectrum 1 weight 0.10000E+01 volume 0.40657E-03 ppm1 0.766 ppm2 3.625 CV 1
OR { 2012}
( segid " " and resid 41 and name HG1%)
(( segid " " and resid 28 and name HB1 ))
ASSI { 2019}
( segid " " and resid 24 and name HG2%)
(( segid " " and resid 46 and name HA ))
3.900 1.900 1.900 peak 2019 spectrum 1 weight 0.10000E+01 volume 0.77242E-03 ppm1 0.714 ppm2 4.270 CV 1
OR { 2019}
( segid " " and resid 19 and name HG1%)
(( segid " " and resid 20 and name HA ))
ASSI { 2038}
(( segid " " and resid 69 and name HA ))
(( segid " " and resid 65 and name HA ))
3.200 3.200 2.800 peak 2038 spectrum 1 weight 0.10000E+01 volume 0.23137E-02 ppm1 4.302 ppm2 3.614 CV 1
OR { 2038}
(( segid " " and resid 19 and name HA ))
(( segid " " and resid 24 and name HA ))
ASSI { 2041}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 64 and name HA ))
2.900 1.000 1.000 peak 2041 spectrum 1 weight 0.10000E+01 volume 0.31636E-02 ppm1 4.142 ppm2 3.639 CV 1
OR { 2041}
(( segid " " and resid 66 and name HA ))
(( segid " " and resid 65 and name HA ))
OR { 2041}
(( segid " " and resid 63 and name HA ))
(( segid " " and resid 65 and name HA ))
ASSI { 2047}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 67 and name HB2 ))
3.800 1.800 1.800 peak 2047 spectrum 1 weight 0.10000E+01 volume 0.66712E-03 ppm1 1.052 ppm2 1.957 CV 1
OR { 2047}
( segid " " and resid 21 and name HG1%)
(( segid " " and resid 67 and name HB2 ))
OR { 2047}
(( segid " " and resid 64 and name HG11))
(( segid " " and resid 67 and name HB1 ))
OR { 2047}
(( segid " " and resid 64 and name HG12))
(( segid " " and resid 67 and name HB1 ))
OR { 2047}
( segid " " and resid 68 and name HG1%)
(( segid " " and resid 67 and name HB2 ))
OR { 2047}
( segid " " and resid 68 and name HG2%)
(( segid " " and resid 67 and name HB2 ))
OR { 2047}
( segid " " and resid 21 and name HG2%)
(( segid " " and resid 67 and name HB1 ))
OR { 2047}
(( segid " " and resid 64 and name HG11))
(( segid " " and resid 67 and name HB2 ))
OR { 2047}
( segid " " and resid 21 and name HG1%)
(( segid " " and resid 67 and name HB1 ))
OR { 2047}
(( segid " " and resid 64 and name HG12))
(( segid " " and resid 67 and name HB2 ))
OR { 2047}
( segid " " and resid 16 and name HG2%)
(( segid " " and resid 17 and name HB1 ))
ASSI { 2070}
(( segid " " and resid 63 and name HN ))
(( segid " " and resid 64 and name HN ))
2.500 0.800 0.800 peak 2070 spectrum 1 weight 0.10000E+01 volume 0.22878E-02 ppm1 7.651 ppm2 7.834 CV 1
OR { 2070}
(( segid " " and resid 66 and name HN ))
(( segid " " and resid 67 and name HN ))
ASSI { 2082}
( segid " " and resid 42 and name HG2%)
(( segid " " and resid 51 and name HB1 ))
2.400 2.400 3.600 peak 2082 spectrum 1 weight 0.10000E+01 volume 0.82869E-02 ppm1 0.744 ppm2 1.837 CV 1
OR { 2082}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 65 and name HB ))
OR { 2082}
( segid " " and resid 64 and name HG2%)
(( segid " " and resid 70 and name HB1 ))
ASSI { 2086}
( segid " " and resid 12 and name HG2%)
(( segid " " and resid 10 and name HG ))
1.900 1.900 4.100 peak 2086 spectrum 1 weight 0.10000E+01 volume 0.93445E-02 ppm1 0.921 ppm2 1.447 CV 1
OR { 2086}
( segid " " and resid 39 and name HD1%)
( segid " " and resid 61 and name HB% )
ASSI { 2089}
(( segid " " and resid 25 and name HB1 ))
( segid " " and resid 64 and name HG2%)
2.500 2.500 3.500 peak 2089 spectrum 1 weight 0.10000E+01 volume 0.19435E-01 ppm1 1.799 ppm2 0.746 CV 1
OR { 2089}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 64 and name HG2%)
OR { 2089}
(( segid " " and resid 25 and name HB2 ))
( segid " " and resid 43 and name HD1%)
OR { 2089}
(( segid " " and resid 25 and name HB1 ))
( segid " " and resid 43 and name HD1%)
! a-helix
assign (resid 61 and name O ) (resid 65 and name HN ) 2.2 0.5 0.2
assign (resid 61 and name O ) (resid 65 and name N ) 3.3 0.8 2.2
assign (resid 62 and name O ) (resid 66 and name HN ) 2.2 0.5 0.2
assign (resid 62 and name O ) (resid 66 and name N ) 3.3 0.8 0.2
assign (resid 63 and name O ) (resid 67 and name HN ) 2.2 0.5 0.2
assign (resid 63 and name O ) (resid 67 and name N ) 3.3 0.8 2.2
assign (resid 64 and name O ) (resid 68 and name HN ) 2.2 0.5 0.2
assign (resid 64 and name O ) (resid 68 and name N ) 3.3 0.8 0.2
assign (resid 65 and name O ) (resid 69 and name HN ) 2.2 0.5 0.2
assign (resid 65 and name O ) (resid 69 and name N ) 3.3 0.8 2.2
!strand 1-2
assign (resid 26 and name O ) (resid 44 and name HN ) 2.2 0.5 0.2
assign (resid 26 and name O ) (resid 44 and name N ) 3.3 0.8 0.2
assign (resid 42 and name O ) (resid 28 and name HN ) 2.2 0.5 0.2
assign (resid 42 and name O ) (resid 28 and name N ) 3.3 0.8 0.2
assign (resid 28 and name O ) (resid 42 and name HN ) 2.2 0.5 0.2
assign (resid 28 and name O ) (resid 42 and name N ) 3.3 0.8 0.2
assign (resid 40 and name O ) (resid 30 and name HN ) 2.2 0.5 0.2
assign (resid 40 and name O ) (resid 30 and name N ) 3.3 0.8 0.2
assign (resid 30 and name O ) (resid 40 and name HN ) 2.2 0.5 0.2
assign (resid 30 and name O ) (resid 40 and name N ) 3.3 0.8 0.2
!strand 2-3
assign (resid 54 and name O ) (resid 41 and name HN ) 2.2 0.5 0.2
assign (resid 54 and name O ) (resid 41 and name N ) 3.3 0.8 0.2
assign (resid 43 and name O ) (resid 52 and name HN ) 2.2 0.5 0.2
assign (resid 43 and name O ) (resid 52 and name N ) 3.3 0.8 0.2
assign (resid 52 and name O ) (resid 43 and name HN ) 2.2 0.5 0.2
assign (resid 52 and name O ) (resid 43 and name N ) 3.3 0.8 0.2
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