NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
8690 |
1mph   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI
(( segid " " and resid "2 " and name "HA "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
4.500 2.700 2.000 peak 2 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "2 " and name "HA "))
(( segid " " and resid "29 " and name "HB "))
4.500 2.700 2.000 peak 6 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "2 " and name "HA "))
(( segid " " and resid "99 " and name "HZ2 "))
3.500 1.700 1.400 peak 10 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "2 " and name "HA "))
(( segid " " and resid "99 " and name "HZ3 "))
4.500 2.700 2.000 peak 11 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "3 " and name "HA2 "))
(( segid " " and resid "4 " and name "HN "))
2.100 0.300 0.400 peak 12 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "4 " and name "HB2 "))
(( segid " " and resid "5 " and name "HN "))
3.000 1.200 1.000 peak 18 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
(( segid " " and resid "25 " and name "HA "))
4.500 2.700 2.000 peak 20 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
4.000 2.200 1.700 peak 22 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "4 " and name "HA "))
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
3.500 1.700 1.400 peak 24 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "4 " and name "HE1 ")
OR
( segid " " and resid "4 " and name "HE2 "))
(( segid " " and resid "27 " and name "HB2 "))
4.000 2.200 1.700 peak 29 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HB1 "))
(( segid " " and resid "6 " and name "HN "))
3.500 1.700 1.400 peak 38 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HG "))
(( segid " " and resid "6 " and name "HN "))
4.500 2.700 2.000 peak 42 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HN "))
(( segid " " and resid "26 " and name "HN "))
3.000 1.200 1.000 peak 43 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HN "))
(( segid " " and resid "27 " and name "HA "))
3.500 1.700 1.400 peak 44 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HB2 "))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
4.500 2.700 2.000 peak 45 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
4.500 2.700 2.000 peak 48 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HG "))
(( segid " " and resid "76 " and name "HZ "))
3.500 1.700 1.400 peak 51 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HA "))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
4.500 2.700 2.000 peak 52 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HB1 "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
3.000 1.200 1.000 peak 53 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HB1 "))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
3.000 1.200 1.000 peak 54 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HB2 "))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
3.500 1.700 1.400 peak 56 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
(( segid " " and resid "88 " and name "HA "))
4.500 2.700 2.000 peak 57 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
3.000 1.200 1.000 peak 58 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
4.000 2.200 1.700 peak 59 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HA "))
(( segid " " and resid "90 " and name "HA "))
3.000 1.200 1.000 peak 61 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HB1 "))
(( segid " " and resid "99 " and name "HZ2 "))
5.000 3.200 2.300 peak 64 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "35 " and name "HB1 ")
OR
( segid " " and resid "35 " and name "HB2 "))
(( segid " " and resid "99 " and name "HZ3 "))
5.000 3.200 2.300 peak 65 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HB2 "))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
5.000 3.200 2.300 peak 66 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HB2 "))
(( segid " " and resid "99 " and name "HZ2 "))
5.000 3.200 2.300 peak 67 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
(( segid " " and resid "99 " and name "HZ2 "))
4.000 2.200 1.700 peak 71 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "99 " and name "HZ3 "))
4.500 2.700 2.000 peak 76 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "5 " and name "HG "))
(( segid " " and resid "99 " and name "HZ3 "))
4.500 2.700 2.000 peak 80 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "6 " and name "HB1 "))
(( segid " " and resid "7 " and name "HN "))
3.500 1.700 1.400 peak 82 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "6 " and name "HA "))
(( segid " " and resid "23 " and name "HZ3 "))
3.000 1.200 1.000 peak 84 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "6 " and name "HB1 "))
(( segid " " and resid "89 " and name "HN "))
4.500 2.700 2.000 peak 87 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "7 " and name "HB1 ")
OR
( segid " " and resid "7 " and name "HB2 "))
(( segid " " and resid "8 " and name "HN "))
3.500 1.700 1.400 peak 91 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "7 " and name "HN "))
(( segid " " and resid "24 " and name "HN "))
3.000 1.200 1.000 peak 95 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
3.000 1.200 1.000 peak 99 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "8 " and name "HA "))
(( segid " " and resid "9 " and name "HN "))
2.100 0.300 0.400 peak 101 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "8 " and name "HB1 "))
(( segid " " and resid "87 " and name "HB2 "))
4.500 2.700 2.000 peak 105 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "8 " and name "HN "))
(( segid " " and resid "88 " and name "HA "))
3.500 1.700 1.400 peak 109 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "9 " and name "HD2 "))
(( segid " " and resid "11 " and name "HN "))
4.500 2.700 2.000 peak 113 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
4.500 2.700 2.000 peak 114 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "9 " and name "HB1 "))
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
4.000 2.200 1.700 peak 115 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "86 " and name "HA "))
2.200 0.400 0.500 peak 118 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "9 " and name "HD2 "))
(( segid " " and resid "86 " and name "HA "))
5.000 3.200 2.300 peak 121 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "9 " and name "HE1 "))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
4.500 2.700 2.000 peak 122 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "11 " and name "HD1 "))
(( segid " " and resid "16 " and name "HA "))
4.000 2.200 1.700 peak 128 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "11 " and name "HH2 "))
(( segid " " and resid "12 " and name "HA "))
4.500 2.700 2.000 peak 130 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "11 " and name "HD1 "))
(( segid " " and resid "16 " and name "HN "))
4.000 2.200 1.700 peak 131 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "11 " and name "HD1 "))
(( segid " " and resid "17 " and name "HA "))
3.000 1.200 1.000 peak 132 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "13 " and name "HN "))
4.000 2.200 1.700 peak 134 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "13 " and name "HN "))
4.500 2.700 2.000 peak 135 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "85 " and name "HN "))
4.500 2.700 2.000 peak 137 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "12 " and name "HB1 ")
OR
( segid " " and resid "12 " and name "HB2 "))
(( segid " " and resid "13 " and name "HN "))
3.500 1.700 1.400 peak 141 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "14 " and name "HD2 "))
4.500 2.700 2.000 peak 144 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "15 " and name "HN "))
3.500 1.700 1.400 peak 147 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "14 " and name "HB1 ")
OR
( segid " " and resid "14 " and name "HB2 "))
(( segid " " and resid "15 " and name "HN "))
3.000 1.200 1.000 peak 148 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "16 " and name "HA "))
(( segid " " and resid "17 " and name "HN "))
3.500 1.700 1.400 peak 151 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "17 " and name "HB1 ")
OR
( segid " " and resid "17 " and name "HB2 "))
(( segid " " and resid "18 " and name "HN "))
3.500 1.700 1.400 peak 155 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "19 " and name "HA "))
(( segid " " and resid "20 " and name "HN "))
4.000 2.200 1.700 peak 158 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "19 " and name "HB1 ")
OR
( segid " " and resid "19 " and name "HB2 "))
(( segid " " and resid "20 " and name "HN "))
4.000 2.200 1.700 peak 159 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "23 " and name "HN "))
2.200 0.400 0.500 peak 160 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "22 " and name "HB1 "))
(( segid " " and resid "23 " and name "HN "))
3.500 1.700 1.400 peak 161 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "22 " and name "HB2 "))
(( segid " " and resid "23 " and name "HN "))
3.000 1.200 1.000 peak 162 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "23 " and name "HB2 "))
(( segid " " and resid "24 " and name "HN "))
4.000 2.200 1.700 peak 165 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "23 " and name "HZ2 "))
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
3.500 1.700 1.400 peak 169 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "23 " and name "HZ2 "))
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
3.500 1.700 1.400 peak 170 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "23 " and name "HZ3 "))
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
3.500 1.700 1.400 peak 171 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "23 " and name "HZ3 "))
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
3.500 1.700 1.400 peak 172 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "23 " and name "HZ3 "))
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
4.500 2.700 2.000 peak 176 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "23 " and name "HZ3 "))
(( segid " " and resid "89 " and name "HG1 ")
OR
( segid " " and resid "89 " and name "HG2 "))
4.500 2.700 2.000 peak 178 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "24 " and name "HB1 "))
(( segid " " and resid "25 " and name "HN "))
4.500 2.700 2.000 peak 181 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "27 " and name "HN "))
3.500 1.700 1.400 peak 189 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "37 " and name "HD1 ")
OR
( segid " " and resid "37 " and name "HD2 "))
3.000 1.200 1.000 peak 191 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
4.500 2.700 2.000 peak 194 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "39 " and name "HN "))
5.000 3.200 2.300 peak 196 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "29 " and name "HB "))
3.500 1.700 1.400 peak 203 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "29 " and name "HG21")
OR
( segid " " and resid "29 " and name "HG23")
OR
( segid " " and resid "29 " and name "HG22"))
3.500 1.700 1.400 peak 205 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
(( segid " " and resid "29 " and name "HG21")
OR
( segid " " and resid "29 " and name "HG23")
OR
( segid " " and resid "29 " and name "HG22"))
3.500 1.700 1.400 peak 207 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "40 " and name "HB1 ")
OR
( segid " " and resid "40 " and name "HB2 "))
5.000 3.200 2.300 peak 211 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "41 " and name "HA "))
4.000 2.200 1.700 peak 213 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "41 " and name "HB1 ")
OR
( segid " " and resid "41 " and name "HB3 ")
OR
( segid " " and resid "41 " and name "HB2 "))
4.500 2.700 2.000 peak 214 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "28 " and name "HB2 "))
(( segid " " and resid "29 " and name "HN "))
3.000 1.200 1.000 peak 218 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "29 " and name "HB "))
(( segid " " and resid "30 " and name "HN "))
4.000 2.200 1.700 peak 222 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "29 " and name "HG11")
OR
( segid " " and resid "29 " and name "HG13")
OR
( segid " " and resid "29 " and name "HG12"))
(( segid " " and resid "30 " and name "HN "))
4.000 2.200 1.700 peak 223 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "29 " and name "HG21")
OR
( segid " " and resid "29 " and name "HG23")
OR
( segid " " and resid "29 " and name "HG22"))
(( segid " " and resid "31 " and name "HN "))
4.000 2.200 1.700 peak 224 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "30 " and name "HB "))
(( segid " " and resid "31 " and name "HN "))
3.500 1.700 1.400 peak 228 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "30 " and name "HA "))
(( segid " " and resid "35 " and name "HA "))
2.200 0.400 0.500 peak 230 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "35 " and name "HN "))
2.200 0.400 0.500 peak 232 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "57 " and name "HA "))
2.200 0.400 0.500 peak 234 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "36 " and name "HN "))
2.100 0.300 0.400 peak 236 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "35 " and name "HG2 "))
(( segid " " and resid "36 " and name "HN "))
4.000 2.200 1.700 peak 239 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "36 " and name "HA2 "))
(( segid " " and resid "37 " and name "HN "))
2.100 0.300 0.400 peak 241 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "36 " and name "HA1 "))
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
3.000 1.200 1.000 peak 242 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "36 " and name "HA1 "))
(( segid " " and resid "55 " and name "HA "))
3.000 1.200 1.000 peak 243 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "36 " and name "HA2 "))
(( segid " " and resid "55 " and name "HA "))
2.300 0.500 0.500 peak 244 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "36 " and name "HA1 "))
(( segid " " and resid "56 " and name "HN "))
3.500 1.700 1.400 peak 245 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "36 " and name "HA2 "))
(( segid " " and resid "56 " and name "HN "))
4.000 2.200 1.700 peak 246 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "37 " and name "HB1 ")
OR
( segid " " and resid "37 " and name "HB2 "))
(( segid " " and resid "38 " and name "HN "))
3.000 1.200 1.000 peak 248 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "37 " and name "HD1 ")
OR
( segid " " and resid "37 " and name "HD2 "))
(( segid " " and resid "56 " and name "HB "))
3.000 1.200 1.000 peak 249 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "38 " and name "HD1 ")
OR
( segid " " and resid "38 " and name "HD2 "))
(( segid " " and resid "43 " and name "HA "))
4.000 2.200 1.700 peak 257 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
(( segid " " and resid "43 " and name "HA "))
4.500 2.700 2.000 peak 259 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "50 " and name "HN "))
3.500 1.700 1.400 peak 261 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
(( segid " " and resid "50 " and name "HN "))
4.500 2.700 2.000 peak 262 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
(( segid " " and resid "47 " and name "HA1 "))
3.500 1.700 1.400 peak 263 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "39 " and name "HA "))
(( segid " " and resid "40 " and name "HN "))
3.500 1.700 1.400 peak 264 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "39 " and name "HB1 "))
(( segid " " and resid "40 " and name "HN "))
4.000 2.200 1.700 peak 265 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "39 " and name "HN "))
(( segid " " and resid "43 " and name "HA "))
3.500 1.700 1.400 peak 268 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "39 " and name "HA "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
3.500 1.700 1.400 peak 270 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "39 " and name "HA "))
(( segid " " and resid "50 " and name "HE1 ")
OR
( segid " " and resid "50 " and name "HE2 "))
3.000 1.200 1.000 peak 271 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "39 " and name "HD1 "))
(( segid " " and resid "50 " and name "HE1 ")
OR
( segid " " and resid "50 " and name "HE2 "))
4.000 2.200 1.700 peak 274 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "39 " and name "HN "))
(( segid " " and resid "50 " and name "HA "))
4.500 2.700 2.000 peak 277 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "40 " and name "HA "))
(( segid " " and resid "41 " and name "HN "))
3.500 1.700 1.400 peak 279 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "40 " and name "HB1 ")
OR
( segid " " and resid "40 " and name "HB2 "))
(( segid " " and resid "41 " and name "HN "))
2.500 0.700 0.700 peak 280 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "40 " and name "HN "))
(( segid " " and resid "43 " and name "HA "))
4.000 2.200 1.700 peak 282 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "42 " and name "HN "))
3.500 1.700 1.400 peak 284 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
(( segid " " and resid "43 " and name "HN "))
3.000 1.200 1.000 peak 289 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "42 " and name "HN "))
(( segid " " and resid "43 " and name "HN "))
3.000 1.200 1.000 peak 290 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "42 " and name "HA "))
(( segid " " and resid "45 " and name "HB1 ")
OR
( segid " " and resid "45 " and name "HB3 ")
OR
( segid " " and resid "45 " and name "HB2 "))
3.500 1.700 1.400 peak 291 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "46 " and name "HN "))
4.000 2.200 1.700 peak 294 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "44 " and name "HN "))
(( segid " " and resid "38 " and name "HB2 "))
4.000 2.200 1.700 peak 297 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "44 " and name "HA "))
(( segid " " and resid "45 " and name "HN "))
3.500 1.700 1.400 peak 298 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "44 " and name "HN "))
(( segid " " and resid "45 " and name "HN "))
4.000 2.200 1.700 peak 300 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "45 " and name "HA "))
(( segid " " and resid "46 " and name "HN "))
4.000 2.200 1.700 peak 301 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "46 " and name "HA "))
(( segid " " and resid "47 " and name "HN "))
3.500 1.700 1.400 peak 304 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "46 " and name "HB1 "))
(( segid " " and resid "47 " and name "HN "))
3.500 1.700 1.400 peak 305 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "46 " and name "HB2 "))
(( segid " " and resid "47 " and name "HN "))
3.500 1.700 1.400 peak 306 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "47 " and name "HA1 "))
(( segid " " and resid "48 " and name "HN "))
3.500 1.700 1.400 peak 308 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "47 " and name "HA2 "))
(( segid " " and resid "48 " and name "HN "))
3.500 1.700 1.400 peak 309 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "48 " and name "HA "))
(( segid " " and resid "49 " and name "HD2 "))
2.200 0.400 0.500 peak 312 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "48 " and name "HD11")
OR
( segid " " and resid "48 " and name "HD13")
OR
( segid " " and resid "48 " and name "HD12"))
(( segid " " and resid "49 " and name "HD2 "))
4.500 2.700 2.000 peak 313 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "48 " and name "HG21")
OR
( segid " " and resid "48 " and name "HG23")
OR
( segid " " and resid "48 " and name "HG22"))
(( segid " " and resid "49 " and name "HD1 "))
3.500 1.700 1.400 peak 314 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "50 " and name "HA "))
(( segid " " and resid "51 " and name "HN "))
3.000 1.200 1.000 peak 317 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "51 " and name "HB2 "))
(( segid " " and resid "52 " and name "HN "))
4.000 2.200 1.700 peak 320 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "52 " and name "HA "))
(( segid " " and resid "53 " and name "HN "))
3.500 1.700 1.400 peak 322 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "52 " and name "HN "))
(( segid " " and resid "53 " and name "HN "))
3.000 1.200 1.000 peak 324 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "53 " and name "HN "))
(( segid " " and resid "54 " and name "HN "))
4.000 2.200 1.700 peak 326 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "54 " and name "HB "))
(( segid " " and resid "55 " and name "HD1 "))
4.000 2.200 1.700 peak 328 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "54 " and name "HB "))
(( segid " " and resid "55 " and name "HD2 "))
3.000 1.200 1.000 peak 329 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "56 " and name "HG11")
OR
( segid " " and resid "56 " and name "HG13")
OR
( segid " " and resid "56 " and name "HG12"))
(( segid " " and resid "57 " and name "HN "))
3.000 1.200 1.000 peak 332 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "56 " and name "HG21")
OR
( segid " " and resid "56 " and name "HG23")
OR
( segid " " and resid "56 " and name "HG22"))
(( segid " " and resid "57 " and name "HN "))
2.100 0.300 0.400 peak 333 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "56 " and name "HG21")
OR
( segid " " and resid "56 " and name "HG23")
OR
( segid " " and resid "56 " and name "HG22"))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
4.500 2.700 2.000 peak 335 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "57 " and name "HB1 "))
(( segid " " and resid "58 " and name "HN "))
4.000 2.200 1.700 peak 338 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "58 " and name "HG "))
(( segid " " and resid "59 " and name "HN "))
3.500 1.700 1.400 peak 342 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "59 " and name "HE1 ")
OR
( segid " " and resid "59 " and name "HE2 "))
(( segid " " and resid "60 " and name "HN "))
4.000 2.200 1.700 peak 347 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB3 ")
OR
( segid " " and resid "61 " and name "HB2 "))
(( segid " " and resid "62 " and name "HN "))
3.000 1.200 1.000 peak 353 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "61 " and name "HA "))
(( segid " " and resid "80 " and name "HN "))
4.500 2.700 2.000 peak 354 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "62 " and name "HG21")
OR
( segid " " and resid "62 " and name "HG23")
OR
( segid " " and resid "62 " and name "HG22"))
(( segid " " and resid "63 " and name "HN "))
2.000 0.200 0.300 peak 356 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "62 " and name "HB "))
(( segid " " and resid "79 " and name "HN "))
3.500 1.700 1.400 peak 357 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "63 " and name "HB2 "))
(( segid " " and resid "64 " and name "HN "))
4.500 2.700 2.000 peak 363 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "63 " and name "HA "))
(( segid " " and resid "78 " and name "HB1 "))
4.500 2.700 2.000 peak 365 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "63 " and name "HA "))
(( segid " " and resid "78 " and name "HD21")
OR
( segid " " and resid "78 " and name "HD23")
OR
( segid " " and resid "78 " and name "HD22"))
4.000 2.200 1.700 peak 367 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "64 " and name "HN "))
(( segid " " and resid "78 " and name "HA "))
3.500 1.700 1.400 peak 371 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB3 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "67 " and name "HN "))
3.000 1.200 1.000 peak 378 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "67 " and name "HB1 "))
(( segid " " and resid "68 " and name "HN "))
3.500 1.700 1.400 peak 382 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "68 " and name "HN "))
3.500 1.700 1.400 peak 383 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "74 " and name "HD2 "))
4.500 2.700 2.000 peak 385 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "68 " and name "HA "))
(( segid " " and resid "69 " and name "HN "))
3.500 1.700 1.400 peak 386 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "68 " and name "HB1 ")
OR
( segid " " and resid "68 " and name "HB2 "))
(( segid " " and resid "69 " and name "HN "))
3.500 1.700 1.400 peak 387 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
(( segid " " and resid "87 " and name "HG "))
4.500 2.700 2.000 peak 393 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "69 " and name "HE1 ")
OR
( segid " " and resid "69 " and name "HE2 "))
(( segid " " and resid "87 " and name "HG "))
4.500 2.700 2.000 peak 396 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "69 " and name "HE1 ")
OR
( segid " " and resid "69 " and name "HE2 "))
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
5.000 3.200 2.300 peak 398 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "70 " and name "HB1 ")
OR
( segid " " and resid "70 " and name "HB2 "))
(( segid " " and resid "71 " and name "HN "))
4.500 2.700 2.000 peak 399 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
(( segid " " and resid "72 " and name "HN "))
3.500 1.700 1.400 peak 402 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "71 " and name "HD1 ")
OR
( segid " " and resid "71 " and name "HD2 "))
(( segid " " and resid "72 " and name "HN "))
4.000 2.200 1.700 peak 403 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "71 " and name "HE1 ")
OR
( segid " " and resid "71 " and name "HE2 "))
(( segid " " and resid "72 " and name "HN "))
4.500 2.700 2.000 peak 404 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "72 " and name "HB1 ")
OR
( segid " " and resid "72 " and name "HB2 "))
(( segid " " and resid "73 " and name "HN "))
4.500 2.700 2.000 peak 406 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "73 " and name "HA "))
(( segid " " and resid "74 " and name "HN "))
3.000 1.200 1.000 peak 407 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "73 " and name "HB1 ")
OR
( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "74 " and name "HN "))
4.000 2.200 1.700 peak 408 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "73 " and name "HD1 ")
OR
( segid " " and resid "73 " and name "HD2 "))
(( segid " " and resid "74 " and name "HN "))
3.500 1.700 1.400 peak 409 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "73 " and name "HN "))
(( segid " " and resid "74 " and name "HN "))
3.000 1.200 1.000 peak 411 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "75 " and name "HB "))
(( segid " " and resid "76 " and name "HN "))
3.500 1.700 1.400 peak 414 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
(( segid " " and resid "76 " and name "HN "))
3.000 1.200 1.000 peak 416 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
(( segid " " and resid "89 " and name "HA "))
4.000 2.200 1.700 peak 419 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "90 " and name "HN "))
4.000 2.200 1.700 peak 421 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
(( segid " " and resid "77 " and name "HA "))
3.500 1.700 1.400 peak 425 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "76 " and name "HZ "))
(( segid " " and resid "88 " and name "HB2 "))
4.000 2.200 1.700 peak 427 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "76 " and name "HZ "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
4.500 2.700 2.000 peak 428 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
(( segid " " and resid "96 " and name "HB1 ")
OR
( segid " " and resid "96 " and name "HB2 "))
4.000 2.200 1.700 peak 430 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "77 " and name "HB1 "))
(( segid " " and resid "78 " and name "HN "))
4.000 2.200 1.700 peak 437 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "77 " and name "HG1 ")
OR
( segid " " and resid "77 " and name "HG2 "))
(( segid " " and resid "78 " and name "HN "))
4.000 2.200 1.700 peak 439 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "77 " and name "HA "))
(( segid " " and resid "88 " and name "HN "))
3.500 1.700 1.400 peak 442 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "78 " and name "HN "))
(( segid " " and resid "87 " and name "HA "))
3.500 1.700 1.400 peak 444 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "78 " and name "HN "))
(( segid " " and resid "87 " and name "HG "))
4.000 2.200 1.700 peak 447 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "79 " and name "HA "))
(( segid " " and resid "86 " and name "HN "))
3.500 1.700 1.400 peak 450 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "80 " and name "HB1 "))
(( segid " " and resid "81 " and name "HN "))
4.000 2.200 1.700 peak 452 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "80 " and name "HG "))
(( segid " " and resid "82 " and name "HN "))
4.000 2.200 1.700 peak 455 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "80 " and name "HD11")
OR
( segid " " and resid "80 " and name "HD13")
OR
( segid " " and resid "80 " and name "HD12"))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
3.500 1.700 1.400 peak 459 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "80 " and name "HD21")
OR
( segid " " and resid "80 " and name "HD23")
OR
( segid " " and resid "80 " and name "HD22"))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
3.500 1.700 1.400 peak 461 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "80 " and name "HG "))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
3.500 1.700 1.400 peak 463 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "81 " and name "HB1 "))
(( segid " " and resid "82 " and name "HN "))
3.500 1.700 1.400 peak 466 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "81 " and name "HB2 "))
(( segid " " and resid "82 " and name "HN "))
3.500 1.700 1.400 peak 467 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "83 " and name "HA1 "))
(( segid " " and resid "84 " and name "HN "))
4.000 2.200 1.700 peak 470 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "83 " and name "HN "))
(( segid " " and resid "84 " and name "HN "))
3.000 1.200 1.000 peak 472 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "85 " and name "HB2 "))
(( segid " " and resid "86 " and name "HN "))
3.500 1.700 1.400 peak 477 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
(( segid " " and resid "87 " and name "HN "))
3.500 1.700 1.400 peak 480 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "86 " and name "HB1 "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
3.000 1.200 1.000 peak 481 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "86 " and name "HB1 "))
(( segid " " and resid "88 " and name "HZ "))
3.000 1.200 1.000 peak 482 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "35 " and name "HE1 ")
OR
( segid " " and resid "35 " and name "HE3 ")
OR
( segid " " and resid "35 " and name "HE2 "))
(( segid " " and resid "88 " and name "HZ "))
2.500 0.700 0.700 peak 484 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
4.000 2.200 1.700 peak 485 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "88 " and name "HA "))
(( segid " " and resid "89 " and name "HN "))
2.200 0.400 0.500 peak 489 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "88 " and name "HB1 "))
(( segid " " and resid "89 " and name "HN "))
3.500 1.700 1.400 peak 490 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "88 " and name "HB2 "))
(( segid " " and resid "89 " and name "HN "))
4.000 2.200 1.700 peak 491 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "89 " and name "HA "))
(( segid " " and resid "90 " and name "HN "))
2.200 0.400 0.500 peak 492 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "89 " and name "HG1 ")
OR
( segid " " and resid "89 " and name "HG2 "))
(( segid " " and resid "90 " and name "HN "))
3.500 1.700 1.400 peak 494 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "90 " and name "HN "))
(( segid " " and resid "91 " and name "HN "))
3.500 1.700 1.400 peak 496 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "91 " and name "HE1 ")
OR
( segid " " and resid "91 " and name "HE2 "))
(( segid " " and resid "92 " and name "HN "))
3.500 1.700 1.400 peak 500 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "93 " and name "HA "))
(( segid " " and resid "94 " and name "HN "))
4.000 2.200 1.700 peak 504 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "93 " and name "HB1 "))
(( segid " " and resid "94 " and name "HN "))
3.500 1.700 1.400 peak 505 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "94 " and name "HB2 "))
(( segid " " and resid "95 " and name "HN "))
3.500 1.700 1.400 peak 508 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "94 " and name "HA "))
(( segid " " and resid "97 " and name "HB1 "))
4.000 2.200 1.700 peak 510 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "94 " and name "HA "))
(( segid " " and resid "97 " and name "HB2 "))
4.000 2.200 1.700 peak 511 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "95 " and name "HB1 "))
(( segid " " and resid "96 " and name "HN "))
3.500 1.700 1.400 peak 514 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "95 " and name "HB2 "))
(( segid " " and resid "96 " and name "HN "))
3.000 1.200 1.000 peak 515 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "95 " and name "HA "))
(( segid " " and resid "98 " and name "HB "))
3.500 1.700 1.400 peak 518 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "96 " and name "HA "))
(( segid " " and resid "97 " and name "HN "))
3.500 1.700 1.400 peak 522 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "96 " and name "HB1 ")
OR
( segid " " and resid "96 " and name "HB2 "))
(( segid " " and resid "97 " and name "HN "))
3.500 1.700 1.400 peak 523 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "97 " and name "HA "))
(( segid " " and resid "98 " and name "HN "))
3.500 1.700 1.400 peak 525 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "97 " and name "HA "))
(( segid " " and resid "100 " and name "HB "))
3.500 1.700 1.400 peak 529 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "97 " and name "HA "))
(( segid " " and resid "100 " and name "HN "))
3.000 1.200 1.000 peak 531 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "98 " and name "HA "))
(( segid " " and resid "101 " and name "HB1 ")
OR
( segid " " and resid "101 " and name "HB2 "))
4.500 2.700 2.000 peak 535 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "99 " and name "HA "))
(( segid " " and resid "100 " and name "HN "))
4.000 2.200 1.700 peak 538 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "99 " and name "HB2 "))
(( segid " " and resid "100 " and name "HN "))
3.500 1.700 1.400 peak 540 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "99 " and name "HE3 "))
(( segid " " and resid "30 " and name "HG21")
OR
( segid " " and resid "30 " and name "HG23")
OR
( segid " " and resid "30 " and name "HG22"))
4.000 2.200 1.700 peak 541 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "99 " and name "HN "))
(( segid " " and resid "100 " and name "HN "))
2.800 1.000 0.900 peak 542 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "99 " and name "HA "))
(( segid " " and resid "102 " and name "HB1 ")
OR
( segid " " and resid "102 " and name "HB3 ")
OR
( segid " " and resid "102 " and name "HB2 "))
3.500 1.700 1.400 peak 543 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "99 " and name "HE3 "))
(( segid " " and resid "102 " and name "HB1 ")
OR
( segid " " and resid "102 " and name "HB3 ")
OR
( segid " " and resid "102 " and name "HB2 "))
4.000 2.200 1.700 peak 545 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "100 " and name "HA "))
(( segid " " and resid "101 " and name "HN "))
4.000 2.200 1.700 peak 546 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "100 " and name "HB "))
(( segid " " and resid "101 " and name "HN "))
3.500 1.700 1.400 peak 547 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "101 " and name "HN "))
3.500 1.700 1.400 peak 548 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "100 " and name "HN "))
(( segid " " and resid "101 " and name "HN "))
2.800 1.000 0.900 peak 549 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "100 " and name "HA "))
(( segid " " and resid "103 " and name "HB "))
3.500 1.700 1.400 peak 550 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "100 " and name "HA "))
(( segid " " and resid "103 " and name "HN "))
3.000 1.200 1.000 peak 551 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "101 " and name "HA "))
(( segid " " and resid "102 " and name "HN "))
4.000 2.200 1.700 peak 552 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "102 " and name "HA "))
(( segid " " and resid "103 " and name "HN "))
4.500 2.700 2.000 peak 555 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "103 " and name "HA "))
(( segid " " and resid "106 " and name "HB1 ")
OR
( segid " " and resid "106 " and name "HB3 ")
OR
( segid " " and resid "106 " and name "HB2 "))
4.000 2.200 1.700 peak 562 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "103 " and name "HA "))
(( segid " " and resid "106 " and name "HN "))
3.000 1.200 1.000 peak 563 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "104 " and name "HB1 "))
(( segid " " and resid "105 " and name "HN "))
4.000 2.200 1.700 peak 565 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "105 " and name "HA "))
(( segid " " and resid "106 " and name "HN "))
3.500 1.700 1.400 peak 567 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "105 " and name "HN "))
(( segid " " and resid "106 " and name "HN "))
2.800 1.000 0.900 peak 568 volume 0.000E+00 ppm1 -999.000 ppm2 -999.000
ASSI
(( segid " " and resid "88 " and name "HN "))
(( segid " " and resid "76 " and name "HN "))
2.800 0.400 0.400 peak 12 volume 0.174E+08 ppm1 8.918 ppm2 9.599
ASSI
(( segid " " and resid "64 " and name "HN "))
(( segid " " and resid "77 " and name "HN "))
2.700 0.400 0.400 peak 17 volume 0.182E+08 ppm1 8.725 ppm2 9.711
ASSI
(( segid " " and resid "56 " and name "HN "))
(( segid " " and resid "35 " and name "HN "))
2.800 0.400 0.400 peak 22 volume 0.160E+08 ppm1 8.522 ppm2 8.867
ASSI
(( segid " " and resid "29 " and name "HN "))
(( segid " " and resid "36 " and name "HN "))
2.900 0.400 0.400 peak 23 volume 0.132E+08 ppm1 8.467 ppm2 8.935
ASSI
(( segid " " and resid "98 " and name "HN "))
(( segid " " and resid "97 " and name "HN "))
2.600 0.400 0.400 peak 27 volume 0.273E+08 ppm1 8.311 ppm2 8.471
ASSI
(( segid " " and resid "94 " and name "HN "))
(( segid " " and resid "95 " and name "HN "))
2.500 0.400 0.400 peak 28 volume 0.295E+08 ppm1 8.298 ppm2 9.355
ASSI
(( segid " " and resid "104 " and name "HN "))
(( segid " " and resid "103 " and name "HN "))
2.600 0.400 0.400 peak 32 volume 0.264E+08 ppm1 8.237 ppm2 8.474
ASSI
(( segid " " and resid "96 " and name "HN "))
(( segid " " and resid "95 " and name "HN "))
2.700 0.400 0.400 peak 55 volume 0.207E+08 ppm1 8.098 ppm2 9.359
ASSI
(( segid " " and resid "96 " and name "HN "))
(( segid " " and resid "97 " and name "HN "))
2.800 0.400 0.400 peak 56 volume 0.147E+08 ppm1 8.098 ppm2 8.471
ASSI
(( segid " " and resid "99 " and name "HN "))
(( segid " " and resid "98 " and name "HN "))
3.000 0.500 0.500 peak 66 volume 0.118E+08 ppm1 8.037 ppm2 8.294
ASSI
(( segid " " and resid "67 " and name "HN "))
(( segid " " and resid "68 " and name "HN "))
2.700 0.400 0.400 peak 67 volume 0.207E+08 ppm1 8.030 ppm2 8.816
ASSI
(( segid " " and resid "102 " and name "HN "))
(( segid " " and resid "103 " and name "HN "))
2.700 0.400 0.400 peak 74 volume 0.205E+08 ppm1 7.939 ppm2 8.477
ASSI
(( segid " " and resid "82 " and name "HN "))
(( segid " " and resid "83 " and name "HN "))
2.600 0.400 0.400 peak 83 volume 0.268E+08 ppm1 7.762 ppm2 8.043
ASSI
(( segid " " and resid "82 " and name "HN "))
(( segid " " and resid "81 " and name "HN "))
2.900 0.400 0.400 peak 84 volume 0.136E+08 ppm1 7.759 ppm2 9.325
ASSI
(( segid " " and resid "11 " and name "HN "))
(( segid " " and resid "10 " and name "HN "))
2.400 0.400 0.400 peak 90 volume 0.371E+08 ppm1 7.694 ppm2 8.057
ASSI
(( segid " " and resid "6 " and name "HN "))
(( segid " " and resid "89 " and name "HN "))
2.800 0.400 0.400 peak 93 volume 0.180E+08 ppm1 7.627 ppm2 9.623
ASSI
(( segid " " and resid "44 " and name "HN "))
(( segid " " and resid "43 " and name "HN "))
2.800 0.400 0.400 peak 94 volume 0.169E+08 ppm1 7.603 ppm2 8.674
ASSI
(( segid " " and resid "4 " and name "HZ "))
(( segid " " and resid "4 " and name "HE1 ")
OR
( segid " " and resid "4 " and name "HE2 "))
1.900 0.300 0.300 peak 95 volume 0.213E+09 ppm1 7.552 ppm2 7.718
ASSI
(( segid " " and resid "105 " and name "HN "))
(( segid " " and resid "104 " and name "HN "))
2.700 0.400 0.400 peak 96 volume 0.191E+08 ppm1 7.525 ppm2 8.226
ASSI
(( segid " " and resid "92 " and name "HN "))
(( segid " " and resid "91 " and name "HN "))
2.600 0.400 0.400 peak 98 volume 0.239E+08 ppm1 7.488 ppm2 9.230
ASSI
(( segid " " and resid "61 " and name "HN "))
(( segid " " and resid "60 " and name "HN "))
2.800 0.400 0.400 peak 102 volume 0.168E+08 ppm1 7.437 ppm2 9.427
ASSI
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
(( segid " " and resid "5 " and name "HN "))
2.800 0.400 0.400 peak 105 volume 0.179E+08 ppm1 7.410 ppm2 9.301
ASSI
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
(( segid " " and resid "4 " and name "HN "))
2.800 0.400 0.400 peak 106 volume 0.198E+08 ppm1 7.410 ppm2 8.857
ASSI
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
(( segid " " and resid "4 " and name "HE1 ")
OR
( segid " " and resid "4 " and name "HE2 "))
2.300 0.300 0.300 peak 108 volume 0.883E+08 ppm1 7.406 ppm2 7.725
ASSI
(( segid " " and resid "99 " and name "HD1 "))
(( segid " " and resid "99 " and name "HN "))
3.100 0.500 0.500 peak 111 volume 0.114E+08 ppm1 7.254 ppm2 8.043
ASSI
(( segid " " and resid "99 " and name "HD1 "))
(( segid " " and resid "99 " and name "HE1 "))
2.600 0.400 0.400 peak 112 volume 0.405E+08 ppm1 7.250 ppm2 10.599
ASSI
(( segid " " and resid "38 " and name "HD1 ")
OR
( segid " " and resid "38 " and name "HD2 "))
(( segid " " and resid "38 " and name "HN "))
2.900 0.400 0.400 peak 113 volume 0.165E+08 ppm1 7.247 ppm2 9.688
ASSI
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
(( segid " " and resid "76 " and name "HN "))
2.800 0.400 0.400 peak 119 volume 0.217E+08 ppm1 7.040 ppm2 9.599
ASSI
(( segid " " and resid "23 " and name "HE3 "))
(( segid " " and resid "24 " and name "HN "))
3.300 0.500 0.500 peak 122 volume 0.762E+07 ppm1 6.955 ppm2 9.050
ASSI
(( segid " " and resid "69 " and name "HE1 ")
OR
( segid " " and resid "69 " and name "HE2 "))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
2.100 0.300 0.300 peak 134 volume 0.136E+09 ppm1 6.799 ppm2 7.277
ASSI
(( segid " " and resid "99 " and name "HZ2 "))
(( segid " " and resid "99 " and name "HE1 "))
2.600 0.400 0.400 peak 136 volume 0.238E+08 ppm1 6.789 ppm2 10.599
ASSI
(( segid " " and resid "99 " and name "HH2 "))
(( segid " " and resid "3 " and name "HN "))
2.700 0.400 0.400 peak 141 volume 0.253E+08 ppm1 6.725 ppm2 8.047
ASSI
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
2.200 0.300 0.300 peak 142 volume 0.104E+09 ppm1 6.725 ppm2 7.040
ASSI
(( segid " " and resid "23 " and name "HZ3 "))
(( segid " " and resid "23 " and name "HE3 "))
2.400 0.400 0.400 peak 149 volume 0.396E+08 ppm1 6.616 ppm2 6.965
ASSI
(( segid " " and resid "23 " and name "HZ3 "))
(( segid " " and resid "89 " and name "HN "))
2.700 0.400 0.400 peak 150 volume 0.176E+08 ppm1 6.610 ppm2 9.623
ASSI
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
2.100 0.300 0.300 peak 151 volume 0.127E+09 ppm1 6.555 ppm2 6.887
ASSI
(( segid " " and resid "99 " and name "HZ3 "))
(( segid " " and resid "99 " and name "HE3 "))
2.500 0.400 0.400 peak 157 volume 0.320E+08 ppm1 6.494 ppm2 7.131
ASSI
(( segid " " and resid "99 " and name "HZ3 "))
(( segid " " and resid "99 " and name "HH2 "))
2.500 0.400 0.400 peak 158 volume 0.341E+08 ppm1 6.474 ppm2 6.721
ASSI
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
(( segid " " and resid "38 " and name "HD1 ")
OR
( segid " " and resid "38 " and name "HD2 "))
2.400 0.400 0.400 peak 159 volume 0.557E+08 ppm1 6.471 ppm2 7.243
ASSI
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
(( segid " " and resid "48 " and name "HN "))
3.200 0.500 0.500 peak 163 volume 0.897E+07 ppm1 6.454 ppm2 8.098
ASSI
(( segid " " and resid "23 " and name "HH2 "))
(( segid " " and resid "23 " and name "HZ2 "))
2.300 0.300 0.300 peak 166 volume 0.594E+08 ppm1 6.427 ppm2 7.020
ASSI
(( segid " " and resid "23 " and name "HH2 "))
(( segid " " and resid "23 " and name "HZ3 "))
2.500 0.400 0.400 peak 167 volume 0.342E+08 ppm1 6.423 ppm2 6.613
ASSI
(( segid " " and resid "76 " and name "HZ "))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
2.300 0.300 0.300 peak 178 volume 0.836E+08 ppm1 6.233 ppm2 6.715
ASSI
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
2.200 0.300 0.300 peak 182 volume 0.107E+09 ppm1 6.064 ppm2 6.440
ASSI
(( segid " " and resid "63 " and name "HA "))
(( segid " " and resid "63 " and name "HN "))
2.800 0.400 0.400 peak 187 volume 0.178E+08 ppm1 5.884 ppm2 8.976
ASSI
(( segid " " and resid "63 " and name "HA "))
(( segid " " and resid "64 " and name "HN "))
2.200 0.300 0.300 peak 188 volume 0.791E+08 ppm1 5.877 ppm2 8.715
ASSI
(( segid " " and resid "85 " and name "HA "))
(( segid " " and resid "86 " and name "HN "))
2.100 0.300 0.300 peak 190 volume 0.835E+08 ppm1 5.715 ppm2 9.271
ASSI
(( segid " " and resid "2 " and name "HA "))
(( segid " " and resid "3 " and name "HN "))
2.300 0.300 0.300 peak 193 volume 0.518E+08 ppm1 5.644 ppm2 8.047
ASSI
(( segid " " and resid "2 " and name "HA "))
(( segid " " and resid "99 " and name "HH2 "))
2.500 0.400 0.400 peak 194 volume 0.360E+08 ppm1 5.644 ppm2 6.715
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
2.500 0.400 0.400 peak 197 volume 0.458E+08 ppm1 5.596 ppm2 6.396
ASSI
(( segid " " and resid "6 " and name "HA "))
(( segid " " and resid "7 " and name "HN "))
2.200 0.300 0.300 peak 198 volume 0.649E+08 ppm1 5.582 ppm2 9.728
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "38 " and name "HD1 ")
OR
( segid " " and resid "38 " and name "HD2 "))
3.300 0.500 0.500 peak 200 volume 0.825E+07 ppm1 5.579 ppm2 7.243
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "4 " and name "HE1 ")
OR
( segid " " and resid "4 " and name "HE2 "))
3.200 0.500 0.500 peak 202 volume 0.987E+07 ppm1 5.576 ppm2 7.715
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
3.300 0.500 0.500 peak 203 volume 0.949E+07 ppm1 5.572 ppm2 7.406
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "76 " and name "HN "))
2.100 0.300 0.300 peak 206 volume 0.105E+09 ppm1 5.555 ppm2 9.596
ASSI
(( segid " " and resid "88 " and name "HA "))
(( segid " " and resid "88 " and name "HN "))
2.900 0.400 0.400 peak 207 volume 0.135E+08 ppm1 5.555 ppm2 8.915
ASSI
(( segid " " and resid "76 " and name "HA "))
(( segid " " and resid "76 " and name "HN "))
2.900 0.400 0.400 peak 208 volume 0.127E+08 ppm1 5.481 ppm2 9.603
ASSI
(( segid " " and resid "28 " and name "HA "))
(( segid " " and resid "29 " and name "HN "))
2.200 0.300 0.300 peak 210 volume 0.733E+08 ppm1 5.467 ppm2 8.460
ASSI
(( segid " " and resid "28 " and name "HA "))
(( segid " " and resid "28 " and name "HN "))
3.000 0.500 0.500 peak 211 volume 0.117E+08 ppm1 5.464 ppm2 8.515
ASSI
(( segid " " and resid "76 " and name "HA "))
(( segid " " and resid "77 " and name "HN "))
2.300 0.300 0.300 peak 212 volume 0.603E+08 ppm1 5.460 ppm2 9.711
ASSI
(( segid " " and resid "76 " and name "HA "))
(( segid " " and resid "66 " and name "HN "))
2.300 0.300 0.300 peak 213 volume 0.572E+08 ppm1 5.460 ppm2 8.715
ASSI
(( segid " " and resid "78 " and name "HA "))
(( segid " " and resid "78 " and name "HN "))
2.700 0.400 0.400 peak 215 volume 0.198E+08 ppm1 5.454 ppm2 9.257
ASSI
(( segid " " and resid "78 " and name "HA "))
(( segid " " and resid "79 " and name "HN "))
2.200 0.300 0.300 peak 216 volume 0.763E+08 ppm1 5.450 ppm2 9.521
ASSI
(( segid " " and resid "78 " and name "HA "))
(( segid " " and resid "63 " and name "HA "))
2.500 0.400 0.400 peak 217 volume 0.338E+08 ppm1 5.450 ppm2 5.870
ASSI
(( segid " " and resid "25 " and name "HA "))
(( segid " " and resid "26 " and name "HN "))
2.100 0.300 0.300 peak 220 volume 0.843E+08 ppm1 5.389 ppm2 9.145
ASSI
(( segid " " and resid "25 " and name "HA "))
(( segid " " and resid "6 " and name "HA "))
2.200 0.300 0.300 peak 221 volume 0.777E+08 ppm1 5.389 ppm2 5.575
ASSI
(( segid " " and resid "77 " and name "HA "))
(( segid " " and resid "78 " and name "HN "))
2.200 0.300 0.300 peak 222 volume 0.777E+08 ppm1 5.349 ppm2 9.254
ASSI
(( segid " " and resid "77 " and name "HA "))
(( segid " " and resid "77 " and name "HN "))
2.900 0.400 0.400 peak 223 volume 0.123E+08 ppm1 5.345 ppm2 9.705
ASSI
(( segid " " and resid "79 " and name "HA "))
(( segid " " and resid "80 " and name "HN "))
2.100 0.300 0.300 peak 226 volume 0.806E+08 ppm1 5.298 ppm2 9.145
ASSI
(( segid " " and resid "79 " and name "HA "))
(( segid " " and resid "85 " and name "HA "))
2.300 0.300 0.300 peak 227 volume 0.500E+08 ppm1 5.294 ppm2 5.708
ASSI
(( segid " " and resid "89 " and name "HA "))
(( segid " " and resid "75 " and name "HA "))
2.400 0.400 0.400 peak 228 volume 0.423E+08 ppm1 5.288 ppm2 5.545
ASSI
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "34 " and name "HN "))
3.100 0.500 0.500 peak 229 volume 0.875E+07 ppm1 5.281 ppm2 7.979
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "38 " and name "HN "))
2.200 0.300 0.300 peak 232 volume 0.753E+08 ppm1 5.203 ppm2 9.691
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "37 " and name "HN "))
2.900 0.400 0.400 peak 235 volume 0.123E+08 ppm1 5.203 ppm2 7.538
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "37 " and name "HD1 ")
OR
( segid " " and resid "37 " and name "HD2 "))
2.500 0.400 0.400 peak 236 volume 0.404E+08 ppm1 5.203 ppm2 7.247
ASSI
(( segid " " and resid "4 " and name "HA "))
(( segid " " and resid "28 " and name "HN "))
3.000 0.500 0.500 peak 237 volume 0.100E+08 ppm1 5.193 ppm2 8.504
ASSI
(( segid " " and resid "4 " and name "HA "))
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
2.600 0.400 0.400 peak 238 volume 0.320E+08 ppm1 5.193 ppm2 7.413
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "28 " and name "HA "))
2.700 0.400 0.400 peak 239 volume 0.196E+08 ppm1 5.193 ppm2 5.460
ASSI
(( segid " " and resid "4 " and name "HA "))
(( segid " " and resid "5 " and name "HN "))
2.200 0.300 0.300 peak 240 volume 0.782E+08 ppm1 5.189 ppm2 9.301
ASSI
(( segid " " and resid "86 " and name "HA "))
(( segid " " and resid "87 " and name "HN "))
2.200 0.300 0.300 peak 243 volume 0.765E+08 ppm1 5.054 ppm2 8.837
ASSI
(( segid " " and resid "86 " and name "HA "))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
3.000 0.500 0.500 peak 244 volume 0.133E+08 ppm1 5.047 ppm2 6.440
ASSI
(( segid " " and resid "30 " and name "HA "))
(( segid " " and resid "31 " and name "HN "))
2.100 0.300 0.300 peak 246 volume 0.804E+08 ppm1 5.037 ppm2 8.725
ASSI
(( segid " " and resid "30 " and name "HA "))
(( segid " " and resid "30 " and name "HN "))
3.100 0.500 0.500 peak 247 volume 0.873E+07 ppm1 5.030 ppm2 8.382
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "7 " and name "HN "))
2.900 0.400 0.400 peak 248 volume 0.122E+08 ppm1 5.020 ppm2 9.735
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "8 " and name "HN "))
2.200 0.300 0.300 peak 250 volume 0.682E+08 ppm1 5.013 ppm2 8.864
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "88 " and name "HA "))
2.600 0.400 0.400 peak 251 volume 0.276E+08 ppm1 5.013 ppm2 5.575
ASSI
(( segid " " and resid "87 " and name "HA "))
(( segid " " and resid "88 " and name "HN "))
2.200 0.300 0.300 peak 253 volume 0.750E+08 ppm1 5.006 ppm2 8.915
ASSI
(( segid " " and resid "87 " and name "HA "))
(( segid " " and resid "77 " and name "HA "))
2.600 0.400 0.400 peak 254 volume 0.258E+08 ppm1 5.003 ppm2 5.345
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "65 " and name "HN "))
2.200 0.300 0.300 peak 255 volume 0.671E+08 ppm1 4.996 ppm2 8.969
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "38 " and name "HD1 ")
OR
( segid " " and resid "38 " and name "HD2 "))
2.900 0.400 0.400 peak 257 volume 0.170E+08 ppm1 4.976 ppm2 7.240
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "39 " and name "HN "))
2.500 0.400 0.400 peak 258 volume 0.322E+08 ppm1 4.969 ppm2 10.118
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "38 " and name "HN "))
2.800 0.400 0.400 peak 260 volume 0.165E+08 ppm1 4.962 ppm2 9.694
ASSI
(( segid " " and resid "90 " and name "HA "))
(( segid " " and resid "91 " and name "HN "))
2.400 0.400 0.400 peak 261 volume 0.411E+08 ppm1 4.942 ppm2 9.227
ASSI
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "25 " and name "HN "))
2.400 0.400 0.400 peak 264 volume 0.383E+08 ppm1 4.928 ppm2 8.982
ASSI
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "24 " and name "HN "))
3.000 0.500 0.500 peak 267 volume 0.101E+08 ppm1 4.908 ppm2 9.043
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "66 " and name "HN "))
2.900 0.400 0.400 peak 269 volume 0.123E+08 ppm1 4.860 ppm2 8.725
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "67 " and name "HN "))
2.300 0.300 0.300 peak 270 volume 0.587E+08 ppm1 4.860 ppm2 8.023
ASSI
(( segid " " and resid "80 " and name "HA "))
(( segid " " and resid "81 " and name "HN "))
2.400 0.400 0.400 peak 272 volume 0.429E+08 ppm1 4.854 ppm2 9.325
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "32 " and name "HN "))
2.400 0.400 0.400 peak 277 volume 0.395E+08 ppm1 4.823 ppm2 9.250
ASSI
(( segid " " and resid "56 " and name "HA "))
(( segid " " and resid "57 " and name "HN "))
2.100 0.300 0.300 peak 439 volume 0.938E+08 ppm1 4.688 ppm2 8.806
ASSI
(( segid " " and resid "55 " and name "HA "))
(( segid " " and resid "56 " and name "HN "))
2.200 0.300 0.300 peak 441 volume 0.675E+08 ppm1 4.684 ppm2 8.508
ASSI
(( segid " " and resid "48 " and name "HA "))
(( segid " " and resid "48 " and name "HN "))
2.600 0.400 0.400 peak 442 volume 0.253E+08 ppm1 4.667 ppm2 8.104
ASSI
(( segid " " and resid "12 " and name "HA "))
(( segid " " and resid "12 " and name "HN "))
3.000 0.500 0.500 peak 451 volume 0.119E+08 ppm1 4.654 ppm2 8.694
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "24 " and name "HN "))
2.200 0.300 0.300 peak 461 volume 0.666E+08 ppm1 4.640 ppm2 9.050
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "58 " and name "HN "))
2.100 0.300 0.300 peak 463 volume 0.862E+08 ppm1 4.637 ppm2 8.772
ASSI
(( segid " " and resid "46 " and name "HA "))
(( segid " " and resid "46 " and name "HN "))
2.500 0.400 0.400 peak 473 volume 0.299E+08 ppm1 4.613 ppm2 7.515
ASSI
(( segid " " and resid "29 " and name "HA "))
(( segid " " and resid "30 " and name "HN "))
2.200 0.300 0.300 peak 474 volume 0.614E+08 ppm1 4.603 ppm2 8.396
ASSI
(( segid " " and resid "29 " and name "HA "))
(( segid " " and resid "2 " and name "HA "))
2.500 0.400 0.400 peak 475 volume 0.363E+08 ppm1 4.603 ppm2 5.640
ASSI
(( segid " " and resid "61 " and name "HA "))
(( segid " " and resid "62 " and name "HN "))
2.100 0.300 0.300 peak 479 volume 0.922E+08 ppm1 4.582 ppm2 8.793
ASSI
(( segid " " and resid "61 " and name "HA "))
(( segid " " and resid "61 " and name "HN "))
2.700 0.400 0.400 peak 481 volume 0.189E+08 ppm1 4.582 ppm2 7.430
ASSI
(( segid " " and resid "49 " and name "HA "))
(( segid " " and resid "50 " and name "HN "))
2.300 0.300 0.300 peak 487 volume 0.561E+08 ppm1 4.576 ppm2 8.688
ASSI
(( segid " " and resid "5 " and name "HA "))
(( segid " " and resid "6 " and name "HN "))
2.300 0.300 0.300 peak 490 volume 0.572E+08 ppm1 4.572 ppm2 7.626
ASSI
(( segid " " and resid "54 " and name "HA "))
(( segid " " and resid "54 " and name "HN "))
2.700 0.400 0.400 peak 492 volume 0.194E+08 ppm1 4.545 ppm2 7.874
ASSI
(( segid " " and resid "84 " and name "HA "))
(( segid " " and resid "85 " and name "HN "))
2.200 0.300 0.300 peak 494 volume 0.627E+08 ppm1 4.535 ppm2 8.877
ASSI
(( segid " " and resid "74 " and name "HA "))
(( segid " " and resid "75 " and name "HN "))
2.500 0.400 0.400 peak 497 volume 0.292E+08 ppm1 4.528 ppm2 7.938
ASSI
(( segid " " and resid "105 " and name "HA "))
(( segid " " and resid "105 " and name "HN "))
2.600 0.400 0.400 peak 502 volume 0.249E+08 ppm1 4.504 ppm2 7.521
ASSI
(( segid " " and resid "69 " and name "HA "))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
2.600 0.400 0.400 peak 504 volume 0.299E+08 ppm1 4.498 ppm2 7.281
ASSI
(( segid " " and resid "69 " and name "HA "))
(( segid " " and resid "70 " and name "HN "))
2.700 0.400 0.400 peak 505 volume 0.216E+08 ppm1 4.494 ppm2 8.172
ASSI
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "63 " and name "HN "))
2.100 0.300 0.300 peak 508 volume 0.843E+08 ppm1 4.437 ppm2 8.976
ASSI
(( segid " " and resid "26 " and name "HA "))
(( segid " " and resid "26 " and name "HN "))
2.600 0.400 0.400 peak 510 volume 0.248E+08 ppm1 4.416 ppm2 9.142
ASSI
(( segid " " and resid "26 " and name "HA "))
(( segid " " and resid "27 " and name "HN "))
2.200 0.300 0.300 peak 511 volume 0.657E+08 ppm1 4.416 ppm2 9.101
ASSI
(( segid " " and resid "72 " and name "HA "))
(( segid " " and resid "73 " and name "HN "))
2.300 0.300 0.300 peak 513 volume 0.562E+08 ppm1 4.403 ppm2 8.277
ASSI
(( segid " " and resid "72 " and name "HA "))
(( segid " " and resid "72 " and name "HN "))
2.800 0.400 0.400 peak 514 volume 0.171E+08 ppm1 4.396 ppm2 7.152
ASSI
(( segid " " and resid "39 " and name "HA "))
(( segid " " and resid "39 " and name "HN "))
2.900 0.400 0.400 peak 516 volume 0.122E+08 ppm1 4.389 ppm2 10.115
ASSI
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "10 " and name "HN "))
2.400 0.400 0.400 peak 518 volume 0.453E+08 ppm1 4.386 ppm2 8.060
ASSI
(( segid " " and resid "97 " and name "HA "))
(( segid " " and resid "97 " and name "HN "))
2.800 0.400 0.400 peak 520 volume 0.159E+08 ppm1 4.365 ppm2 8.471
ASSI
(( segid " " and resid "50 " and name "HA "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
2.600 0.400 0.400 peak 522 volume 0.301E+08 ppm1 4.345 ppm2 6.765
ASSI
(( segid " " and resid "50 " and name "HA "))
(( segid " " and resid "50 " and name "HN "))
2.900 0.400 0.400 peak 523 volume 0.142E+08 ppm1 4.342 ppm2 8.691
ASSI
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "10 " and name "HN "))
2.900 0.400 0.400 peak 527 volume 0.143E+08 ppm1 4.311 ppm2 8.064
ASSI
(( segid " " and resid "32 " and name "HA "))
(( segid " " and resid "32 " and name "HN "))
2.400 0.400 0.400 peak 528 volume 0.441E+08 ppm1 4.298 ppm2 9.250
ASSI
(( segid " " and resid "98 " and name "HB "))
(( segid " " and resid "98 " and name "HN "))
2.400 0.400 0.400 peak 531 volume 0.386E+08 ppm1 4.271 ppm2 8.298
ASSI
(( segid " " and resid "40 " and name "HA "))
(( segid " " and resid "4 " and name "HZ "))
2.600 0.400 0.400 peak 538 volume 0.338E+08 ppm1 4.237 ppm2 7.545
ASSI
(( segid " " and resid "81 " and name "HA "))
(( segid " " and resid "81 " and name "HN "))
2.900 0.400 0.400 peak 539 volume 0.124E+08 ppm1 4.226 ppm2 9.332
ASSI
(( segid " " and resid "53 " and name "HA "))
(( segid " " and resid "53 " and name "HN "))
2.700 0.400 0.400 peak 541 volume 0.195E+08 ppm1 4.223 ppm2 8.304
ASSI
(( segid " " and resid "81 " and name "HA "))
(( segid " " and resid "82 " and name "HN "))
3.000 0.500 0.500 peak 542 volume 0.110E+08 ppm1 4.223 ppm2 7.755
ASSI
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "67 " and name "HN "))
2.600 0.400 0.400 peak 548 volume 0.271E+08 ppm1 4.206 ppm2 8.023
ASSI
(( segid " " and resid "91 " and name "HA "))
(( segid " " and resid "91 " and name "HN "))
2.800 0.400 0.400 peak 550 volume 0.172E+08 ppm1 4.179 ppm2 9.223
ASSI
(( segid " " and resid "59 " and name "HA "))
(( segid " " and resid "60 " and name "HN "))
2.200 0.300 0.300 peak 555 volume 0.665E+08 ppm1 4.128 ppm2 9.427
ASSI
(( segid " " and resid "27 " and name "HA "))
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
2.800 0.400 0.400 peak 562 volume 0.193E+08 ppm1 4.101 ppm2 5.565
ASSI
(( segid " " and resid "27 " and name "HA "))
(( segid " " and resid "28 " and name "HN "))
2.100 0.300 0.300 peak 563 volume 0.813E+08 ppm1 4.098 ppm2 8.504
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "60 " and name "HN "))
2.300 0.300 0.300 peak 584 volume 0.520E+08 ppm1 3.986 ppm2 9.427
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "61 " and name "HN "))
2.800 0.400 0.400 peak 587 volume 0.175E+08 ppm1 3.982 ppm2 7.430
ASSI
(( segid " " and resid "81 " and name "HB2 "))
(( segid " " and resid "81 " and name "HN "))
2.600 0.400 0.400 peak 590 volume 0.220E+08 ppm1 3.969 ppm2 9.328
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "66 " and name "HN "))
2.200 0.300 0.300 peak 591 volume 0.685E+08 ppm1 3.962 ppm2 8.715
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "65 " and name "HN "))
2.900 0.400 0.400 peak 592 volume 0.138E+08 ppm1 3.959 ppm2 8.969
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "76 " and name "HA "))
2.400 0.400 0.400 peak 594 volume 0.393E+08 ppm1 3.959 ppm2 5.453
ASSI
(( segid " " and resid "81 " and name "HB2 "))
(( segid " " and resid "81 " and name "HB1 "))
1.900 0.300 0.300 peak 595 volume 0.134E+09 ppm1 3.955 ppm2 4.118
ASSI
(( segid " " and resid "57 " and name "HB2 "))
(( segid " " and resid "57 " and name "HN "))
2.400 0.400 0.400 peak 597 volume 0.321E+08 ppm1 3.949 ppm2 8.803
ASSI
(( segid " " and resid "18 " and name "HA "))
(( segid " " and resid "19 " and name "HN "))
2.400 0.400 0.400 peak 598 volume 0.406E+08 ppm1 3.945 ppm2 8.267
ASSI
(( segid " " and resid "46 " and name "HB2 "))
(( segid " " and resid "46 " and name "HN "))
2.400 0.400 0.400 peak 616 volume 0.315E+08 ppm1 3.874 ppm2 7.525
ASSI
(( segid " " and resid "19 " and name "HB1 ")
OR
( segid " " and resid "19 " and name "HB2 "))
(( segid " " and resid "19 " and name "HA "))
2.400 0.400 0.400 peak 626 volume 0.343E+08 ppm1 3.823 ppm2 4.142
ASSI
(( segid " " and resid "96 " and name "HA "))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
3.100 0.500 0.500 peak 628 volume 0.102E+08 ppm1 3.816 ppm2 6.718
ASSI
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "18 " and name "HN "))
2.300 0.300 0.300 peak 638 volume 0.487E+08 ppm1 3.681 ppm2 7.193
ASSI
(( segid " " and resid "3 " and name "HA2 "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
2.800 0.400 0.400 peak 654 volume 0.210E+08 ppm1 3.593 ppm2 6.392
ASSI
(( segid " " and resid "3 " and name "HA2 "))
(( segid " " and resid "3 " and name "HN "))
2.900 0.400 0.400 peak 657 volume 0.134E+08 ppm1 3.582 ppm2 8.054
ASSI
(( segid " " and resid "100 " and name "HA "))
(( segid " " and resid "100 " and name "HN "))
2.700 0.400 0.400 peak 670 volume 0.191E+08 ppm1 3.515 ppm2 8.104
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "11 " and name "HE3 "))
2.600 0.400 0.400 peak 675 volume 0.275E+08 ppm1 3.454 ppm2 7.443
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "11 " and name "HN "))
2.800 0.400 0.400 peak 680 volume 0.133E+08 ppm1 3.433 ppm2 7.708
ASSI
(( segid " " and resid "9 " and name "HB1 "))
(( segid " " and resid "9 " and name "HN "))
2.700 0.400 0.400 peak 686 volume 0.155E+08 ppm1 3.399 ppm2 9.393
ASSI
(( segid " " and resid "83 " and name "HA2 "))
(( segid " " and resid "83 " and name "HN "))
2.500 0.400 0.400 peak 697 volume 0.295E+08 ppm1 3.355 ppm2 8.043
ASSI
(( segid " " and resid "4 " and name "HB1 "))
(( segid " " and resid "5 " and name "HN "))
2.900 0.400 0.400 peak 704 volume 0.115E+08 ppm1 3.281 ppm2 9.301
ASSI
(( segid " " and resid "4 " and name "HB1 "))
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
2.400 0.400 0.400 peak 705 volume 0.446E+08 ppm1 3.281 ppm2 7.406
ASSI
(( segid " " and resid "69 " and name "HB1 "))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
2.400 0.400 0.400 peak 706 volume 0.452E+08 ppm1 3.274 ppm2 7.277
ASSI
(( segid " " and resid "69 " and name "HB1 "))
(( segid " " and resid "69 " and name "HN "))
2.500 0.400 0.400 peak 708 volume 0.272E+08 ppm1 3.264 ppm2 7.789
ASSI
(( segid " " and resid "76 " and name "HB1 "))
(( segid " " and resid "76 " and name "HA "))
2.600 0.400 0.400 peak 730 volume 0.229E+08 ppm1 3.135 ppm2 5.450
ASSI
(( segid " " and resid "76 " and name "HB1 "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
2.400 0.400 0.400 peak 738 volume 0.462E+08 ppm1 3.121 ppm2 7.033
ASSI
(( segid " " and resid "76 " and name "HB2 "))
(( segid " " and resid "76 " and name "HA "))
2.600 0.400 0.400 peak 759 volume 0.237E+08 ppm1 3.006 ppm2 5.450
ASSI
(( segid " " and resid "76 " and name "HB2 "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
2.400 0.400 0.400 peak 760 volume 0.422E+08 ppm1 3.003 ppm2 7.033
ASSI
(( segid " " and resid "4 " and name "HB2 "))
(( segid " " and resid "4 " and name "HN "))
2.400 0.400 0.400 peak 767 volume 0.358E+08 ppm1 2.972 ppm2 8.860
ASSI
(( segid " " and resid "99 " and name "HB1 "))
(( segid " " and resid "100 " and name "HN "))
2.800 0.400 0.400 peak 768 volume 0.129E+08 ppm1 2.972 ppm2 8.108
ASSI
(( segid " " and resid "4 " and name "HB2 "))
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
2.300 0.300 0.300 peak 769 volume 0.534E+08 ppm1 2.972 ppm2 7.406
ASSI
(( segid " " and resid "99 " and name "HB1 "))
(( segid " " and resid "99 " and name "HD1 "))
2.800 0.400 0.400 peak 770 volume 0.175E+08 ppm1 2.972 ppm2 7.247
ASSI
(( segid " " and resid "99 " and name "HB1 "))
(( segid " " and resid "99 " and name "HN "))
2.400 0.400 0.400 peak 771 volume 0.373E+08 ppm1 2.969 ppm2 8.043
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "41 " and name "HN "))
2.700 0.400 0.400 peak 777 volume 0.208E+08 ppm1 2.959 ppm2 7.860
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
3.000 0.500 0.500 peak 778 volume 0.122E+08 ppm1 2.959 ppm2 6.392
ASSI
(( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "24 " and name "HD2 "))
3.000 0.500 0.500 peak 780 volume 0.105E+08 ppm1 2.952 ppm2 6.860
ASSI
(( segid " " and resid "69 " and name "HB2 "))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
2.500 0.400 0.400 peak 786 volume 0.346E+08 ppm1 2.932 ppm2 7.281
ASSI
(( segid " " and resid "69 " and name "HB2 "))
(( segid " " and resid "69 " and name "HN "))
2.500 0.400 0.400 peak 787 volume 0.258E+08 ppm1 2.928 ppm2 7.786
ASSI
(( segid " " and resid "6 " and name "HB1 "))
(( segid " " and resid "23 " and name "HE3 "))
2.500 0.400 0.400 peak 788 volume 0.338E+08 ppm1 2.918 ppm2 6.955
ASSI
(( segid " " and resid "97 " and name "HB1 "))
(( segid " " and resid "97 " and name "HN "))
2.500 0.400 0.400 peak 790 volume 0.288E+08 ppm1 2.915 ppm2 8.471
ASSI
(( segid " " and resid "6 " and name "HB1 "))
(( segid " " and resid "6 " and name "HA "))
2.600 0.400 0.400 peak 791 volume 0.193E+08 ppm1 2.915 ppm2 5.586
ASSI
(( segid " " and resid "6 " and name "HB1 "))
(( segid " " and resid "6 " and name "HN "))
2.800 0.400 0.400 peak 795 volume 0.127E+08 ppm1 2.908 ppm2 7.626
ASSI
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "40 " and name "HN "))
2.900 0.400 0.400 peak 805 volume 0.113E+08 ppm1 2.837 ppm2 7.457
ASSI
(( segid " " and resid "6 " and name "HB2 "))
(( segid " " and resid "6 " and name "HA "))
2.500 0.400 0.400 peak 808 volume 0.309E+08 ppm1 2.816 ppm2 5.572
ASSI
(( segid " " and resid "28 " and name "HB1 "))
(( segid " " and resid "28 " and name "HA "))
2.800 0.400 0.400 peak 809 volume 0.139E+08 ppm1 2.813 ppm2 5.464
ASSI
(( segid " " and resid "28 " and name "HB1 "))
(( segid " " and resid "99 " and name "HH2 "))
2.500 0.400 0.400 peak 812 volume 0.304E+08 ppm1 2.806 ppm2 6.711
ASSI
(( segid " " and resid "28 " and name "HB1 "))
(( segid " " and resid "28 " and name "HN "))
2.500 0.400 0.400 peak 813 volume 0.262E+08 ppm1 2.799 ppm2 8.504
ASSI
(( segid " " and resid "32 " and name "HB2 "))
(( segid " " and resid "32 " and name "HB1 "))
1.800 0.300 0.300 peak 819 volume 0.154E+09 ppm1 2.782 ppm2 2.992
ASSI
(( segid " " and resid "63 " and name "HB1 "))
(( segid " " and resid "63 " and name "HA "))
2.700 0.400 0.400 peak 820 volume 0.178E+08 ppm1 2.779 ppm2 5.874
ASSI
(( segid " " and resid "44 " and name "HA "))
(( segid " " and resid "38 " and name "HD1 ")
OR
( segid " " and resid "38 " and name "HD2 "))
2.700 0.400 0.400 peak 822 volume 0.236E+08 ppm1 2.769 ppm2 7.250
ASSI
(( segid " " and resid "25 " and name "HB1 ")
OR
( segid " " and resid "25 " and name "HB2 "))
(( segid " " and resid "25 " and name "HA "))
2.500 0.400 0.400 peak 824 volume 0.281E+08 ppm1 2.762 ppm2 5.379
ASSI
(( segid " " and resid "25 " and name "HB1 ")
OR
( segid " " and resid "25 " and name "HB2 "))
(( segid " " and resid "25 " and name "HN "))
2.300 0.300 0.300 peak 826 volume 0.429E+08 ppm1 2.759 ppm2 8.979
ASSI
(( segid " " and resid "97 " and name "HB2 "))
(( segid " " and resid "98 " and name "HN "))
2.500 0.400 0.400 peak 827 volume 0.279E+08 ppm1 2.759 ppm2 8.298
ASSI
(( segid " " and resid "97 " and name "HB2 "))
(( segid " " and resid "97 " and name "HN "))
2.400 0.400 0.400 peak 834 volume 0.358E+08 ppm1 2.742 ppm2 8.471
ASSI
(( segid " " and resid "99 " and name "HB2 "))
(( segid " " and resid "76 " and name "HZ "))
2.900 0.400 0.400 peak 840 volume 0.127E+08 ppm1 2.731 ppm2 6.223
ASSI
(( segid " " and resid "82 " and name "HB1 ")
OR
( segid " " and resid "82 " and name "HB2 "))
(( segid " " and resid "82 " and name "HN "))
2.600 0.400 0.400 peak 842 volume 0.201E+08 ppm1 2.725 ppm2 7.752
ASSI
(( segid " " and resid "99 " and name "HB2 "))
(( segid " " and resid "99 " and name "HE3 "))
2.600 0.400 0.400 peak 845 volume 0.239E+08 ppm1 2.715 ppm2 7.131
ASSI
(( segid " " and resid "31 " and name "HB1 "))
(( segid " " and resid "31 " and name "HN "))
2.800 0.400 0.400 peak 852 volume 0.133E+08 ppm1 2.701 ppm2 8.725
ASSI
(( segid " " and resid "63 " and name "HB2 "))
(( segid " " and resid "63 " and name "HN "))
3.000 0.500 0.500 peak 861 volume 0.858E+07 ppm1 2.664 ppm2 8.979
ASSI
(( segid " " and resid "63 " and name "HB2 "))
(( segid " " and resid "63 " and name "HA "))
2.700 0.400 0.400 peak 862 volume 0.190E+08 ppm1 2.664 ppm2 5.887
ASSI
(( segid " " and resid "37 " and name "HB1 ")
OR
( segid " " and resid "37 " and name "HB2 "))
(( segid " " and resid "37 " and name "HN "))
2.500 0.400 0.400 peak 865 volume 0.256E+08 ppm1 2.650 ppm2 7.542
ASSI
(( segid " " and resid "37 " and name "HB1 ")
OR
( segid " " and resid "37 " and name "HB2 "))
(( segid " " and resid "37 " and name "HD1 ")
OR
( segid " " and resid "37 " and name "HD2 "))
2.200 0.300 0.300 peak 867 volume 0.723E+08 ppm1 2.647 ppm2 7.247
ASSI
(( segid " " and resid "27 " and name "HB1 "))
(( segid " " and resid "27 " and name "HN "))
2.600 0.400 0.400 peak 871 volume 0.216E+08 ppm1 2.637 ppm2 9.108
ASSI
(( segid " " and resid "31 " and name "HB2 "))
(( segid " " and resid "31 " and name "HN "))
2.800 0.400 0.400 peak 875 volume 0.134E+08 ppm1 2.630 ppm2 8.725
ASSI
(( segid " " and resid "27 " and name "HB1 "))
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
2.500 0.400 0.400 peak 876 volume 0.323E+08 ppm1 2.630 ppm2 5.569
ASSI
(( segid " " and resid "92 " and name "HB1 ")
OR
( segid " " and resid "92 " and name "HB2 "))
(( segid " " and resid "92 " and name "HN "))
2.500 0.400 0.400 peak 879 volume 0.262E+08 ppm1 2.626 ppm2 7.481
ASSI
(( segid " " and resid "31 " and name "HB2 "))
(( segid " " and resid "31 " and name "HB1 "))
1.700 0.300 0.300 peak 883 volume 0.203E+09 ppm1 2.606 ppm2 2.697
ASSI
(( segid " " and resid "50 " and name "HB1 "))
(( segid " " and resid "50 " and name "HN "))
2.500 0.400 0.400 peak 888 volume 0.263E+08 ppm1 2.579 ppm2 8.688
ASSI
(( segid " " and resid "50 " and name "HB1 "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
2.400 0.400 0.400 peak 889 volume 0.413E+08 ppm1 2.576 ppm2 6.765
ASSI
(( segid " " and resid "95 " and name "HG1 ")
OR
( segid " " and resid "95 " and name "HG2 "))
(( segid " " and resid "99 " and name "HD1 "))
2.200 0.300 0.300 peak 895 volume 0.719E+08 ppm1 2.548 ppm2 7.243
ASSI
(( segid " " and resid "9 " and name "HB2 "))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
3.000 0.500 0.500 peak 900 volume 0.106E+08 ppm1 2.515 ppm2 6.437
ASSI
(( segid " " and resid "96 " and name "HG1 "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
2.500 0.400 0.400 peak 917 volume 0.311E+08 ppm1 2.413 ppm2 7.033
ASSI
(( segid " " and resid "84 " and name "HB2 "))
(( segid " " and resid "85 " and name "HN "))
2.900 0.400 0.400 peak 918 volume 0.997E+07 ppm1 2.409 ppm2 8.888
ASSI
(( segid " " and resid "50 " and name "HB2 "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
2.500 0.400 0.400 peak 922 volume 0.308E+08 ppm1 2.399 ppm2 6.765
ASSI
(( segid " " and resid "50 " and name "HB2 "))
(( segid " " and resid "50 " and name "HB1 "))
1.900 0.300 0.300 peak 926 volume 0.132E+09 ppm1 2.392 ppm2 2.569
ASSI
(( segid " " and resid "50 " and name "HB2 "))
(( segid " " and resid "50 " and name "HN "))
2.500 0.400 0.400 peak 928 volume 0.299E+08 ppm1 2.389 ppm2 8.691
ASSI
(( segid " " and resid "78 " and name "HB1 "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
2.300 0.300 0.300 peak 930 volume 0.563E+08 ppm1 2.386 ppm2 6.877
ASSI
(( segid " " and resid "86 " and name "HB1 "))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
2.400 0.400 0.400 peak 931 volume 0.426E+08 ppm1 2.386 ppm2 6.437
ASSI
(( segid " " and resid "95 " and name "HB1 "))
(( segid " " and resid "95 " and name "HN "))
2.400 0.400 0.400 peak 940 volume 0.337E+08 ppm1 2.345 ppm2 9.359
ASSI
(( segid " " and resid "80 " and name "HB1 "))
(( segid " " and resid "80 " and name "HN "))
2.600 0.400 0.400 peak 941 volume 0.223E+08 ppm1 2.345 ppm2 9.152
ASSI
(( segid " " and resid "56 " and name "HB "))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
3.000 0.500 0.500 peak 943 volume 0.110E+08 ppm1 2.331 ppm2 7.176
ASSI
(( segid " " and resid "85 " and name "HB1 "))
(( segid " " and resid "85 " and name "HA "))
2.900 0.400 0.400 peak 945 volume 0.118E+08 ppm1 2.311 ppm2 5.704
ASSI
(( segid " " and resid "54 " and name "HB "))
(( segid " " and resid "54 " and name "HN "))
2.700 0.400 0.400 peak 951 volume 0.175E+08 ppm1 2.287 ppm2 7.877
ASSI
(( segid " " and resid "2 " and name "HG1 ")
OR
( segid " " and resid "2 " and name "HG2 "))
(( segid " " and resid "2 " and name "HA "))
2.400 0.400 0.400 peak 962 volume 0.329E+08 ppm1 2.260 ppm2 5.637
ASSI
(( segid " " and resid "95 " and name "HB2 "))
(( segid " " and resid "92 " and name "HN "))
2.500 0.400 0.400 peak 970 volume 0.242E+08 ppm1 2.230 ppm2 7.477
ASSI
(( segid " " and resid "95 " and name "HB2 "))
(( segid " " and resid "95 " and name "HN "))
2.600 0.400 0.400 peak 973 volume 0.218E+08 ppm1 2.226 ppm2 9.355
ASSI
(( segid " " and resid "64 " and name "HB1 ")
OR
( segid " " and resid "64 " and name "HB2 "))
(( segid " " and resid "64 " and name "HN "))
2.800 0.400 0.400 peak 974 volume 0.130E+08 ppm1 2.226 ppm2 8.718
ASSI
(( segid " " and resid "64 " and name "HB1 ")
OR
( segid " " and resid "64 " and name "HB2 "))
(( segid " " and resid "65 " and name "HN "))
3.000 0.500 0.500 peak 976 volume 0.974E+07 ppm1 2.220 ppm2 8.969
ASSI
(( segid " " and resid "28 " and name "HB2 "))
(( segid " " and resid "28 " and name "HA "))
2.600 0.400 0.400 peak 978 volume 0.236E+08 ppm1 2.220 ppm2 5.467
ASSI
(( segid " " and resid "95 " and name "HB2 "))
(( segid " " and resid "95 " and name "HG1 ")
OR
( segid " " and resid "95 " and name "HG2 "))
2.400 0.400 0.400 peak 980 volume 0.279E+08 ppm1 2.220 ppm2 2.555
ASSI
(( segid " " and resid "28 " and name "HB2 "))
(( segid " " and resid "28 " and name "HB1 "))
1.900 0.300 0.300 peak 984 volume 0.125E+09 ppm1 2.209 ppm2 2.799
ASSI
(( segid " " and resid "96 " and name "HB1 ")
OR
( segid " " and resid "96 " and name "HB2 "))
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
2.400 0.400 0.400 peak 986 volume 0.270E+08 ppm1 2.196 ppm2 2.714
ASSI
(( segid " " and resid "2 " and name "HB1 "))
(( segid " " and resid "2 " and name "HN "))
2.700 0.400 0.400 peak 990 volume 0.186E+08 ppm1 2.145 ppm2 8.067
ASSI
(( segid " " and resid "85 " and name "HG1 ")
OR
( segid " " and resid "85 " and name "HG2 "))
(( segid " " and resid "85 " and name "HA "))
2.600 0.400 0.400 peak 992 volume 0.223E+08 ppm1 2.135 ppm2 5.708
ASSI
(( segid " " and resid "75 " and name "HB "))
(( segid " " and resid "75 " and name "HA "))
2.700 0.400 0.400 peak 993 volume 0.186E+08 ppm1 2.135 ppm2 5.562
ASSI
(( segid " " and resid "39 " and name "HB1 "))
(( segid " " and resid "39 " and name "HN "))
2.500 0.400 0.400 peak 994 volume 0.260E+08 ppm1 2.131 ppm2 10.115
ASSI
(( segid " " and resid "75 " and name "HB "))
(( segid " " and resid "75 " and name "HN "))
2.300 0.300 0.300 peak 995 volume 0.400E+08 ppm1 2.131 ppm2 7.935
ASSI
(( segid " " and resid "39 " and name "HB1 "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
2.900 0.400 0.400 peak 996 volume 0.144E+08 ppm1 2.128 ppm2 6.765
ASSI
(( segid " " and resid "101 " and name "HB1 ")
OR
( segid " " and resid "101 " and name "HB2 "))
(( segid " " and resid "101 " and name "HG1 "))
2.500 0.400 0.400 peak 1001 volume 0.208E+08 ppm1 2.125 ppm2 2.450
ASSI
(( segid " " and resid "101 " and name "HB1 ")
OR
( segid " " and resid "101 " and name "HB2 "))
(( segid " " and resid "101 " and name "HN "))
2.600 0.400 0.400 peak 1003 volume 0.234E+08 ppm1 2.121 ppm2 8.101
ASSI
(( segid " " and resid "94 " and name "HB1 "))
(( segid " " and resid "94 " and name "HN "))
2.400 0.400 0.400 peak 1014 volume 0.318E+08 ppm1 2.111 ppm2 8.291
ASSI
(( segid " " and resid "34 " and name "HB1 "))
(( segid " " and resid "34 " and name "HA "))
2.900 0.400 0.400 peak 1016 volume 0.107E+08 ppm1 2.111 ppm2 5.267
ASSI
(( segid " " and resid "94 " and name "HB1 "))
(( segid " " and resid "95 " and name "HN "))
2.700 0.400 0.400 peak 1018 volume 0.156E+08 ppm1 2.104 ppm2 9.355
ASSI
(( segid " " and resid "64 " and name "HG1 ")
OR
( segid " " and resid "64 " and name "HG2 "))
(( segid " " and resid "64 " and name "HB1 ")
OR
( segid " " and resid "64 " and name "HB2 "))
1.800 0.300 0.300 peak 1025 volume 0.174E+09 ppm1 2.084 ppm2 2.226
ASSI
(( segid " " and resid "101 " and name "HB1 ")
OR
( segid " " and resid "101 " and name "HB2 "))
(( segid " " and resid "101 " and name "HG2 "))
2.200 0.300 0.300 peak 1030 volume 0.424E+08 ppm1 2.081 ppm2 2.409
ASSI
(( segid " " and resid "103 " and name "HG11"))
(( segid " " and resid "99 " and name "HE3 "))
2.900 0.400 0.400 peak 1033 volume 0.137E+08 ppm1 2.070 ppm2 7.128
ASSI
(( segid " " and resid "88 " and name "HB1 "))
(( segid " " and resid "88 " and name "HA "))
2.700 0.400 0.400 peak 1039 volume 0.170E+08 ppm1 2.064 ppm2 5.575
ASSI
(( segid " " and resid "85 " and name "HB2 "))
(( segid " " and resid "11 " and name "HE3 "))
2.800 0.400 0.400 peak 1047 volume 0.150E+08 ppm1 2.040 ppm2 7.470
ASSI
(( segid " " and resid "80 " and name "HB2 "))
(( segid " " and resid "82 " and name "HN "))
2.800 0.400 0.400 peak 1049 volume 0.140E+08 ppm1 2.037 ppm2 7.755
ASSI
(( segid " " and resid "88 " and name "HB1 "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
2.800 0.400 0.400 peak 1050 volume 0.151E+08 ppm1 2.020 ppm2 6.877
ASSI
(( segid " " and resid "86 " and name "HB2 "))
(( segid " " and resid "86 " and name "HB1 "))
1.800 0.300 0.300 peak 1053 volume 0.156E+09 ppm1 2.016 ppm2 2.365
ASSI
(( segid " " and resid "86 " and name "HB2 "))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
2.400 0.400 0.400 peak 1055 volume 0.453E+08 ppm1 2.006 ppm2 6.437
ASSI
(( segid " " and resid "34 " and name "HB2 "))
(( segid " " and resid "34 " and name "HN "))
2.800 0.400 0.400 peak 1058 volume 0.126E+08 ppm1 2.003 ppm2 7.986
ASSI
(( segid " " and resid "2 " and name "HB2 "))
(( segid " " and resid "2 " and name "HA "))
2.500 0.400 0.400 peak 1059 volume 0.285E+08 ppm1 2.003 ppm2 5.637
ASSI
(( segid " " and resid "103 " and name "HB "))
(( segid " " and resid "103 " and name "HN "))
2.200 0.300 0.300 peak 1061 volume 0.660E+08 ppm1 1.999 ppm2 8.481
ASSI
(( segid " " and resid "103 " and name "HB "))
(( segid " " and resid "104 " and name "HN "))
2.500 0.400 0.400 peak 1063 volume 0.283E+08 ppm1 1.996 ppm2 8.230
ASSI
(( segid " " and resid "28 " and name "HG "))
(( segid " " and resid "28 " and name "HB1 "))
2.900 0.400 0.400 peak 1065 volume 0.113E+08 ppm1 1.996 ppm2 2.792
ASSI
(( segid " " and resid "79 " and name "HB1 "))
(( segid " " and resid "79 " and name "HN "))
2.700 0.400 0.400 peak 1069 volume 0.159E+08 ppm1 1.976 ppm2 9.532
ASSI
(( segid " " and resid "91 " and name "HB1 "))
(( segid " " and resid "91 " and name "HN "))
2.800 0.400 0.400 peak 1070 volume 0.147E+08 ppm1 1.965 ppm2 9.230
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "39 " and name "HN "))
2.500 0.400 0.400 peak 1076 volume 0.242E+08 ppm1 1.959 ppm2 10.118
ASSI
(( segid " " and resid "27 " and name "HB2 "))
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
2.400 0.400 0.400 peak 1080 volume 0.379E+08 ppm1 1.955 ppm2 5.565
ASSI
(( segid " " and resid "27 " and name "HB2 "))
(( segid " " and resid "27 " and name "HB1 "))
2.000 0.300 0.300 peak 1081 volume 0.990E+08 ppm1 1.955 ppm2 2.626
ASSI
(( segid " " and resid "27 " and name "HB2 "))
(( segid " " and resid "27 " and name "HN "))
2.500 0.400 0.400 peak 1084 volume 0.261E+08 ppm1 1.948 ppm2 9.098
ASSI
(( segid " " and resid "48 " and name "HB "))
(( segid " " and resid "48 " and name "HN "))
2.500 0.400 0.400 peak 1092 volume 0.301E+08 ppm1 1.935 ppm2 8.108
ASSI
(( segid " " and resid "80 " and name "HG "))
(( segid " " and resid "80 " and name "HN "))
2.500 0.400 0.400 peak 1095 volume 0.237E+08 ppm1 1.915 ppm2 9.145
ASSI
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
(( segid " " and resid "90 " and name "HN "))
2.400 0.400 0.400 peak 1102 volume 0.259E+08 ppm1 1.864 ppm2 8.891
ASSI
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
(( segid " " and resid "96 " and name "HN "))
2.500 0.400 0.400 peak 1103 volume 0.210E+08 ppm1 1.864 ppm2 8.101
ASSI
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
(( segid " " and resid "92 " and name "HN "))
2.500 0.400 0.400 peak 1104 volume 0.188E+08 ppm1 1.860 ppm2 7.484
ASSI
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
(( segid " " and resid "99 " and name "HD1 "))
3.100 0.500 0.500 peak 1105 volume 0.751E+07 ppm1 1.860 ppm2 7.243
ASSI
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
(( segid " " and resid "91 " and name "HN "))
2.200 0.300 0.300 peak 1109 volume 0.393E+08 ppm1 1.857 ppm2 9.227
ASSI
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
2.600 0.400 0.400 peak 1110 volume 0.182E+08 ppm1 1.857 ppm2 6.721
ASSI
(( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "39 " and name "HD1 "))
1.600 0.200 0.200 peak 1115 volume 0.375E+09 ppm1 1.853 ppm2 1.962
ASSI
(( segid " " and resid "59 " and name "HB1 "))
(( segid " " and resid "59 " and name "HN "))
2.700 0.400 0.400 peak 1120 volume 0.183E+08 ppm1 1.843 ppm2 7.904
ASSI
(( segid " " and resid "62 " and name "HB "))
(( segid " " and resid "62 " and name "HN "))
2.400 0.400 0.400 peak 1128 volume 0.320E+08 ppm1 1.823 ppm2 8.796
ASSI
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
(( segid " " and resid "42 " and name "HN "))
2.300 0.300 0.300 peak 1129 volume 0.475E+08 ppm1 1.816 ppm2 8.067
ASSI
(( segid " " and resid "79 " and name "HB2 "))
(( segid " " and resid "79 " and name "HA "))
2.700 0.400 0.400 peak 1147 volume 0.175E+08 ppm1 1.786 ppm2 5.277
ASSI
(( segid " " and resid "35 " and name "HG1 "))
(( segid " " and resid "35 " and name "HN "))
2.900 0.400 0.400 peak 1152 volume 0.116E+08 ppm1 1.776 ppm2 8.864
ASSI
(( segid " " and resid "77 " and name "HB2 "))
(( segid " " and resid "77 " and name "HN "))
2.800 0.400 0.400 peak 1160 volume 0.132E+08 ppm1 1.752 ppm2 9.705
ASSI
(( segid " " and resid "26 " and name "HB "))
(( segid " " and resid "26 " and name "HN "))
3.000 0.500 0.500 peak 1168 volume 0.844E+07 ppm1 1.742 ppm2 9.149
ASSI
(( segid " " and resid "59 " and name "HB2 "))
(( segid " " and resid "59 " and name "HN "))
2.500 0.400 0.400 peak 1174 volume 0.277E+08 ppm1 1.728 ppm2 7.904
ASSI
(( segid " " and resid "91 " and name "HG1 ")
OR
( segid " " and resid "91 " and name "HG2 "))
(( segid " " and resid "91 " and name "HB2 "))
2.100 0.300 0.300 peak 1186 volume 0.579E+08 ppm1 1.708 ppm2 1.911
ASSI
(( segid " " and resid "30 " and name "HB "))
(( segid " " and resid "30 " and name "HN "))
2.500 0.400 0.400 peak 1202 volume 0.284E+08 ppm1 1.684 ppm2 8.393
ASSI
(( segid " " and resid "78 " and name "HG "))
(( segid " " and resid "78 " and name "HB1 "))
2.400 0.400 0.400 peak 1206 volume 0.262E+08 ppm1 1.670 ppm2 2.382
ASSI
(( segid " " and resid "42 " and name "HD1 ")
OR
( segid " " and resid "42 " and name "HD2 "))
(( segid " " and resid "42 " and name "HE1 ")
OR
( segid " " and resid "42 " and name "HE2 "))
2.100 0.300 0.300 peak 1213 volume 0.635E+08 ppm1 1.657 ppm2 2.986
ASSI
(( segid " " and resid "7 " and name "HB1 ")
OR
( segid " " and resid "7 " and name "HB2 "))
(( segid " " and resid "7 " and name "HN "))
2.700 0.400 0.400 peak 1239 volume 0.169E+08 ppm1 1.596 ppm2 9.728
ASSI
(( segid " " and resid "5 " and name "HB1 "))
(( segid " " and resid "5 " and name "HN "))
2.700 0.400 0.400 peak 1260 volume 0.182E+08 ppm1 1.528 ppm2 9.301
ASSI
(( segid " " and resid "35 " and name "HB1 ")
OR
( segid " " and resid "35 " and name "HB2 "))
(( segid " " and resid "35 " and name "HN "))
2.900 0.400 0.400 peak 1261 volume 0.118E+08 ppm1 1.528 ppm2 8.871
ASSI
(( segid " " and resid "48 " and name "HG11"))
(( segid " " and resid "48 " and name "HB "))
2.900 0.400 0.400 peak 1264 volume 0.100E+08 ppm1 1.528 ppm2 1.945
ASSI
(( segid " " and resid "48 " and name "HG11"))
(( segid " " and resid "48 " and name "HN "))
2.800 0.400 0.400 peak 1272 volume 0.144E+08 ppm1 1.514 ppm2 8.104
ASSI
(( segid " " and resid "78 " and name "HB2 "))
(( segid " " and resid "78 " and name "HA "))
2.700 0.400 0.400 peak 1274 volume 0.181E+08 ppm1 1.498 ppm2 5.443
ASSI
(( segid " " and resid "78 " and name "HB2 "))
(( segid " " and resid "78 " and name "HB1 "))
1.900 0.300 0.300 peak 1277 volume 0.102E+09 ppm1 1.494 ppm2 2.375
ASSI
(( segid " " and resid "77 " and name "HG1 ")
OR
( segid " " and resid "77 " and name "HG2 "))
(( segid " " and resid "77 " and name "HB1 "))
2.400 0.400 0.400 peak 1285 volume 0.257E+08 ppm1 1.474 ppm2 1.863
ASSI
(( segid " " and resid "45 " and name "HB1 ")
OR
( segid " " and resid "45 " and name "HB3 ")
OR
( segid " " and resid "45 " and name "HB2 "))
(( segid " " and resid "46 " and name "HN "))
2.600 0.400 0.400 peak 1288 volume 0.160E+08 ppm1 1.464 ppm2 7.525
ASSI
(( segid " " and resid "45 " and name "HB1 ")
OR
( segid " " and resid "45 " and name "HB3 ")
OR
( segid " " and resid "45 " and name "HB2 "))
(( segid " " and resid "45 " and name "HN "))
2.100 0.300 0.300 peak 1291 volume 0.552E+08 ppm1 1.460 ppm2 7.647
ASSI
(( segid " " and resid "42 " and name "HG1 ")
OR
( segid " " and resid "42 " and name "HG2 "))
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
2.100 0.300 0.300 peak 1298 volume 0.572E+08 ppm1 1.447 ppm2 1.796
ASSI
(( segid " " and resid "59 " and name "HG2 "))
(( segid " " and resid "59 " and name "HG1 "))
1.700 0.300 0.300 peak 1302 volume 0.264E+09 ppm1 1.433 ppm2 1.535
ASSI
(( segid " " and resid "16 " and name "HG1 ")
OR
( segid " " and resid "16 " and name "HG2 "))
(( segid " " and resid "16 " and name "HE1 ")
OR
( segid " " and resid "16 " and name "HE2 "))
2.400 0.400 0.400 peak 1323 volume 0.287E+08 ppm1 1.396 ppm2 2.969
ASSI
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB3 ")
OR
( segid " " and resid "61 " and name "HB2 "))
(( segid " " and resid "61 " and name "HN "))
2.200 0.300 0.300 peak 1330 volume 0.432E+08 ppm1 1.389 ppm2 7.433
ASSI
(( segid " " and resid "72 " and name "HB1 ")
OR
( segid " " and resid "72 " and name "HB2 "))
(( segid " " and resid "72 " and name "HN "))
2.900 0.400 0.400 peak 1331 volume 0.110E+08 ppm1 1.389 ppm2 7.135
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB3 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "66 " and name "HN "))
2.300 0.300 0.300 peak 1346 volume 0.350E+08 ppm1 1.372 ppm2 8.718
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB3 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "76 " and name "HA "))
2.900 0.400 0.400 peak 1347 volume 0.869E+07 ppm1 1.372 ppm2 5.453
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB3 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "69 " and name "HB2 "))
2.300 0.300 0.300 peak 1349 volume 0.313E+08 ppm1 1.369 ppm2 2.908
ASSI
(( segid " " and resid "70 " and name "HG1 ")
OR
( segid " " and resid "70 " and name "HG2 "))
(( segid " " and resid "70 " and name "HD2 "))
2.000 0.300 0.300 peak 1351 volume 0.848E+08 ppm1 1.365 ppm2 1.599
ASSI
(( segid " " and resid "70 " and name "HG1 ")
OR
( segid " " and resid "70 " and name "HG2 "))
(( segid " " and resid "70 " and name "HN "))
2.800 0.400 0.400 peak 1353 volume 0.143E+08 ppm1 1.345 ppm2 8.165
ASSI
(( segid " " and resid "70 " and name "HG1 ")
OR
( segid " " and resid "70 " and name "HG2 "))
(( segid " " and resid "70 " and name "HE1 ")
OR
( segid " " and resid "70 " and name "HE2 "))
2.600 0.400 0.400 peak 1357 volume 0.159E+08 ppm1 1.338 ppm2 2.999
ASSI
(( segid " " and resid "87 " and name "HG "))
(( segid " " and resid "87 " and name "HN "))
2.900 0.400 0.400 peak 1362 volume 0.108E+08 ppm1 1.328 ppm2 8.830
ASSI
(( segid " " and resid "89 " and name "HB2 "))
(( segid " " and resid "23 " and name "HH2 "))
2.800 0.400 0.400 peak 1366 volume 0.154E+08 ppm1 1.291 ppm2 6.426
ASSI
(( segid " " and resid "80 " and name "HD11")
OR
( segid " " and resid "80 " and name "HD13")
OR
( segid " " and resid "80 " and name "HD12"))
(( segid " " and resid "80 " and name "HG "))
2.300 0.300 0.300 peak 1367 volume 0.272E+08 ppm1 1.291 ppm2 1.911
ASSI
(( segid " " and resid "80 " and name "HD11")
OR
( segid " " and resid "80 " and name "HD13")
OR
( segid " " and resid "80 " and name "HD12"))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
2.500 0.400 0.400 peak 1368 volume 0.237E+08 ppm1 1.287 ppm2 6.060
ASSI
(( segid " " and resid "80 " and name "HD11")
OR
( segid " " and resid "80 " and name "HD13")
OR
( segid " " and resid "80 " and name "HD12"))
(( segid " " and resid "80 " and name "HB1 "))
2.300 0.300 0.300 peak 1370 volume 0.311E+08 ppm1 1.287 ppm2 2.321
ASSI
(( segid " " and resid "102 " and name "HB1 ")
OR
( segid " " and resid "102 " and name "HB3 ")
OR
( segid " " and resid "102 " and name "HB2 "))
(( segid " " and resid "102 " and name "HN "))
2.100 0.300 0.300 peak 1373 volume 0.538E+08 ppm1 1.281 ppm2 7.935
ASSI
(( segid " " and resid "89 " and name "HB2 "))
(( segid " " and resid "23 " and name "HZ3 "))
2.600 0.400 0.400 peak 1374 volume 0.182E+08 ppm1 1.281 ppm2 6.609
ASSI
(( segid " " and resid "102 " and name "HB1 ")
OR
( segid " " and resid "102 " and name "HB3 ")
OR
( segid " " and resid "102 " and name "HB2 "))
(( segid " " and resid "103 " and name "HN "))
2.600 0.400 0.400 peak 1375 volume 0.182E+08 ppm1 1.277 ppm2 8.477
ASSI
(( segid " " and resid "89 " and name "HB2 "))
(( segid " " and resid "6 " and name "HB1 "))
2.800 0.400 0.400 peak 1376 volume 0.113E+08 ppm1 1.277 ppm2 2.897
ASSI
(( segid " " and resid "89 " and name "HB2 "))
(( segid " " and resid "89 " and name "HN "))
2.800 0.400 0.400 peak 1377 volume 0.149E+08 ppm1 1.274 ppm2 9.620
ASSI
(( segid " " and resid "5 " and name "HB2 "))
(( segid " " and resid "6 " and name "HN "))
2.600 0.400 0.400 peak 1378 volume 0.208E+08 ppm1 1.270 ppm2 7.630
ASSI
(( segid " " and resid "65 " and name "HG11")
OR
( segid " " and resid "65 " and name "HG13")
OR
( segid " " and resid "65 " and name "HG12"))
(( segid " " and resid "65 " and name "HB "))
2.200 0.300 0.300 peak 1390 volume 0.348E+08 ppm1 1.233 ppm2 2.094
ASSI
(( segid " " and resid "62 " and name "HG12"))
(( segid " " and resid "62 " and name "HG11"))
1.800 0.300 0.300 peak 1391 volume 0.148E+09 ppm1 1.233 ppm2 1.589
ASSI
(( segid " " and resid "56 " and name "HG11")
OR
( segid " " and resid "56 " and name "HG13")
OR
( segid " " and resid "56 " and name "HG12"))
(( segid " " and resid "56 " and name "HB "))
2.200 0.300 0.300 peak 1392 volume 0.390E+08 ppm1 1.230 ppm2 2.301
ASSI
(( segid " " and resid "56 " and name "HG11")
OR
( segid " " and resid "56 " and name "HG13")
OR
( segid " " and resid "56 " and name "HG12"))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
2.400 0.400 0.400 peak 1395 volume 0.327E+08 ppm1 1.216 ppm2 7.176
ASSI
(( segid " " and resid "65 " and name "HG11")
OR
( segid " " and resid "65 " and name "HG13")
OR
( segid " " and resid "65 " and name "HG12"))
(( segid " " and resid "65 " and name "HN "))
2.400 0.400 0.400 peak 1398 volume 0.301E+08 ppm1 1.213 ppm2 8.969
ASSI
(( segid " " and resid "54 " and name "HG11")
OR
( segid " " and resid "54 " and name "HG13")
OR
( segid " " and resid "54 " and name "HG12"))
(( segid " " and resid "54 " and name "HB "))
2.400 0.400 0.400 peak 1435 volume 0.232E+08 ppm1 1.169 ppm2 2.277
ASSI
(( segid " " and resid "100 " and name "HG11"))
(( segid " " and resid "100 " and name "HB "))
2.500 0.400 0.400 peak 1439 volume 0.193E+08 ppm1 1.169 ppm2 1.697
ASSI
(( segid " " and resid "100 " and name "HG11"))
(( segid " " and resid "100 " and name "HN "))
2.300 0.300 0.300 peak 1440 volume 0.405E+08 ppm1 1.165 ppm2 8.104
ASSI
(( segid " " and resid "65 " and name "HG21")
OR
( segid " " and resid "65 " and name "HG23")
OR
( segid " " and resid "65 " and name "HG22"))
(( segid " " and resid "65 " and name "HB "))
2.200 0.300 0.300 peak 1445 volume 0.387E+08 ppm1 1.155 ppm2 2.101
ASSI
(( segid " " and resid "65 " and name "HG21")
OR
( segid " " and resid "65 " and name "HG23")
OR
( segid " " and resid "65 " and name "HG22"))
(( segid " " and resid "66 " and name "HN "))
2.700 0.400 0.400 peak 1451 volume 0.145E+08 ppm1 1.148 ppm2 8.721
ASSI
(( segid " " and resid "48 " and name "HG12"))
(( segid " " and resid "48 " and name "HG11"))
1.900 0.300 0.300 peak 1467 volume 0.112E+09 ppm1 1.138 ppm2 1.504
ASSI
(( segid " " and resid "48 " and name "HG12"))
(( segid " " and resid "48 " and name "HB "))
2.900 0.400 0.400 peak 1472 volume 0.877E+07 ppm1 1.128 ppm2 1.941
ASSI
(( segid " " and resid "80 " and name "HD21")
OR
( segid " " and resid "80 " and name "HD23")
OR
( segid " " and resid "80 " and name "HD22"))
(( segid " " and resid "80 " and name "HB2 "))
2.700 0.400 0.400 peak 1479 volume 0.109E+08 ppm1 1.098 ppm2 2.036
ASSI
(( segid " " and resid "80 " and name "HD21")
OR
( segid " " and resid "80 " and name "HD23")
OR
( segid " " and resid "80 " and name "HD22"))
(( segid " " and resid "80 " and name "HD11")
OR
( segid " " and resid "80 " and name "HD13")
OR
( segid " " and resid "80 " and name "HD12"))
1.900 0.300 0.300 peak 1483 volume 0.673E+08 ppm1 1.091 ppm2 1.277
ASSI
(( segid " " and resid "78 " and name "HD11")
OR
( segid " " and resid "78 " and name "HD13")
OR
( segid " " and resid "78 " and name "HD12"))
(( segid " " and resid "78 " and name "HG "))
2.200 0.300 0.300 peak 1487 volume 0.378E+08 ppm1 1.081 ppm2 1.660
ASSI
(( segid " " and resid "78 " and name "HD11")
OR
( segid " " and resid "78 " and name "HD13")
OR
( segid " " and resid "78 " and name "HD12"))
(( segid " " and resid "78 " and name "HB2 "))
2.700 0.400 0.400 peak 1488 volume 0.105E+08 ppm1 1.077 ppm2 1.477
ASSI
(( segid " " and resid "78 " and name "HD11")
OR
( segid " " and resid "78 " and name "HD13")
OR
( segid " " and resid "78 " and name "HD12"))
(( segid " " and resid "79 " and name "HN "))
2.500 0.400 0.400 peak 1489 volume 0.204E+08 ppm1 1.074 ppm2 9.528
ASSI
(( segid " " and resid "41 " and name "HB1 ")
OR
( segid " " and resid "41 " and name "HB3 ")
OR
( segid " " and resid "41 " and name "HB2 "))
(( segid " " and resid "42 " and name "HN "))
2.600 0.400 0.400 peak 1498 volume 0.184E+08 ppm1 1.043 ppm2 8.067
ASSI
(( segid " " and resid "41 " and name "HB1 ")
OR
( segid " " and resid "41 " and name "HB3 ")
OR
( segid " " and resid "41 " and name "HB2 "))
(( segid " " and resid "41 " and name "HA "))
2.000 0.300 0.300 peak 1501 volume 0.716E+08 ppm1 1.043 ppm2 2.955
ASSI
(( segid " " and resid "48 " and name "HG21")
OR
( segid " " and resid "48 " and name "HG23")
OR
( segid " " and resid "48 " and name "HG22"))
(( segid " " and resid "48 " and name "HB "))
2.200 0.300 0.300 peak 1509 volume 0.393E+08 ppm1 1.033 ppm2 1.921
ASSI
(( segid " " and resid "67 " and name "HD11")
OR
( segid " " and resid "67 " and name "HD13")
OR
( segid " " and resid "67 " and name "HD12"))
(( segid " " and resid "67 " and name "HB1 "))
2.500 0.400 0.400 peak 1514 volume 0.166E+08 ppm1 1.013 ppm2 1.775
ASSI
(( segid " " and resid "67 " and name "HD11")
OR
( segid " " and resid "67 " and name "HD13")
OR
( segid " " and resid "67 " and name "HD12"))
(( segid " " and resid "67 " and name "HG "))
1.900 0.300 0.300 peak 1515 volume 0.929E+08 ppm1 1.013 ppm2 1.697
ASSI
(( segid " " and resid "78 " and name "HD21")
OR
( segid " " and resid "78 " and name "HD23")
OR
( segid " " and resid "78 " and name "HD22"))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
2.500 0.400 0.400 peak 1520 volume 0.247E+08 ppm1 1.006 ppm2 6.542
ASSI
(( segid " " and resid "78 " and name "HD21")
OR
( segid " " and resid "78 " and name "HD23")
OR
( segid " " and resid "78 " and name "HD22"))
(( segid " " and resid "78 " and name "HB1 "))
2.200 0.300 0.300 peak 1525 volume 0.328E+08 ppm1 1.003 ppm2 2.375
ASSI
(( segid " " and resid "78 " and name "HD21")
OR
( segid " " and resid "78 " and name "HD23")
OR
( segid " " and resid "78 " and name "HD22"))
(( segid " " and resid "78 " and name "HB2 "))
2.500 0.400 0.400 peak 1528 volume 0.183E+08 ppm1 0.996 ppm2 1.497
ASSI
(( segid " " and resid "67 " and name "HD21")
OR
( segid " " and resid "67 " and name "HD23")
OR
( segid " " and resid "67 " and name "HD22"))
(( segid " " and resid "67 " and name "HA "))
2.300 0.300 0.300 peak 1537 volume 0.332E+08 ppm1 0.969 ppm2 4.199
ASSI
(( segid " " and resid "67 " and name "HD21")
OR
( segid " " and resid "67 " and name "HD23")
OR
( segid " " and resid "67 " and name "HD22"))
(( segid " " and resid "67 " and name "HG "))
1.900 0.300 0.300 peak 1538 volume 0.887E+08 ppm1 0.962 ppm2 1.704
ASSI
(( segid " " and resid "48 " and name "HD11")
OR
( segid " " and resid "48 " and name "HD13")
OR
( segid " " and resid "48 " and name "HD12"))
(( segid " " and resid "48 " and name "HG11"))
2.200 0.300 0.300 peak 1542 volume 0.377E+08 ppm1 0.952 ppm2 1.494
ASSI
(( segid " " and resid "48 " and name "HD11")
OR
( segid " " and resid "48 " and name "HD13")
OR
( segid " " and resid "48 " and name "HD12"))
(( segid " " and resid "46 " and name "HB2 "))
2.400 0.400 0.400 peak 1544 volume 0.223E+08 ppm1 0.948 ppm2 3.853
ASSI
(( segid " " and resid "103 " and name "HG21")
OR
( segid " " and resid "103 " and name "HG23")
OR
( segid " " and resid "103 " and name "HG22"))
(( segid " " and resid "103 " and name "HB "))
2.100 0.300 0.300 peak 1549 volume 0.536E+08 ppm1 0.935 ppm2 1.992
ASSI
(( segid " " and resid "29 " and name "HG11")
OR
( segid " " and resid "29 " and name "HG13")
OR
( segid " " and resid "29 " and name "HG12"))
(( segid " " and resid "38 " and name "HD1 ")
OR
( segid " " and resid "38 " and name "HD2 "))
2.500 0.400 0.400 peak 1551 volume 0.261E+08 ppm1 0.931 ppm2 7.237
ASSI
(( segid " " and resid "29 " and name "HG11")
OR
( segid " " and resid "29 " and name "HG13")
OR
( segid " " and resid "29 " and name "HG12"))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
2.300 0.300 0.300 peak 1552 volume 0.385E+08 ppm1 0.931 ppm2 6.392
ASSI
(( segid " " and resid "29 " and name "HG11")
OR
( segid " " and resid "29 " and name "HG13")
OR
( segid " " and resid "29 " and name "HG12"))
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
2.600 0.400 0.400 peak 1553 volume 0.217E+08 ppm1 0.931 ppm2 5.569
ASSI
(( segid " " and resid "62 " and name "HG21")
OR
( segid " " and resid "62 " and name "HG23")
OR
( segid " " and resid "62 " and name "HG22"))
(( segid " " and resid "62 " and name "HB "))
2.400 0.400 0.400 peak 1556 volume 0.232E+08 ppm1 0.928 ppm2 1.816
ASSI
(( segid " " and resid "103 " and name "HG21")
OR
( segid " " and resid "103 " and name "HG23")
OR
( segid " " and resid "103 " and name "HG22"))
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB3 ")
OR
( segid " " and resid "61 " and name "HB2 "))
2.000 0.300 0.300 peak 1568 volume 0.466E+08 ppm1 0.904 ppm2 1.385
ASSI
(( segid " " and resid "5 " and name "HG "))
(( segid " " and resid "99 " and name "HE1 "))
2.900 0.400 0.400 peak 1569 volume 0.125E+08 ppm1 0.901 ppm2 10.596
ASSI
(( segid " " and resid "103 " and name "HD11")
OR
( segid " " and resid "103 " and name "HD13")
OR
( segid " " and resid "103 " and name "HD12"))
(( segid " " and resid "99 " and name "HE3 "))
2.400 0.400 0.400 peak 1570 volume 0.329E+08 ppm1 0.901 ppm2 7.131
ASSI
(( segid " " and resid "103 " and name "HD11")
OR
( segid " " and resid "103 " and name "HD13")
OR
( segid " " and resid "103 " and name "HD12"))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
2.300 0.300 0.300 peak 1573 volume 0.426E+08 ppm1 0.898 ppm2 6.721
ASSI
(( segid " " and resid "103 " and name "HD11")
OR
( segid " " and resid "103 " and name "HD13")
OR
( segid " " and resid "103 " and name "HD12"))
(( segid " " and resid "100 " and name "HA "))
2.400 0.400 0.400 peak 1575 volume 0.253E+08 ppm1 0.894 ppm2 3.511
ASSI
(( segid " " and resid "103 " and name "HD11")
OR
( segid " " and resid "103 " and name "HD13")
OR
( segid " " and resid "103 " and name "HD12"))
(( segid " " and resid "76 " and name "HZ "))
2.900 0.400 0.400 peak 1576 volume 0.101E+08 ppm1 0.887 ppm2 6.223
ASSI
(( segid " " and resid "62 " and name "HD11")
OR
( segid " " and resid "62 " and name "HD13")
OR
( segid " " and resid "62 " and name "HD12"))
(( segid " " and resid "62 " and name "HG11"))
2.500 0.400 0.400 peak 1582 volume 0.194E+08 ppm1 0.874 ppm2 1.613
ASSI
(( segid " " and resid "44 " and name "HB1 ")
OR
( segid " " and resid "44 " and name "HB3 ")
OR
( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "45 " and name "HN "))
2.500 0.400 0.400 peak 1585 volume 0.188E+08 ppm1 0.867 ppm2 7.647
ASSI
(( segid " " and resid "44 " and name "HB1 ")
OR
( segid " " and resid "44 " and name "HB3 ")
OR
( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "44 " and name "HN "))
2.200 0.300 0.300 peak 1586 volume 0.448E+08 ppm1 0.867 ppm2 7.599
ASSI
(( segid " " and resid "29 " and name "HG21")
OR
( segid " " and resid "29 " and name "HG23")
OR
( segid " " and resid "29 " and name "HG22"))
(( segid " " and resid "30 " and name "HN "))
2.600 0.400 0.400 peak 1590 volume 0.171E+08 ppm1 0.864 ppm2 8.393
ASSI
(( segid " " and resid "44 " and name "HB1 ")
OR
( segid " " and resid "44 " and name "HB3 ")
OR
( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
2.400 0.400 0.400 peak 1591 volume 0.342E+08 ppm1 0.864 ppm2 6.396
ASSI
(( segid " " and resid "44 " and name "HB1 ")
OR
( segid " " and resid "44 " and name "HB3 ")
OR
( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
2.300 0.300 0.300 peak 1592 volume 0.457E+08 ppm1 0.864 ppm2 5.565
ASSI
(( segid " " and resid "44 " and name "HB1 ")
OR
( segid " " and resid "44 " and name "HB3 ")
OR
( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "41 " and name "HA "))
2.300 0.300 0.300 peak 1593 volume 0.332E+08 ppm1 0.864 ppm2 2.958
ASSI
(( segid " " and resid "44 " and name "HB1 ")
OR
( segid " " and resid "44 " and name "HB3 ")
OR
( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "44 " and name "HA "))
2.000 0.300 0.300 peak 1594 volume 0.698E+08 ppm1 0.864 ppm2 2.775
ASSI
(( segid " " and resid "44 " and name "HB1 ")
OR
( segid " " and resid "44 " and name "HB3 ")
OR
( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "38 " and name "HB1 "))
2.500 0.400 0.400 peak 1596 volume 0.163E+08 ppm1 0.857 ppm2 3.236
ASSI
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
(( segid " " and resid "23 " and name "HH2 "))
2.400 0.400 0.400 peak 1598 volume 0.300E+08 ppm1 0.833 ppm2 6.420
ASSI
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
(( segid " " and resid "76 " and name "HN "))
2.400 0.400 0.400 peak 1599 volume 0.248E+08 ppm1 0.830 ppm2 9.596
ASSI
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
2.600 0.400 0.400 peak 1600 volume 0.185E+08 ppm1 0.826 ppm2 7.274
ASSI
(( segid " " and resid "30 " and name "HD11")
OR
( segid " " and resid "30 " and name "HD13")
OR
( segid " " and resid "30 " and name "HD12"))
(( segid " " and resid "99 " and name "HE3 "))
2.500 0.400 0.400 peak 1601 volume 0.271E+08 ppm1 0.826 ppm2 7.128
ASSI
(( segid " " and resid "30 " and name "HD11")
OR
( segid " " and resid "30 " and name "HD13")
OR
( segid " " and resid "30 " and name "HD12"))
(( segid " " and resid "99 " and name "HZ3 "))
2.200 0.300 0.300 peak 1602 volume 0.374E+08 ppm1 0.826 ppm2 6.467
ASSI
(( segid " " and resid "58 " and name "HD11")
OR
( segid " " and resid "58 " and name "HD13")
OR
( segid " " and resid "58 " and name "HD12"))
(( segid " " and resid "103 " and name "HA "))
2.100 0.300 0.300 peak 1603 volume 0.531E+08 ppm1 0.826 ppm2 3.579
ASSI
(( segid " " and resid "100 " and name "HG21")
OR
( segid " " and resid "100 " and name "HG23")
OR
( segid " " and resid "100 " and name "HG22"))
(( segid " " and resid "100 " and name "HA "))
2.300 0.300 0.300 peak 1607 volume 0.378E+08 ppm1 0.820 ppm2 3.511
ASSI
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
(( segid " " and resid "75 " and name "HB "))
2.300 0.300 0.300 peak 1609 volume 0.304E+08 ppm1 0.820 ppm2 2.141
ASSI
(( segid " " and resid "30 " and name "HD11")
OR
( segid " " and resid "30 " and name "HD13")
OR
( segid " " and resid "30 " and name "HD12"))
(( segid " " and resid "102 " and name "HB1 ")
OR
( segid " " and resid "102 " and name "HB3 ")
OR
( segid " " and resid "102 " and name "HB2 "))
2.200 0.300 0.300 peak 1613 volume 0.277E+08 ppm1 0.820 ppm2 1.277
ASSI
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
(( segid " " and resid "75 " and name "HN "))
2.400 0.400 0.400 peak 1628 volume 0.251E+08 ppm1 0.789 ppm2 7.935
ASSI
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
(( segid " " and resid "75 " and name "HA "))
2.300 0.300 0.300 peak 1634 volume 0.357E+08 ppm1 0.779 ppm2 5.552
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "76 " and name "HB1 "))
2.600 0.400 0.400 peak 1635 volume 0.152E+08 ppm1 0.779 ppm2 3.108
ASSI
(( segid " " and resid "30 " and name "HG21")
OR
( segid " " and resid "30 " and name "HG23")
OR
( segid " " and resid "30 " and name "HG22"))
(( segid " " and resid "31 " and name "HN "))
2.500 0.400 0.400 peak 1636 volume 0.205E+08 ppm1 0.775 ppm2 8.721
ASSI
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
(( segid " " and resid "23 " and name "HH2 "))
2.700 0.400 0.400 peak 1637 volume 0.179E+08 ppm1 0.775 ppm2 6.416
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "76 " and name "HB2 "))
2.500 0.400 0.400 peak 1640 volume 0.157E+08 ppm1 0.772 ppm2 2.999
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "65 " and name "HG11")
OR
( segid " " and resid "65 " and name "HG13")
OR
( segid " " and resid "65 " and name "HG12"))
2.100 0.300 0.300 peak 1652 volume 0.341E+08 ppm1 0.765 ppm2 1.209
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "65 " and name "HG21")
OR
( segid " " and resid "65 " and name "HG23")
OR
( segid " " and resid "65 " and name "HG22"))
2.700 0.400 0.400 peak 1653 volume 0.811E+07 ppm1 0.765 ppm2 1.158
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "97 " and name "HA "))
2.800 0.400 0.400 peak 1655 volume 0.964E+07 ppm1 0.762 ppm2 4.348
ASSI
(( segid " " and resid "88 " and name "HB2 "))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
2.800 0.400 0.400 peak 1660 volume 0.150E+08 ppm1 0.735 ppm2 6.718
ASSI
(( segid " " and resid "73 " and name "HB1 ")
OR
( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "73 " and name "HG1 "))
2.500 0.400 0.400 peak 1664 volume 0.209E+08 ppm1 0.725 ppm2 1.589
ASSI
(( segid " " and resid "88 " and name "HB2 "))
(( segid " " and resid "88 " and name "HB1 "))
1.800 0.300 0.300 peak 1667 volume 0.140E+09 ppm1 0.721 ppm2 2.060
ASSI
(( segid " " and resid "88 " and name "HB2 "))
(( segid " " and resid "88 " and name "HN "))
2.600 0.400 0.400 peak 1670 volume 0.189E+08 ppm1 0.718 ppm2 8.911
ASSI
(( segid " " and resid "8 " and name "HD1 "))
(( segid " " and resid "69 " and name "HE1 ")
OR
( segid " " and resid "69 " and name "HE2 "))
3.100 0.500 0.500 peak 1672 volume 0.842E+07 ppm1 0.714 ppm2 6.799
ASSI
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
(( segid " " and resid "77 " and name "HA "))
2.600 0.400 0.400 peak 1690 volume 0.165E+08 ppm1 0.653 ppm2 5.348
ASSI
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
(( segid " " and resid "87 " and name "HG "))
2.100 0.300 0.300 peak 1694 volume 0.504E+08 ppm1 0.650 ppm2 1.355
ASSI
(( segid " " and resid "100 " and name "HG12"))
(( segid " " and resid "100 " and name "HB "))
2.800 0.400 0.400 peak 1699 volume 0.109E+08 ppm1 0.647 ppm2 1.707
ASSI
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
(( segid " " and resid "87 " and name "HB2 "))
2.500 0.400 0.400 peak 1700 volume 0.169E+08 ppm1 0.647 ppm2 1.016
ASSI
(( segid " " and resid "100 " and name "HG12"))
(( segid " " and resid "100 " and name "HA "))
2.400 0.400 0.400 peak 1709 volume 0.320E+08 ppm1 0.623 ppm2 3.511
ASSI
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
(( segid " " and resid "5 " and name "HG "))
2.500 0.400 0.400 peak 1716 volume 0.170E+08 ppm1 0.586 ppm2 0.938
ASSI
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
2.600 0.400 0.400 peak 1717 volume 0.221E+08 ppm1 0.582 ppm2 6.718
ASSI
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
(( segid " " and resid "76 " and name "HZ "))
2.900 0.400 0.400 peak 1718 volume 0.950E+07 ppm1 0.582 ppm2 6.220
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
2.900 0.400 0.400 peak 1719 volume 0.995E+07 ppm1 0.579 ppm2 6.535
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "26 " and name "HB "))
2.200 0.300 0.300 peak 1723 volume 0.381E+08 ppm1 0.569 ppm2 1.738
ASSI
(( segid " " and resid "8 " and name "HD2 "))
(( segid " " and resid "8 " and name "HD1 "))
1.800 0.300 0.300 peak 1729 volume 0.142E+09 ppm1 0.548 ppm2 0.758
ASSI
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
(( segid " " and resid "18 " and name "HN "))
2.400 0.400 0.400 peak 1736 volume 0.256E+08 ppm1 0.508 ppm2 7.189
ASSI
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
(( segid " " and resid "18 " and name "HA "))
2.200 0.300 0.300 peak 1738 volume 0.399E+08 ppm1 0.504 ppm2 3.942
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
2.000 0.300 0.300 peak 1745 volume 0.461E+08 ppm1 0.460 ppm2 0.568
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "37 " and name "HD1 ")
OR
( segid " " and resid "37 " and name "HD2 "))
2.700 0.400 0.400 peak 1746 volume 0.159E+08 ppm1 0.453 ppm2 7.250
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "50 " and name "HE1 ")
OR
( segid " " and resid "50 " and name "HE2 "))
3.000 0.500 0.500 peak 1747 volume 0.811E+07 ppm1 0.453 ppm2 6.528
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "26 " and name "HB "))
2.200 0.300 0.300 peak 1748 volume 0.423E+08 ppm1 0.453 ppm2 1.741
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "23 " and name "HZ2 "))
2.600 0.400 0.400 peak 1758 volume 0.136E+08 ppm1 0.392 ppm2 7.016
ASSI
(( segid " " and resid "8 " and name "HG1 "))
(( segid " " and resid "8 " and name "HD1 "))
2.700 0.400 0.400 peak 1782 volume 0.141E+08 ppm1 0.304 ppm2 0.735
ASSI
(( segid " " and resid "8 " and name "HG1 "))
(( segid " " and resid "9 " and name "HN "))
3.000 0.500 0.500 peak 1789 volume 0.925E+07 ppm1 0.284 ppm2 9.389
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "5 " and name "HG "))
2.100 0.300 0.300 peak 2003 volume 0.486E+08 ppm1 -0.835 ppm2 0.935
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "76 " and name "HZ "))
2.500 0.400 0.400 peak 2007 volume 0.266E+08 ppm1 -0.835 ppm2 6.220
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "5 " and name "HB1 "))
2.400 0.400 0.400 peak 2010 volume 0.251E+08 ppm1 -0.835 ppm2 1.528
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "5 " and name "HB2 "))
2.500 0.400 0.400 peak 2012 volume 0.179E+08 ppm1 -0.835 ppm2 1.253
ASSI
(( segid " " and resid "8 " and name "HB2 "))
(( segid " " and resid "8 " and name "HA "))
2.600 0.400 0.400 peak 2014 volume 0.207E+08 ppm1 -0.943 ppm2 3.928
ASSI
(( segid " " and resid "8 " and name "HB2 "))
(( segid " " and resid "8 " and name "HN "))
2.900 0.400 0.400 peak 2036 volume 0.116E+08 ppm1 -0.936 ppm2 8.864
ASSI
(( segid " " and resid "4 " and name "HA "))
(( segid " " and resid "27 " and name "HA "))
2.400 0.400 0.400 peak 2155 volume 0.399E+08 ppm1 5.193 ppm2 4.094
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "50 " and name "HB2 "))
2.500 0.400 0.400 peak 2179 volume 0.254E+08 ppm1 4.966 ppm2 2.392
ASSI
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
(( segid " " and resid "50 " and name "HE1 ")
OR
( segid " " and resid "50 " and name "HE2 "))
2.200 0.600 0.600 peak 42 volume 0.205E+09 ppm1 6.768 ppm2 6.522
ASSI
(( segid " " and resid "11 " and name "HA "))
(( segid " " and resid "12 " and name "HN "))
2.100 0.600 0.600 peak 73 volume 0.152E+09 ppm1 4.746 ppm2 8.682
ASSI
(( segid " " and resid "11 " and name "HH2 "))
(( segid " " and resid "11 " and name "HZ3 "))
2.100 0.600 0.600 peak 82 volume 0.148E+09 ppm1 7.174 ppm2 6.870
ASSI
(( segid " " and resid "11 " and name "HZ2 "))
(( segid " " and resid "11 " and name "HH2 "))
2.200 0.600 0.600 peak 83 volume 0.109E+09 ppm1 7.470 ppm2 7.180
ASSI
(( segid " " and resid "106 " and name "HB1 ")
OR
( segid " " and resid "106 " and name "HB3 ")
OR
( segid " " and resid "106 " and name "HB2 "))
(( segid " " and resid "106 " and name "HN "))
2.200 0.600 0.600 peak 93 volume 0.109E+09 ppm1 1.394 ppm2 7.254
ASSI
(( segid " " and resid "11 " and name "HE3 "))
(( segid " " and resid "11 " and name "HZ3 "))
2.200 0.600 0.600 peak 97 volume 0.961E+08 ppm1 7.445 ppm2 6.870
ASSI
(( segid " " and resid "65 " and name "HB "))
(( segid " " and resid "65 " and name "HN "))
2.200 0.600 0.600 peak 111 volume 0.876E+08 ppm1 2.097 ppm2 8.963
ASSI
(( segid " " and resid "40 " and name "HA "))
(( segid " " and resid "40 " and name "HN "))
2.400 0.700 0.700 peak 127 volume 0.760E+08 ppm1 4.217 ppm2 7.447
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "43 " and name "HN "))
2.400 0.700 0.700 peak 164 volume 0.601E+08 ppm1 4.204 ppm2 8.674
ASSI
(( segid " " and resid "84 " and name "HB1 "))
(( segid " " and resid "84 " and name "HN "))
2.400 0.700 0.700 peak 172 volume 0.629E+08 ppm1 3.107 ppm2 8.112
ASSI
(( segid " " and resid "106 " and name "HA "))
(( segid " " and resid "106 " and name "HN "))
2.500 0.800 0.800 peak 197 volume 0.475E+08 ppm1 3.970 ppm2 7.254
ASSI
(( segid " " and resid "51 " and name "HA "))
(( segid " " and resid "51 " and name "HN "))
2.400 0.700 0.700 peak 198 volume 0.632E+08 ppm1 4.081 ppm2 8.948
ASSI
(( segid " " and resid "11 " and name "HZ2 "))
(( segid " " and resid "11 " and name "HE1 "))
2.500 0.800 0.800 peak 202 volume 0.520E+08 ppm1 7.458 ppm2 10.131
ASSI
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
2.500 0.800 0.800 peak 219 volume 0.509E+08 ppm1 0.778 ppm2 7.277
ASSI
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "72 " and name "HN "))
2.500 0.800 0.800 peak 222 volume 0.477E+08 ppm1 3.945 ppm2 7.129
ASSI
(( segid " " and resid "23 " and name "HB1 "))
(( segid " " and resid "23 " and name "HE3 "))
2.500 0.800 0.800 peak 228 volume 0.488E+08 ppm1 3.095 ppm2 6.951
ASSI
(( segid " " and resid "58 " and name "HN "))
(( segid " " and resid "59 " and name "HN "))
2.600 0.800 0.800 peak 229 volume 0.540E+08 ppm1 8.776 ppm2 7.905
ASSI
(( segid " " and resid "78 " and name "HD11")
OR
( segid " " and resid "78 " and name "HD13")
OR
( segid " " and resid "78 " and name "HD12"))
(( segid " " and resid "78 " and name "HA "))
2.300 0.700 0.700 peak 230 volume 0.604E+08 ppm1 1.062 ppm2 5.442
ASSI
(( segid " " and resid "56 " and name "HG21")
OR
( segid " " and resid "56 " and name "HG23")
OR
( segid " " and resid "56 " and name "HG22"))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
2.600 0.800 0.800 peak 240 volume 0.477E+08 ppm1 1.000 ppm2 7.173
ASSI
(( segid " " and resid "45 " and name "HN "))
(( segid " " and resid "46 " and name "HN "))
2.800 1.000 1.000 peak 242 volume 0.380E+08 ppm1 7.643 ppm2 7.521
ASSI
(( segid " " and resid "63 " and name "HG "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
2.800 1.000 1.000 peak 253 volume 0.395E+08 ppm1 1.900 ppm2 7.032
ASSI
(( segid " " and resid "69 " and name "HN "))
(( segid " " and resid "68 " and name "HN "))
2.800 1.000 1.000 peak 268 volume 0.381E+08 ppm1 7.778 ppm2 8.815
ASSI
(( segid " " and resid "41 " and name "HN "))
(( segid " " and resid "42 " and name "HN "))
2.700 0.900 0.900 peak 278 volume 0.400E+08 ppm1 7.852 ppm2 8.061
ASSI
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
2.800 1.000 1.000 peak 293 volume 0.315E+08 ppm1 4.377 ppm2 6.441
ASSI
(( segid " " and resid "98 " and name "HG1 "))
(( segid " " and resid "98 " and name "HN "))
2.600 0.800 0.800 peak 301 volume 0.509E+08 ppm1 1.025 ppm2 8.282
ASSI
(( segid " " and resid "62 " and name "HG11"))
(( segid " " and resid "62 " and name "HN "))
2.400 0.700 0.700 peak 303 volume 0.580E+08 ppm1 1.579 ppm2 8.778
ASSI
(( segid " " and resid "27 " and name "HA "))
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
2.700 0.900 0.900 peak 319 volume 0.414E+08 ppm1 4.118 ppm2 7.424
ASSI
(( segid " " and resid "76 " and name "HB1 "))
(( segid " " and resid "77 " and name "HN "))
2.500 0.800 0.800 peak 321 volume 0.419E+08 ppm1 3.107 ppm2 9.710
ASSI
(( segid " " and resid "88 " and name "HA "))
(( segid " " and resid "23 " and name "HZ3 "))
2.500 0.800 0.800 peak 334 volume 0.353E+08 ppm1 5.572 ppm2 6.604
ASSI
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
(( segid " " and resid "4 " and name "HE1 ")
OR
( segid " " and resid "4 " and name "HE2 "))
2.900 1.100 1.100 peak 344 volume 0.345E+08 ppm1 6.386 ppm2 7.706
ASSI
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
(( segid " " and resid "99 " and name "HE1 "))
2.800 1.000 1.000 peak 345 volume 0.273E+08 ppm1 0.569 ppm2 10.597
ASSI
(( segid " " and resid "84 " and name "HB2 "))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
2.700 0.900 0.900 peak 348 volume 0.320E+08 ppm1 2.393 ppm2 6.064
ASSI
(( segid " " and resid "103 " and name "HA "))
(( segid " " and resid "103 " and name "HN "))
2.700 0.900 0.900 peak 351 volume 0.305E+08 ppm1 3.576 ppm2 8.482
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "23 " and name "HE3 "))
2.800 1.000 1.000 peak 371 volume 0.285E+08 ppm1 4.636 ppm2 6.951
ASSI
(( segid " " and resid "63 " and name "HG "))
(( segid " " and resid "63 " and name "HA "))
2.700 0.900 0.900 peak 375 volume 0.339E+08 ppm1 1.900 ppm2 5.871
ASSI
(( segid " " and resid "14 " and name "HB1 ")
OR
( segid " " and resid "14 " and name "HB2 "))
(( segid " " and resid "14 " and name "HD2 "))
2.900 1.100 1.100 peak 376 volume 0.198E+08 ppm1 3.120 ppm2 7.114
ASSI
(( segid " " and resid "51 " and name "HA "))
(( segid " " and resid "51 " and name "HD2 "))
3.000 1.100 1.100 peak 382 volume 0.220E+08 ppm1 4.081 ppm2 6.167
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "26 " and name "HN "))
2.700 0.900 0.900 peak 387 volume 0.303E+08 ppm1 0.569 ppm2 9.140
ASSI
(( segid " " and resid "40 " and name "HB1 ")
OR
( segid " " and resid "40 " and name "HB2 "))
(( segid " " and resid "4 " and name "HZ "))
2.800 1.000 1.000 peak 390 volume 0.276E+08 ppm1 3.107 ppm2 7.543
ASSI
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "14 " and name "HN "))
2.800 1.000 1.000 peak 393 volume 0.269E+08 ppm1 4.241 ppm2 8.453
ASSI
(( segid " " and resid "28 " and name "HN "))
(( segid " " and resid "3 " and name "HN "))
3.000 1.100 1.100 peak 400 volume 0.249E+08 ppm1 8.493 ppm2 8.046
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "24 " and name "HD2 "))
3.000 1.100 1.100 peak 411 volume 0.197E+08 ppm1 0.445 ppm2 6.848
ASSI
(( segid " " and resid "5 " and name "HG "))
(( segid " " and resid "99 " and name "HZ2 "))
2.600 0.800 0.800 peak 414 volume 0.236E+08 ppm1 0.901 ppm2 6.781
ASSI
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
(( segid " " and resid "86 " and name "HN "))
3.000 1.100 1.100 peak 418 volume 0.251E+08 ppm1 6.435 ppm2 9.266
ASSI
(( segid " " and resid "92 " and name "HB1 ")
OR
( segid " " and resid "92 " and name "HB2 "))
(( segid " " and resid "93 " and name "HN "))
3.000 1.100 1.100 peak 423 volume 0.161E+08 ppm1 2.614 ppm2 8.231
ASSI
(( segid " " and resid "95 " and name "HG1 ")
OR
( segid " " and resid "95 " and name "HG2 "))
(( segid " " and resid "99 " and name "HE1 "))
2.900 1.100 1.100 peak 431 volume 0.219E+08 ppm1 2.540 ppm2 10.597
ASSI
(( segid " " and resid "86 " and name "HA "))
(( segid " " and resid "10 " and name "HN "))
2.800 1.000 1.000 peak 445 volume 0.261E+08 ppm1 5.055 ppm2 8.061
ASSI
(( segid " " and resid "4 " and name "HB1 "))
(( segid " " and resid "4 " and name "HN "))
2.800 1.000 1.000 peak 450 volume 0.208E+08 ppm1 3.268 ppm2 8.859
ASSI
(( segid " " and resid "60 " and name "HB1 ")
OR
( segid " " and resid "60 " and name "HB2 "))
(( segid " " and resid "60 " and name "HN "))
2.800 1.000 1.000 peak 454 volume 0.242E+08 ppm1 2.245 ppm2 9.421
ASSI
(( segid " " and resid "79 " and name "HB2 "))
(( segid " " and resid "79 " and name "HN "))
2.700 0.900 0.900 peak 456 volume 0.298E+08 ppm1 1.776 ppm2 9.525
ASSI
(( segid " " and resid "79 " and name "HN "))
(( segid " " and resid "62 " and name "HN "))
3.000 1.100 1.100 peak 459 volume 0.225E+08 ppm1 9.516 ppm2 8.793
ASSI
(( segid " " and resid "9 " and name "HB2 "))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
2.900 1.100 1.100 peak 467 volume 0.200E+08 ppm1 2.516 ppm2 6.064
ASSI
(( segid " " and resid "80 " and name "HB1 "))
(( segid " " and resid "82 " and name "HN "))
2.800 1.000 1.000 peak 470 volume 0.208E+08 ppm1 2.331 ppm2 7.750
ASSI
(( segid " " and resid "80 " and name "HA "))
(( segid " " and resid "80 " and name "HN "))
2.900 1.100 1.100 peak 475 volume 0.216E+08 ppm1 4.845 ppm2 9.148
ASSI
(( segid " " and resid "88 " and name "HB2 "))
(( segid " " and resid "88 " and name "HA "))
2.500 0.800 0.800 peak 477 volume 0.314E+08 ppm1 0.704 ppm2 5.568
ASSI
(( segid " " and resid "23 " and name "HB2 "))
(( segid " " and resid "23 " and name "HN "))
2.700 0.900 0.900 peak 481 volume 0.260E+08 ppm1 2.910 ppm2 8.556
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "75 " and name "HN "))
3.000 1.100 1.100 peak 484 volume 0.192E+08 ppm1 5.548 ppm2 7.927
ASSI
(( segid " " and resid "29 " and name "HA "))
(( segid " " and resid "29 " and name "HN "))
2.900 1.100 1.100 peak 489 volume 0.206E+08 ppm1 4.599 ppm2 8.467
ASSI
(( segid " " and resid "40 " and name "HA "))
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
3.100 1.200 1.200 peak 491 volume 0.169E+08 ppm1 4.229 ppm2 5.561
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "39 " and name "HN "))
2.900 1.100 1.100 peak 497 volume 0.164E+08 ppm1 3.243 ppm2 10.109
ASSI
(( segid " " and resid "85 " and name "HA "))
(( segid " " and resid "80 " and name "HN "))
3.000 1.100 1.100 peak 498 volume 0.178E+08 ppm1 5.708 ppm2 9.148
ASSI
(( segid " " and resid "100 " and name "HG12"))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
2.900 1.100 1.100 peak 502 volume 0.198E+08 ppm1 0.618 ppm2 7.032
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "88 " and name "HB1 "))
2.600 0.800 0.800 peak 503 volume 0.222E+08 ppm1 -0.836 ppm2 2.062
ASSI
(( segid " " and resid "91 " and name "HA "))
(( segid " " and resid "92 " and name "HN "))
3.100 1.200 1.200 peak 507 volume 0.154E+08 ppm1 4.167 ppm2 7.484
ASSI
(( segid " " and resid "79 " and name "HA "))
(( segid " " and resid "79 " and name "HN "))
2.900 1.100 1.100 peak 512 volume 0.212E+08 ppm1 5.289 ppm2 9.518
ASSI
(( segid " " and resid "76 " and name "HZ "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
3.400 1.400 1.400 peak 513 volume 0.139E+08 ppm1 6.213 ppm2 7.040
ASSI
(( segid " " and resid "35 " and name "HB1 ")
OR
( segid " " and resid "35 " and name "HB2 "))
(( segid " " and resid "36 " and name "HN "))
2.900 1.100 1.100 peak 516 volume 0.188E+08 ppm1 1.518 ppm2 8.933
ASSI
(( segid " " and resid "11 " and name "HN "))
(( segid " " and resid "85 " and name "HN "))
3.000 1.100 1.100 peak 519 volume 0.217E+08 ppm1 7.704 ppm2 8.881
ASSI
(( segid " " and resid "7 " and name "HG1 ")
OR
( segid " " and resid "7 " and name "HG2 "))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
3.000 1.100 1.100 peak 521 volume 0.189E+08 ppm1 1.123 ppm2 6.544
ASSI
(( segid " " and resid "14 " and name "HB1 ")
OR
( segid " " and resid "14 " and name "HB2 "))
(( segid " " and resid "14 " and name "HN "))
2.900 1.100 1.100 peak 523 volume 0.182E+08 ppm1 3.120 ppm2 8.453
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "23 " and name "HZ3 "))
2.800 1.000 1.000 peak 527 volume 0.188E+08 ppm1 4.993 ppm2 6.604
ASSI
(( segid " " and resid "78 " and name "HD11")
OR
( segid " " and resid "78 " and name "HD13")
OR
( segid " " and resid "78 " and name "HD12"))
(( segid " " and resid "63 " and name "HA "))
2.800 1.000 1.000 peak 528 volume 0.197E+08 ppm1 1.062 ppm2 5.879
ASSI
(( segid " " and resid "104 " and name "HA "))
(( segid " " and resid "105 " and name "HN "))
3.100 1.200 1.200 peak 533 volume 0.157E+08 ppm1 4.352 ppm2 7.513
ASSI
(( segid " " and resid "6 " and name "HA "))
(( segid " " and resid "6 " and name "HN "))
2.900 1.100 1.100 peak 534 volume 0.219E+08 ppm1 5.584 ppm2 7.617
ASSI
(( segid " " and resid "86 " and name "HA "))
(( segid " " and resid "86 " and name "HN "))
2.900 1.100 1.100 peak 535 volume 0.223E+08 ppm1 5.042 ppm2 9.266
ASSI
(( segid " " and resid "80 " and name "HG "))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
3.000 1.100 1.100 peak 536 volume 0.157E+08 ppm1 1.912 ppm2 6.064
ASSI
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "38 " and name "HN "))
2.900 1.100 1.100 peak 540 volume 0.202E+08 ppm1 2.812 ppm2 9.688
ASSI
(( segid " " and resid "62 " and name "HG21")
OR
( segid " " and resid "62 " and name "HG23")
OR
( segid " " and resid "62 " and name "HG22"))
(( segid " " and resid "62 " and name "HN "))
2.900 1.100 1.100 peak 541 volume 0.219E+08 ppm1 0.914 ppm2 8.793
ASSI
(( segid " " and resid "25 " and name "HB1 ")
OR
( segid " " and resid "25 " and name "HB2 "))
(( segid " " and resid "26 " and name "HN "))
3.000 1.100 1.100 peak 542 volume 0.153E+08 ppm1 2.750 ppm2 9.140
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "11 " and name "HD1 "))
3.100 1.200 1.200 peak 544 volume 0.142E+08 ppm1 3.440 ppm2 7.062
ASSI
(( segid " " and resid "56 " and name "HG11")
OR
( segid " " and resid "56 " and name "HG13")
OR
( segid " " and resid "56 " and name "HG12"))
(( segid " " and resid "37 " and name "HD1 ")
OR
( segid " " and resid "37 " and name "HD2 "))
3.300 1.400 1.400 peak 548 volume 0.116E+08 ppm1 1.209 ppm2 7.247
ASSI
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
(( segid " " and resid "6 " and name "HN "))
3.000 1.100 1.100 peak 557 volume 0.172E+08 ppm1 0.569 ppm2 7.624
ASSI
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
(( segid " " and resid "9 " and name "HD2 "))
3.300 1.400 1.400 peak 568 volume 0.104E+08 ppm1 0.495 ppm2 6.382
ASSI
(( segid " " and resid "63 " and name "HA "))
(( segid " " and resid "79 " and name "HN "))
3.100 1.200 1.200 peak 572 volume 0.151E+08 ppm1 5.880 ppm2 9.518
ASSI
(( segid " " and resid "6 " and name "HB1 "))
(( segid " " and resid "23 " and name "HZ3 "))
2.700 0.900 0.900 peak 574 volume 0.169E+08 ppm1 2.898 ppm2 6.604
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "40 " and name "HN "))
3.100 1.200 1.200 peak 575 volume 0.129E+08 ppm1 3.243 ppm2 7.454
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "23 " and name "HH2 "))
3.100 1.200 1.200 peak 576 volume 0.167E+08 ppm1 0.371 ppm2 6.419
ASSI
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
3.400 1.400 1.400 peak 580 volume 0.148E+08 ppm1 7.408 ppm2 6.396
ASSI
(( segid " " and resid "103 " and name "HD11")
OR
( segid " " and resid "103 " and name "HD13")
OR
( segid " " and resid "103 " and name "HD12"))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
3.100 1.200 1.200 peak 583 volume 0.161E+08 ppm1 0.889 ppm2 7.032
ASSI
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
(( segid " " and resid "89 " and name "HA "))
2.900 1.100 1.100 peak 588 volume 0.167E+08 ppm1 0.778 ppm2 5.265
ASSI
(( segid " " and resid "80 " and name "HD21")
OR
( segid " " and resid "80 " and name "HD23")
OR
( segid " " and resid "80 " and name "HD22"))
(( segid " " and resid "80 " and name "HN "))
3.000 1.100 1.100 peak 592 volume 0.166E+08 ppm1 1.086 ppm2 9.148
ASSI
(( segid " " and resid "84 " and name "HB1 "))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
3.200 1.300 1.300 peak 594 volume 0.120E+08 ppm1 3.107 ppm2 6.064
ASSI
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "71 " and name "HN "))
2.900 1.100 1.100 peak 596 volume 0.202E+08 ppm1 3.908 ppm2 6.833
ASSI
(( segid " " and resid "85 " and name "HA "))
(( segid " " and resid "85 " and name "HN "))
3.100 1.200 1.200 peak 599 volume 0.145E+08 ppm1 5.695 ppm2 8.889
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
3.200 1.300 1.300 peak 602 volume 0.145E+08 ppm1 5.548 ppm2 7.032
ASSI
(( segid " " and resid "40 " and name "HB1 ")
OR
( segid " " and resid "40 " and name "HB2 "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
3.200 1.300 1.300 peak 604 volume 0.111E+08 ppm1 3.107 ppm2 6.389
ASSI
(( segid " " and resid "75 " and name "HB "))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
3.000 1.100 1.100 peak 606 volume 0.164E+08 ppm1 2.134 ppm2 7.277
ASSI
(( segid " " and resid "78 " and name "HB1 "))
(( segid " " and resid "78 " and name "HA "))
2.800 1.000 1.000 peak 607 volume 0.154E+08 ppm1 2.380 ppm2 5.435
ASSI
(( segid " " and resid "77 " and name "HB1 "))
(( segid " " and resid "77 " and name "HA "))
2.900 1.100 1.100 peak 609 volume 0.137E+08 ppm1 1.850 ppm2 5.346
ASSI
(( segid " " and resid "42 " and name "HA "))
(( segid " " and resid "43 " and name "HN "))
3.200 1.300 1.300 peak 610 volume 0.113E+08 ppm1 3.995 ppm2 8.674
ASSI
(( segid " " and resid "20 " and name "HN "))
(( segid " " and resid "22 " and name "HN "))
3.800 1.800 1.800 peak 611 volume 0.613E+07 ppm1 7.889 ppm2 7.979
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "12 " and name "HN "))
3.100 1.200 1.200 peak 613 volume 0.119E+08 ppm1 3.452 ppm2 8.689
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "48 " and name "HN "))
3.100 1.200 1.200 peak 614 volume 0.154E+08 ppm1 4.217 ppm2 8.105
ASSI
(( segid " " and resid "96 " and name "HA "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
3.300 1.400 1.400 peak 619 volume 0.109E+08 ppm1 3.810 ppm2 7.032
ASSI
(( segid " " and resid "100 " and name "HG11"))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
3.200 1.300 1.300 peak 621 volume 0.119E+08 ppm1 1.148 ppm2 7.032
ASSI
(( segid " " and resid "35 " and name "HG1 "))
(( segid " " and resid "36 " and name "HN "))
2.900 1.100 1.100 peak 622 volume 0.172E+08 ppm1 1.727 ppm2 8.933
ASSI
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
(( segid " " and resid "19 " and name "HN "))
3.000 1.100 1.100 peak 625 volume 0.160E+08 ppm1 0.495 ppm2 8.268
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "99 " and name "HZ2 "))
3.000 1.100 1.100 peak 631 volume 0.102E+08 ppm1 -0.836 ppm2 6.788
ASSI
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "17 " and name "HN "))
3.100 1.200 1.200 peak 635 volume 0.152E+08 ppm1 3.674 ppm2 8.763
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "77 " and name "HN "))
3.200 1.300 1.300 peak 637 volume 0.120E+08 ppm1 3.958 ppm2 9.710
ASSI
(( segid " " and resid "51 " and name "HD2 "))
(( segid " " and resid "51 " and name "HN "))
3.400 1.400 1.400 peak 638 volume 0.138E+08 ppm1 6.164 ppm2 8.948
ASSI
(( segid " " and resid "77 " and name "HG1 ")
OR
( segid " " and resid "77 " and name "HG2 "))
(( segid " " and resid "77 " and name "HA "))
2.800 1.000 1.000 peak 639 volume 0.173E+08 ppm1 1.468 ppm2 5.346
ASSI
(( segid " " and resid "80 " and name "HD11")
OR
( segid " " and resid "80 " and name "HD13")
OR
( segid " " and resid "80 " and name "HD12"))
(( segid " " and resid "80 " and name "HN "))
3.200 1.300 1.300 peak 640 volume 0.104E+08 ppm1 1.283 ppm2 9.140
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "4 " and name "HZ "))
3.500 1.500 1.500 peak 644 volume 0.127E+08 ppm1 5.560 ppm2 7.543
ASSI
(( segid " " and resid "12 " and name "HA "))
(( segid " " and resid "11 " and name "HE3 "))
3.200 1.300 1.300 peak 649 volume 0.127E+08 ppm1 4.660 ppm2 7.454
ASSI
(( segid " " and resid "89 " and name "HB2 "))
(( segid " " and resid "6 " and name "HB2 "))
2.700 0.900 0.900 peak 650 volume 0.159E+08 ppm1 1.271 ppm2 2.795
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "99 " and name "HD1 "))
3.500 1.500 1.500 peak 651 volume 0.809E+07 ppm1 -0.836 ppm2 7.247
ASSI
(( segid " " and resid "65 " and name "HG21")
OR
( segid " " and resid "65 " and name "HG23")
OR
( segid " " and resid "65 " and name "HG22"))
(( segid " " and resid "67 " and name "HN "))
3.300 1.400 1.400 peak 656 volume 0.102E+08 ppm1 1.136 ppm2 8.016
ASSI
(( segid " " and resid "52 " and name "HN "))
(( segid " " and resid "51 " and name "HN "))
3.500 1.500 1.500 peak 657 volume 0.963E+07 ppm1 7.754 ppm2 8.941
ASSI
(( segid " " and resid "91 " and name "HD1 ")
OR
( segid " " and resid "91 " and name "HD2 "))
(( segid " " and resid "92 " and name "HN "))
3.000 1.100 1.100 peak 658 volume 0.147E+08 ppm1 1.419 ppm2 7.476
ASSI
(( segid " " and resid "88 " and name "HB2 "))
(( segid " " and resid "76 " and name "HN "))
3.000 1.100 1.100 peak 659 volume 0.148E+08 ppm1 0.717 ppm2 9.599
ASSI
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "12 " and name "HN "))
3.300 1.400 1.400 peak 662 volume 0.108E+08 ppm1 3.674 ppm2 8.689
ASSI
(( segid " " and resid "35 " and name "HN "))
(( segid " " and resid "31 " and name "HN "))
3.400 1.400 1.400 peak 664 volume 0.113E+08 ppm1 8.850 ppm2 8.711
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "38 " and name "HN "))
3.100 1.200 1.200 peak 667 volume 0.133E+08 ppm1 0.445 ppm2 9.688
ASSI
(( segid " " and resid "3 " and name "HA2 "))
(( segid " " and resid "99 " and name "HZ2 "))
3.100 1.200 1.200 peak 669 volume 0.976E+07 ppm1 3.576 ppm2 6.781
ASSI
(( segid " " and resid "18 " and name "HA "))
(( segid " " and resid "18 " and name "HN "))
3.300 1.400 1.400 peak 673 volume 0.937E+07 ppm1 3.921 ppm2 7.203
ASSI
(( segid " " and resid "99 " and name "HB1 "))
(( segid " " and resid "76 " and name "HZ "))
3.200 1.300 1.300 peak 676 volume 0.113E+08 ppm1 2.959 ppm2 6.219
ASSI
(( segid " " and resid "2 " and name "HG1 ")
OR
( segid " " and resid "2 " and name "HG2 "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
3.200 1.300 1.300 peak 678 volume 0.109E+08 ppm1 2.257 ppm2 6.389
ASSI
(( segid " " and resid "83 " and name "HA2 "))
(( segid " " and resid "84 " and name "HN "))
3.400 1.400 1.400 peak 686 volume 0.916E+07 ppm1 3.342 ppm2 8.112
ASSI
(( segid " " and resid "27 " and name "HN "))
(( segid " " and resid "4 " and name "HE1 ")
OR
( segid " " and resid "4 " and name "HE2 "))
3.500 1.500 1.500 peak 687 volume 0.103E+08 ppm1 9.109 ppm2 7.713
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "44 " and name "HN "))
3.300 1.400 1.400 peak 690 volume 0.790E+07 ppm1 3.255 ppm2 7.602
ASSI
(( segid " " and resid "35 " and name "HB1 ")
OR
( segid " " and resid "35 " and name "HB2 "))
(( segid " " and resid "35 " and name "HA "))
3.000 1.100 1.100 peak 692 volume 0.125E+08 ppm1 1.518 ppm2 5.191
ASSI
(( segid " " and resid "30 " and name "HG21")
OR
( segid " " and resid "30 " and name "HG23")
OR
( segid " " and resid "30 " and name "HG22"))
(( segid " " and resid "34 " and name "HN "))
3.200 1.300 1.300 peak 694 volume 0.121E+08 ppm1 0.790 ppm2 7.979
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
3.300 1.400 1.400 peak 695 volume 0.958E+07 ppm1 3.255 ppm2 5.561
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
3.600 1.600 1.600 peak 696 volume 0.636E+07 ppm1 5.202 ppm2 7.173
ASSI
(( segid " " and resid "76 " and name "HB2 "))
(( segid " " and resid "76 " and name "HN "))
3.100 1.200 1.200 peak 697 volume 0.120E+08 ppm1 2.996 ppm2 9.599
ASSI
(( segid " " and resid "78 " and name "HG "))
(( segid " " and resid "78 " and name "HA "))
2.900 1.100 1.100 peak 698 volume 0.141E+08 ppm1 1.653 ppm2 5.442
ASSI
(( segid " " and resid "40 " and name "HB1 ")
OR
( segid " " and resid "40 " and name "HB2 "))
(( segid " " and resid "42 " and name "HN "))
3.100 1.200 1.200 peak 700 volume 0.113E+08 ppm1 3.107 ppm2 8.061
ASSI
(( segid " " and resid "80 " and name "HD21")
OR
( segid " " and resid "80 " and name "HD23")
OR
( segid " " and resid "80 " and name "HD22"))
(( segid " " and resid "81 " and name "HN "))
3.200 1.300 1.300 peak 701 volume 0.116E+08 ppm1 1.086 ppm2 9.325
ASSI
(( segid " " and resid "34 " and name "HG1 ")
OR
( segid " " and resid "34 " and name "HG2 "))
(( segid " " and resid "34 " and name "HN "))
3.000 1.100 1.100 peak 703 volume 0.137E+08 ppm1 2.294 ppm2 7.987
ASSI
(( segid " " and resid "27 " and name "HA "))
(( segid " " and resid "27 " and name "HN "))
3.200 1.300 1.300 peak 704 volume 0.128E+08 ppm1 4.093 ppm2 9.103
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "38 " and name "HN "))
3.100 1.200 1.200 peak 705 volume 0.118E+08 ppm1 3.243 ppm2 9.688
ASSI
(( segid " " and resid "8 " and name "HB2 "))
(( segid " " and resid "23 " and name "HE3 "))
3.300 1.400 1.400 peak 707 volume 0.882E+07 ppm1 -0.947 ppm2 6.944
ASSI
(( segid " " and resid "34 " and name "HG1 ")
OR
( segid " " and resid "34 " and name "HG2 "))
(( segid " " and resid "34 " and name "HA "))
2.900 1.100 1.100 peak 708 volume 0.150E+08 ppm1 2.294 ppm2 5.280
ASSI
(( segid " " and resid "9 " and name "HB1 "))
(( segid " " and resid "9 " and name "HD2 "))
3.400 1.400 1.400 peak 710 volume 0.811E+07 ppm1 3.391 ppm2 6.382
ASSI
(( segid " " and resid "8 " and name "HG1 "))
(( segid " " and resid "8 " and name "HE2 "))
2.800 1.000 1.000 peak 713 volume 0.133E+08 ppm1 0.261 ppm2 2.440
ASSI
(( segid " " and resid "56 " and name "HB "))
(( segid " " and resid "56 " and name "HN "))
3.300 1.400 1.400 peak 714 volume 0.809E+07 ppm1 2.306 ppm2 8.512
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "96 " and name "HG1 "))
3.000 1.100 1.100 peak 717 volume 0.102E+08 ppm1 0.753 ppm2 2.417
ASSI
(( segid " " and resid "79 " and name "HG1 "))
(( segid " " and resid "79 " and name "HE "))
3.100 1.200 1.200 peak 719 volume 0.846E+07 ppm1 1.665 ppm2 7.321
ASSI
(( segid " " and resid "29 " and name "HA "))
(( segid " " and resid "99 " and name "HH2 "))
3.300 1.400 1.400 peak 720 volume 0.112E+08 ppm1 4.586 ppm2 6.714
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
3.400 1.400 1.400 peak 722 volume 0.929E+07 ppm1 3.958 ppm2 7.025
ASSI
(( segid " " and resid "89 " and name "HB2 "))
(( segid " " and resid "89 " and name "HA "))
2.900 1.100 1.100 peak 723 volume 0.150E+08 ppm1 1.271 ppm2 5.265
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "19 " and name "HN "))
3.500 1.500 1.500 peak 724 volume 0.695E+07 ppm1 4.611 ppm2 8.275
ASSI
(( segid " " and resid "78 " and name "HG "))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
3.400 1.400 1.400 peak 725 volume 0.776E+07 ppm1 1.678 ppm2 6.714
ASSI
(( segid " " and resid "99 " and name "HD1 "))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
3.700 1.700 1.700 peak 727 volume 0.813E+07 ppm1 7.236 ppm2 6.714
ASSI
(( segid " " and resid "16 " and name "HN "))
(( segid " " and resid "15 " and name "HN "))
3.300 1.400 1.400 peak 728 volume 0.129E+08 ppm1 7.643 ppm2 8.600
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "99 " and name "HE1 "))
3.500 1.500 1.500 peak 729 volume 0.802E+07 ppm1 -0.836 ppm2 10.597
ASSI
(( segid " " and resid "2 " and name "HA "))
(( segid " " and resid "30 " and name "HN "))
3.200 1.300 1.300 peak 732 volume 0.123E+08 ppm1 5.634 ppm2 8.401
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
3.400 1.400 1.400 peak 734 volume 0.923E+07 ppm1 0.581 ppm2 7.166
ASSI
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "39 " and name "HN "))
3.300 1.400 1.400 peak 736 volume 0.778E+07 ppm1 2.799 ppm2 10.109
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "28 " and name "HB1 "))
3.000 1.100 1.100 peak 737 volume 0.112E+08 ppm1 -0.836 ppm2 2.795
ASSI
(( segid " " and resid "76 " and name "HB2 "))
(( segid " " and resid "66 " and name "HN "))
3.200 1.300 1.300 peak 738 volume 0.109E+08 ppm1 3.009 ppm2 8.711
ASSI
(( segid " " and resid "6 " and name "HB2 "))
(( segid " " and resid "89 " and name "HN "))
3.200 1.300 1.300 peak 741 volume 0.962E+07 ppm1 2.787 ppm2 9.614
ASSI
(( segid " " and resid "11 " and name "HZ3 "))
(( segid " " and resid "84 " and name "HN "))
3.500 1.500 1.500 peak 743 volume 0.634E+07 ppm1 6.854 ppm2 8.105
ASSI
(( segid " " and resid "28 " and name "HG "))
(( segid " " and resid "28 " and name "HA "))
3.200 1.300 1.300 peak 745 volume 0.112E+08 ppm1 1.998 ppm2 5.472
ASSI
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
(( segid " " and resid "69 " and name "HN "))
3.800 1.800 1.800 peak 751 volume 0.640E+07 ppm1 7.285 ppm2 7.787
ASSI
(( segid " " and resid "27 " and name "HB1 "))
(( segid " " and resid "4 " and name "HE1 ")
OR
( segid " " and resid "4 " and name "HE2 "))
3.200 1.300 1.300 peak 752 volume 0.112E+08 ppm1 2.614 ppm2 7.713
ASSI
(( segid " " and resid "51 " and name "HB1 "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
3.400 1.400 1.400 peak 755 volume 0.870E+07 ppm1 3.194 ppm2 6.759
ASSI
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "9 " and name "HD2 "))
3.600 1.600 1.600 peak 756 volume 0.626E+07 ppm1 4.549 ppm2 6.382
ASSI
(( segid " " and resid "30 " and name "HG21")
OR
( segid " " and resid "30 " and name "HG23")
OR
( segid " " and resid "30 " and name "HG22"))
(( segid " " and resid "30 " and name "HN "))
3.200 1.300 1.300 peak 760 volume 0.122E+08 ppm1 0.766 ppm2 8.401
ASSI
(( segid " " and resid "17 " and name "HD1 ")
OR
( segid " " and resid "17 " and name "HD2 "))
(( segid " " and resid "18 " and name "HN "))
3.100 1.200 1.200 peak 761 volume 0.124E+08 ppm1 1.086 ppm2 7.188
ASSI
(( segid " " and resid "95 " and name "HG1 ")
OR
( segid " " and resid "95 " and name "HG2 "))
(( segid " " and resid "92 " and name "HN "))
3.300 1.400 1.400 peak 762 volume 0.862E+07 ppm1 2.528 ppm2 7.484
ASSI
(( segid " " and resid "32 " and name "HB2 "))
(( segid " " and resid "31 " and name "HD21")
OR
( segid " " and resid "31 " and name "HD22"))
3.300 1.400 1.400 peak 766 volume 0.785E+07 ppm1 2.799 ppm2 6.515
ASSI
(( segid " " and resid "38 " and name "HD1 ")
OR
( segid " " and resid "38 " and name "HD2 "))
(( segid " " and resid "48 " and name "HN "))
3.700 1.700 1.700 peak 767 volume 0.736E+07 ppm1 7.236 ppm2 8.112
ASSI
(( segid " " and resid "95 " and name "HG1 ")
OR
( segid " " and resid "95 " and name "HG2 "))
(( segid " " and resid "96 " and name "HN "))
3.300 1.400 1.400 peak 772 volume 0.911E+07 ppm1 2.553 ppm2 8.112
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "99 " and name "HE3 "))
3.400 1.400 1.400 peak 779 volume 0.946E+07 ppm1 -0.836 ppm2 7.129
ASSI
(( segid " " and resid "60 " and name "HG1 ")
OR
( segid " " and resid "60 " and name "HG2 "))
(( segid " " and resid "60 " and name "HN "))
3.300 1.400 1.400 peak 783 volume 0.859E+07 ppm1 2.343 ppm2 9.421
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "99 " and name "HB1 "))
3.200 1.300 1.300 peak 784 volume 0.754E+07 ppm1 -0.861 ppm2 2.965
ASSI
(( segid " " and resid "70 " and name "HA "))
(( segid " " and resid "70 " and name "HN "))
3.300 1.400 1.400 peak 785 volume 0.932E+07 ppm1 4.266 ppm2 8.186
ASSI
(( segid " " and resid "79 " and name "HB2 "))
(( segid " " and resid "79 " and name "HE "))
3.200 1.300 1.300 peak 788 volume 0.583E+07 ppm1 1.764 ppm2 7.321
ASSI
(( segid " " and resid "93 " and name "HB1 "))
(( segid " " and resid "93 " and name "HN "))
3.500 1.500 1.500 peak 792 volume 0.547E+07 ppm1 2.873 ppm2 8.231
ASSI
(( segid " " and resid "50 " and name "HB2 "))
(( segid " " and resid "39 " and name "HN "))
3.300 1.400 1.400 peak 794 volume 0.872E+07 ppm1 2.393 ppm2 10.117
ASSI
(( segid " " and resid "78 " and name "HB2 "))
(( segid " " and resid "79 " and name "HN "))
3.200 1.300 1.300 peak 796 volume 0.108E+08 ppm1 1.481 ppm2 9.518
ASSI
(( segid " " and resid "50 " and name "HA "))
(( segid " " and resid "51 " and name "HD2 "))
3.700 1.700 1.700 peak 798 volume 0.591E+07 ppm1 4.327 ppm2 6.160
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "23 " and name "HE3 "))
3.600 1.600 1.600 peak 801 volume 0.740E+07 ppm1 4.993 ppm2 6.951
ASSI
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "14 " and name "HD2 "))
3.600 1.600 1.600 peak 803 volume 0.673E+07 ppm1 4.229 ppm2 7.114
ASSI
(( segid " " and resid "103 " and name "HD11")
OR
( segid " " and resid "103 " and name "HD13")
OR
( segid " " and resid "103 " and name "HD12"))
(( segid " " and resid "102 " and name "HN "))
3.400 1.400 1.400 peak 804 volume 0.820E+07 ppm1 0.889 ppm2 7.935
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "87 " and name "HN "))
3.300 1.400 1.400 peak 805 volume 0.917E+07 ppm1 0.384 ppm2 8.837
ASSI
(( segid " " and resid "80 " and name "HN "))
(( segid " " and resid "84 " and name "HN "))
3.700 1.700 1.700 peak 806 volume 0.625E+07 ppm1 9.134 ppm2 8.105
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "6 " and name "HN "))
3.400 1.400 1.400 peak 807 volume 0.779E+07 ppm1 -0.836 ppm2 7.617
ASSI
(( segid " " and resid "4 " and name "HB1 "))
(( segid " " and resid "4 " and name "HE1 ")
OR
( segid " " and resid "4 " and name "HE2 "))
3.600 1.600 1.600 peak 809 volume 0.603E+07 ppm1 3.280 ppm2 7.720
ASSI
(( segid " " and resid "26 " and name "HN "))
(( segid " " and resid "25 " and name "HN "))
3.700 1.700 1.700 peak 815 volume 0.696E+07 ppm1 9.134 ppm2 8.955
ASSI
(( segid " " and resid "37 " and name "HN "))
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
3.700 1.700 1.700 peak 816 volume 0.727E+07 ppm1 7.519 ppm2 6.463
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
3.700 1.700 1.700 peak 819 volume 0.562E+07 ppm1 4.956 ppm2 6.759
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "28 " and name "HB2 "))
3.200 1.300 1.300 peak 825 volume 0.666E+07 ppm1 -0.836 ppm2 2.218
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "7 " and name "HN "))
3.500 1.500 1.500 peak 829 volume 0.666E+07 ppm1 4.636 ppm2 9.732
ASSI
(( segid " " and resid "37 " and name "HN "))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
3.900 1.900 1.900 peak 830 volume 0.589E+07 ppm1 7.544 ppm2 7.166
ASSI
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
3.500 1.500 1.500 peak 834 volume 0.716E+07 ppm1 0.643 ppm2 7.269
ASSI
(( segid " " and resid "34 " and name "HB1 "))
(( segid " " and resid "34 " and name "HN "))
3.300 1.400 1.400 peak 837 volume 0.767E+07 ppm1 2.134 ppm2 7.979
ASSI
(( segid " " and resid "11 " and name "HH2 "))
(( segid " " and resid "11 " and name "HE1 "))
3.900 1.900 1.900 peak 840 volume 0.634E+07 ppm1 7.187 ppm2 10.131
ASSI
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "69 " and name "HN "))
3.600 1.600 1.600 peak 844 volume 0.635E+07 ppm1 4.192 ppm2 7.779
ASSI
(( segid " " and resid "78 " and name "HB2 "))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
3.600 1.600 1.600 peak 845 volume 0.618E+07 ppm1 1.481 ppm2 6.433
ASSI
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "9 " and name "HN "))
3.500 1.500 1.500 peak 847 volume 0.712E+07 ppm1 4.364 ppm2 9.392
ASSI
(( segid " " and resid "90 " and name "HA "))
(( segid " " and resid "92 " and name "HN "))
3.700 1.700 1.700 peak 848 volume 0.512E+07 ppm1 4.931 ppm2 7.476
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "5 " and name "HN "))
3.500 1.500 1.500 peak 849 volume 0.632E+07 ppm1 -0.836 ppm2 9.303
ASSI
(( segid " " and resid "89 " and name "HA "))
(( segid " " and resid "23 " and name "HZ3 "))
3.400 1.400 1.400 peak 851 volume 0.550E+07 ppm1 5.264 ppm2 6.611
ASSI
(( segid " " and resid "57 " and name "HB2 "))
(( segid " " and resid "59 " and name "HN "))
3.400 1.400 1.400 peak 856 volume 0.717E+07 ppm1 3.933 ppm2 7.890
ASSI
(( segid " " and resid "100 " and name "HG12"))
(( segid " " and resid "76 " and name "HB1 "))
3.000 1.100 1.100 peak 859 volume 0.978E+07 ppm1 0.593 ppm2 3.120
ASSI
(( segid " " and resid "41 " and name "HN "))
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
3.700 1.700 1.700 peak 863 volume 0.712E+07 ppm1 7.852 ppm2 7.402
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
3.400 1.400 1.400 peak 864 volume 0.759E+07 ppm1 3.255 ppm2 6.470
ASSI
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
(( segid " " and resid "89 " and name "HN "))
3.500 1.500 1.500 peak 868 volume 0.648E+07 ppm1 0.569 ppm2 9.614
ASSI
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
(( segid " " and resid "51 " and name "HD2 "))
4.000 2.000 2.000 peak 872 volume 0.545E+07 ppm1 6.768 ppm2 6.160
ASSI
(( segid " " and resid "99 " and name "HZ3 "))
(( segid " " and resid "30 " and name "HN "))
3.500 1.500 1.500 peak 874 volume 0.660E+07 ppm1 6.484 ppm2 8.401
ASSI
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB3 ")
OR
( segid " " and resid "61 " and name "HB2 "))
(( segid " " and resid "79 " and name "HN "))
3.400 1.400 1.400 peak 875 volume 0.796E+07 ppm1 1.382 ppm2 9.518
ASSI
(( segid " " and resid "37 " and name "HN "))
(( segid " " and resid "38 " and name "HN "))
3.700 1.700 1.700 peak 878 volume 0.649E+07 ppm1 7.544 ppm2 9.688
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "12 " and name "HN "))
3.300 1.400 1.400 peak 887 volume 0.846E+07 ppm1 2.898 ppm2 8.704
ASSI
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
(( segid " " and resid "12 " and name "HN "))
3.600 1.600 1.600 peak 890 volume 0.556E+07 ppm1 0.495 ppm2 8.689
ASSI
(( segid " " and resid "79 " and name "HG2 "))
(( segid " " and resid "85 " and name "HA "))
3.200 1.300 1.300 peak 891 volume 0.736E+07 ppm1 1.616 ppm2 5.701
ASSI
(( segid " " and resid "96 " and name "HE1 ")
OR
( segid " " and resid "96 " and name "HE3 ")
OR
( segid " " and resid "96 " and name "HE2 "))
(( segid " " and resid "97 " and name "HN "))
3.500 1.500 1.500 peak 892 volume 0.668E+07 ppm1 1.863 ppm2 8.475
ASSI
(( segid " " and resid "99 " and name "HE3 "))
(( segid " " and resid "76 " and name "HZ "))
3.900 1.900 1.900 peak 897 volume 0.675E+07 ppm1 7.125 ppm2 6.219
ASSI
(( segid " " and resid "73 " and name "HN "))
(( segid " " and resid "72 " and name "HN "))
3.900 1.900 1.900 peak 902 volume 0.525E+07 ppm1 8.271 ppm2 7.151
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "77 " and name "HN "))
3.500 1.500 1.500 peak 905 volume 0.610E+07 ppm1 0.766 ppm2 9.702
ASSI
(( segid " " and resid "3 " and name "HA2 "))
(( segid " " and resid "2 " and name "HA "))
3.500 1.500 1.500 peak 910 volume 0.558E+07 ppm1 3.576 ppm2 5.635
ASSI
(( segid " " and resid "28 " and name "HB2 "))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
3.500 1.500 1.500 peak 911 volume 0.663E+07 ppm1 2.208 ppm2 7.166
ASSI
(( segid " " and resid "76 " and name "HN "))
(( segid " " and resid "66 " and name "HN "))
3.800 1.800 1.800 peak 914 volume 0.566E+07 ppm1 9.602 ppm2 8.711
ASSI
(( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "25 " and name "HN "))
3.400 1.400 1.400 peak 915 volume 0.664E+07 ppm1 2.935 ppm2 8.978
ASSI
(( segid " " and resid "58 " and name "HD21")
OR
( segid " " and resid "58 " and name "HD23")
OR
( segid " " and resid "58 " and name "HD22"))
(( segid " " and resid "61 " and name "HN "))
3.500 1.500 1.500 peak 919 volume 0.641E+07 ppm1 0.766 ppm2 7.447
ASSI
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
3.700 1.700 1.700 peak 920 volume 0.540E+07 ppm1 4.389 ppm2 6.071
ASSI
(( segid " " and resid "84 " and name "HB1 "))
(( segid " " and resid "80 " and name "HN "))
3.400 1.400 1.400 peak 924 volume 0.670E+07 ppm1 3.107 ppm2 9.140
ASSI
(( segid " " and resid "5 " and name "HN "))
(( segid " " and resid "6 " and name "HN "))
3.900 1.900 1.900 peak 927 volume 0.523E+07 ppm1 9.282 ppm2 7.609
ASSI
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
(( segid " " and resid "95 " and name "HN "))
3.600 1.600 1.600 peak 930 volume 0.595E+07 ppm1 1.850 ppm2 9.355
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "34 " and name "HN "))
3.600 1.600 1.600 peak 934 volume 0.566E+07 ppm1 5.178 ppm2 7.972
ASSI
(( segid " " and resid "76 " and name "HN "))
(( segid " " and resid "75 " and name "HN "))
3.700 1.700 1.700 peak 935 volume 0.633E+07 ppm1 9.602 ppm2 7.927
ASSI
(( segid " " and resid "8 " and name "HB2 "))
(( segid " " and resid "23 " and name "HZ3 "))
3.200 1.300 1.300 peak 937 volume 0.649E+07 ppm1 -0.960 ppm2 6.596
ASSI
(( segid " " and resid "89 " and name "HB1 "))
(( segid " " and resid "89 " and name "HN "))
3.500 1.500 1.500 peak 938 volume 0.579E+07 ppm1 2.676 ppm2 9.614
ASSI
(( segid " " and resid "60 " and name "HN "))
(( segid " " and resid "59 " and name "HN "))
3.800 1.800 1.800 peak 947 volume 0.591E+07 ppm1 9.417 ppm2 7.905
ASSI
(( segid " " and resid "64 " and name "HB1 ")
OR
( segid " " and resid "64 " and name "HB2 "))
(( segid " " and resid "77 " and name "HN "))
3.400 1.400 1.400 peak 949 volume 0.699E+07 ppm1 2.220 ppm2 9.702
ASSI
(( segid " " and resid "9 " and name "HB2 "))
(( segid " " and resid "10 " and name "HN "))
3.500 1.500 1.500 peak 950 volume 0.578E+07 ppm1 2.528 ppm2 8.053
ASSI
(( segid " " and resid "62 " and name "HB "))
(( segid " " and resid "63 " and name "HN "))
3.500 1.500 1.500 peak 955 volume 0.546E+07 ppm1 1.826 ppm2 8.970
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "63 " and name "HA "))
3.500 1.500 1.500 peak 957 volume 0.520E+07 ppm1 4.981 ppm2 5.879
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "25 " and name "HA "))
3.500 1.500 1.500 peak 961 volume 0.528E+07 ppm1 0.569 ppm2 5.391
ASSI
(( segid " " and resid "27 " and name "HN "))
(( segid " " and resid "28 " and name "HN "))
3.700 1.700 1.700 peak 962 volume 0.642E+07 ppm1 9.097 ppm2 8.512
ASSI
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
(( segid " " and resid "11 " and name "HN "))
3.500 1.500 1.500 peak 994 volume 0.631E+07 ppm1 0.495 ppm2 7.706
ASSI
(( segid " " and resid "35 " and name "HG1 "))
(( segid " " and resid "35 " and name "HA "))
3.400 1.400 1.400 peak 995 volume 0.526E+07 ppm1 1.764 ppm2 5.198
ASSI
(( segid " " and resid "40 " and name "HA "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
3.700 1.700 1.700 peak 1006 volume 0.626E+07 ppm1 4.229 ppm2 6.389
ASSI
(( segid " " and resid "55 " and name "HD2 "))
(( segid " " and resid "54 " and name "HN "))
3.600 1.600 1.600 peak 1020 volume 0.530E+07 ppm1 3.662 ppm2 7.876
ASSI
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
(( segid " " and resid "23 " and name "HZ2 "))
3.600 1.600 1.600 peak 1024 volume 0.546E+07 ppm1 7.261 ppm2 7.003
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB3 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "76 " and name "HN "))
3.700 1.700 1.700 peak 1033 volume 0.506E+07 ppm1 1.370 ppm2 9.591
ASSI
(( segid " " and resid "94 " and name "HN "))
(( segid " " and resid "92 " and name "HN "))
3.700 1.700 1.700 peak 1071 volume 0.637E+07 ppm1 8.283 ppm2 7.484
ASSI
(( segid " " and resid "30 " and name "HA "))
(( segid " " and resid "34 " and name "HN "))
3.600 1.600 1.600 peak 1074 volume 0.553E+07 ppm1 5.030 ppm2 7.994
ASSI
(( segid " " and resid "6 " and name "HN "))
(( segid " " and resid "88 " and name "HE1 ")
OR
( segid " " and resid "88 " and name "HE2 "))
3.900 1.900 1.900 peak 1076 volume 0.527E+07 ppm1 7.618 ppm2 6.537
ASSI
(( segid " " and resid "53 " and name "HA "))
(( segid " " and resid "54 " and name "HN "))
2.100 0.600 0.600 peak 1099 volume 0.154E+09 ppm1 4.204 ppm2 7.876
ASSI
(( segid " " and resid "29 " and name "HG11")
OR
( segid " " and resid "29 " and name "HG13")
OR
( segid " " and resid "29 " and name "HG12"))
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
2.400 0.700 0.700 peak 1113 volume 0.799E+08 ppm1 0.914 ppm2 6.463
ASSI
(( segid " " and resid "29 " and name "HG11")
OR
( segid " " and resid "29 " and name "HG13")
OR
( segid " " and resid "29 " and name "HG12"))
(( segid " " and resid "29 " and name "HN "))
2.300 0.700 0.700 peak 1125 volume 0.796E+08 ppm1 0.914 ppm2 8.475
ASSI
(( segid " " and resid "13 " and name "HB1 ")
OR
( segid " " and resid "13 " and name "HB3 ")
OR
( segid " " and resid "13 " and name "HB2 "))
(( segid " " and resid "13 " and name "HN "))
2.400 0.700 0.700 peak 1131 volume 0.598E+08 ppm1 1.345 ppm2 8.038
ASSI
(( segid " " and resid "102 " and name "HN "))
(( segid " " and resid "101 " and name "HN "))
2.600 0.800 0.800 peak 1139 volume 0.497E+08 ppm1 7.938 ppm2 8.127
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "14 " and name "HN "))
2.500 0.800 0.800 peak 1145 volume 0.519E+08 ppm1 4.081 ppm2 8.453
ASSI
(( segid " " and resid "91 " and name "HG1 ")
OR
( segid " " and resid "91 " and name "HG2 "))
(( segid " " and resid "91 " and name "HN "))
2.600 0.800 0.800 peak 1158 volume 0.344E+08 ppm1 1.678 ppm2 9.222
ASSI
(( segid " " and resid "4 " and name "HZ "))
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
3.000 1.100 1.100 peak 1163 volume 0.294E+08 ppm1 7.544 ppm2 7.402
ASSI
(( segid " " and resid "44 " and name "HN "))
(( segid " " and resid "40 " and name "HN "))
2.900 1.100 1.100 peak 1173 volume 0.309E+08 ppm1 7.630 ppm2 7.447
ASSI
(( segid " " and resid "36 " and name "HA2 "))
(( segid " " and resid "36 " and name "HN "))
2.700 0.900 0.900 peak 1176 volume 0.361E+08 ppm1 3.378 ppm2 8.933
ASSI
(( segid " " and resid "2 " and name "HB2 "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
2.800 1.000 1.000 peak 1178 volume 0.277E+08 ppm1 1.998 ppm2 6.389
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "40 " and name "HN "))
2.700 0.900 0.900 peak 1180 volume 0.305E+08 ppm1 1.937 ppm2 7.454
ASSI
(( segid " " and resid "35 " and name "HG2 "))
(( segid " " and resid "35 " and name "HN "))
2.600 0.800 0.800 peak 1186 volume 0.349E+08 ppm1 1.678 ppm2 8.859
ASSI
(( segid " " and resid "16 " and name "HA "))
(( segid " " and resid "16 " and name "HN "))
2.800 1.000 1.000 peak 1190 volume 0.250E+08 ppm1 4.660 ppm2 7.639
ASSI
(( segid " " and resid "6 " and name "HA "))
(( segid " " and resid "26 " and name "HN "))
2.800 1.000 1.000 peak 1191 volume 0.267E+08 ppm1 5.584 ppm2 9.140
ASSI
(( segid " " and resid "79 " and name "HD1 ")
OR
( segid " " and resid "79 " and name "HD2 "))
(( segid " " and resid "79 " and name "HE "))
2.600 0.800 0.800 peak 1194 volume 0.221E+08 ppm1 3.194 ppm2 7.321
ASSI
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "58 " and name "HN "))
2.800 1.000 1.000 peak 1196 volume 0.281E+08 ppm1 5.276 ppm2 8.771
ASSI
(( segid " " and resid "43 " and name "HN "))
(( segid " " and resid "40 " and name "HN "))
3.100 1.200 1.200 peak 1203 volume 0.204E+08 ppm1 8.678 ppm2 7.454
ASSI
(( segid " " and resid "22 " and name "HB1 "))
(( segid " " and resid "22 " and name "HN "))
2.700 0.900 0.900 peak 1206 volume 0.267E+08 ppm1 3.871 ppm2 7.972
ASSI
(( segid " " and resid "103 " and name "HG21")
OR
( segid " " and resid "103 " and name "HG23")
OR
( segid " " and resid "103 " and name "HG22"))
(( segid " " and resid "104 " and name "HN "))
3.000 1.100 1.100 peak 1207 volume 0.181E+08 ppm1 0.926 ppm2 8.231
ASSI
(( segid " " and resid "88 " and name "HB1 "))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
2.900 1.100 1.100 peak 1210 volume 0.227E+08 ppm1 2.047 ppm2 6.714
ASSI
(( segid " " and resid "10 " and name "HB2 "))
(( segid " " and resid "11 " and name "HN "))
2.800 1.000 1.000 peak 1211 volume 0.202E+08 ppm1 1.604 ppm2 7.698
ASSI
(( segid " " and resid "95 " and name "HB1 "))
(( segid " " and resid "92 " and name "HN "))
2.900 1.100 1.100 peak 1212 volume 0.187E+08 ppm1 2.331 ppm2 7.484
ASSI
(( segid " " and resid "19 " and name "HB1 ")
OR
( segid " " and resid "19 " and name "HB2 "))
(( segid " " and resid "19 " and name "HN "))
2.800 1.000 1.000 peak 1213 volume 0.219E+08 ppm1 3.810 ppm2 8.268
ASSI
(( segid " " and resid "22 " and name "HB2 "))
(( segid " " and resid "22 " and name "HN "))
2.800 1.000 1.000 peak 1214 volume 0.239E+08 ppm1 3.748 ppm2 7.972
ASSI
(( segid " " and resid "31 " and name "HN "))
(( segid " " and resid "34 " and name "HN "))
3.000 1.100 1.100 peak 1215 volume 0.235E+08 ppm1 8.727 ppm2 7.979
ASSI
(( segid " " and resid "56 " and name "HG11")
OR
( segid " " and resid "56 " and name "HG13")
OR
( segid " " and resid "56 " and name "HG12"))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
3.000 1.100 1.100 peak 1217 volume 0.176E+08 ppm1 1.209 ppm2 6.064
ASSI
(( segid " " and resid "41 " and name "HN "))
(( segid " " and resid "4 " and name "HZ "))
3.100 1.200 1.200 peak 1220 volume 0.206E+08 ppm1 7.852 ppm2 7.550
ASSI
(( segid " " and resid "99 " and name "HB2 "))
(( segid " " and resid "76 " and name "HE1 ")
OR
( segid " " and resid "76 " and name "HE2 "))
2.900 1.100 1.100 peak 1221 volume 0.198E+08 ppm1 2.713 ppm2 6.714
ASSI
(( segid " " and resid "76 " and name "HB2 "))
(( segid " " and resid "77 " and name "HN "))
2.900 1.100 1.100 peak 1228 volume 0.178E+08 ppm1 2.996 ppm2 9.710
ASSI
(( segid " " and resid "80 " and name "HD21")
OR
( segid " " and resid "80 " and name "HD23")
OR
( segid " " and resid "80 " and name "HD22"))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
3.100 1.200 1.200 peak 1231 volume 0.145E+08 ppm1 1.086 ppm2 6.064
ASSI
(( segid " " and resid "85 " and name "HB2 "))
(( segid " " and resid "85 " and name "HA "))
2.700 0.900 0.900 peak 1232 volume 0.224E+08 ppm1 2.035 ppm2 5.701
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "59 " and name "HN "))
3.100 1.200 1.200 peak 1233 volume 0.151E+08 ppm1 4.426 ppm2 7.905
ASSI
(( segid " " and resid "71 " and name "HN "))
(( segid " " and resid "72 " and name "HN "))
3.200 1.300 1.300 peak 1234 volume 0.158E+08 ppm1 6.805 ppm2 7.151
ASSI
(( segid " " and resid "95 " and name "HB2 "))
(( segid " " and resid "91 " and name "HN "))
2.900 1.100 1.100 peak 1235 volume 0.184E+08 ppm1 2.208 ppm2 9.222
ASSI
(( segid " " and resid "51 " and name "HB1 "))
(( segid " " and resid "52 " and name "HN "))
2.900 1.100 1.100 peak 1236 volume 0.175E+08 ppm1 3.206 ppm2 7.750
ASSI
(( segid " " and resid "10 " and name "HB1 "))
(( segid " " and resid "11 " and name "HN "))
2.900 1.100 1.100 peak 1238 volume 0.175E+08 ppm1 1.690 ppm2 7.698
ASSI
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
3.700 1.700 1.700 peak 1239 volume 0.839E+07 ppm1 7.002 ppm2 6.870
ASSI
(( segid " " and resid "85 " and name "HB1 "))
(( segid " " and resid "86 " and name "HN "))
2.800 1.000 1.000 peak 1240 volume 0.231E+08 ppm1 2.294 ppm2 9.266
ASSI
(( segid " " and resid "87 " and name "HB2 "))
(( segid " " and resid "88 " and name "HN "))
2.800 1.000 1.000 peak 1244 volume 0.220E+08 ppm1 1.000 ppm2 8.918
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "31 " and name "HN "))
3.100 1.200 1.200 peak 1247 volume 0.143E+08 ppm1 5.190 ppm2 8.726
ASSI
(( segid " " and resid "23 " and name "HE3 "))
(( segid " " and resid "7 " and name "HN "))
3.200 1.300 1.300 peak 1249 volume 0.171E+08 ppm1 6.940 ppm2 9.732
ASSI
(( segid " " and resid "26 " and name "HB "))
(( segid " " and resid "24 " and name "HD2 "))
3.100 1.200 1.200 peak 1250 volume 0.136E+08 ppm1 1.739 ppm2 6.848
ASSI
(( segid " " and resid "28 " and name "HB2 "))
(( segid " " and resid "28 " and name "HN "))
3.000 1.100 1.100 peak 1251 volume 0.149E+08 ppm1 2.195 ppm2 8.504
ASSI
(( segid " " and resid "77 " and name "HG1 ")
OR
( segid " " and resid "77 " and name "HG2 "))
(( segid " " and resid "77 " and name "HN "))
2.900 1.100 1.100 peak 1253 volume 0.164E+08 ppm1 1.456 ppm2 9.710
ASSI
(( segid " " and resid "78 " and name "HG "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
3.000 1.100 1.100 peak 1256 volume 0.152E+08 ppm1 1.653 ppm2 6.877
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "20 " and name "HN "))
3.100 1.200 1.200 peak 1261 volume 0.137E+08 ppm1 4.611 ppm2 7.905
ASSI
(( segid " " and resid "85 " and name "HG1 ")
OR
( segid " " and resid "85 " and name "HG2 "))
(( segid " " and resid "86 " and name "HN "))
3.000 1.100 1.100 peak 1263 volume 0.152E+08 ppm1 2.121 ppm2 9.259
ASSI
(( segid " " and resid "5 " and name "HB2 "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
3.000 1.100 1.100 peak 1268 volume 0.154E+08 ppm1 1.246 ppm2 6.877
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB3 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "77 " and name "HN "))
3.200 1.300 1.300 peak 1269 volume 0.112E+08 ppm1 1.370 ppm2 9.710
ASSI
(( segid " " and resid "9 " and name "HB2 "))
(( segid " " and resid "9 " and name "HD2 "))
3.400 1.400 1.400 peak 1271 volume 0.867E+07 ppm1 2.516 ppm2 6.382
ASSI
(( segid " " and resid "38 " and name "HN "))
(( segid " " and resid "27 " and name "HN "))
3.200 1.300 1.300 peak 1273 volume 0.168E+08 ppm1 9.688 ppm2 9.103
ASSI
(( segid " " and resid "34 " and name "HN "))
(( segid " " and resid "35 " and name "HN "))
3.300 1.400 1.400 peak 1276 volume 0.130E+08 ppm1 7.975 ppm2 8.867
ASSI
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "22 " and name "HN "))
3.200 1.300 1.300 peak 1279 volume 0.112E+08 ppm1 4.549 ppm2 7.964
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "85 " and name "HN "))
3.300 1.400 1.400 peak 1283 volume 0.865E+07 ppm1 3.440 ppm2 8.889
ASSI
(( segid " " and resid "79 " and name "HB1 "))
(( segid " " and resid "62 " and name "HN "))
3.100 1.200 1.200 peak 1284 volume 0.129E+08 ppm1 1.949 ppm2 8.793
ASSI
(( segid " " and resid "31 " and name "HB1 "))
(( segid " " and resid "31 " and name "HD21")
OR
( segid " " and resid "31 " and name "HD22"))
3.200 1.300 1.300 peak 1288 volume 0.103E+08 ppm1 2.676 ppm2 6.522
ASSI
(( segid " " and resid "60 " and name "HB1 ")
OR
( segid " " and resid "60 " and name "HB2 "))
(( segid " " and resid "61 " and name "HN "))
3.300 1.400 1.400 peak 1289 volume 0.901E+07 ppm1 2.245 ppm2 7.432
ASSI
(( segid " " and resid "35 " and name "HG1 "))
(( segid " " and resid "56 " and name "HN "))
3.300 1.400 1.400 peak 1291 volume 0.808E+07 ppm1 1.764 ppm2 8.504
ASSI
(( segid " " and resid "62 " and name "HN "))
(( segid " " and resid "61 " and name "HN "))
3.400 1.400 1.400 peak 1297 volume 0.106E+08 ppm1 8.752 ppm2 7.447
ASSI
(( segid " " and resid "71 " and name "HG1 ")
OR
( segid " " and resid "71 " and name "HG2 "))
(( segid " " and resid "72 " and name "HN "))
3.300 1.400 1.400 peak 1298 volume 0.773E+07 ppm1 1.838 ppm2 7.143
ASSI
(( segid " " and resid "26 " and name "HN "))
(( segid " " and resid "7 " and name "HN "))
3.400 1.400 1.400 peak 1300 volume 0.114E+08 ppm1 9.134 ppm2 9.725
ASSI
(( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "50 " and name "HE1 ")
OR
( segid " " and resid "50 " and name "HE2 "))
3.300 1.400 1.400 peak 1306 volume 0.939E+07 ppm1 1.850 ppm2 6.522
ASSI
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
(( segid " " and resid "50 " and name "HE1 ")
OR
( segid " " and resid "50 " and name "HE2 "))
3.400 1.400 1.400 peak 1311 volume 0.779E+07 ppm1 3.120 ppm2 6.522
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "69 " and name "HB2 "))
3.200 1.300 1.300 peak 1312 volume 0.716E+07 ppm1 0.371 ppm2 2.906
ASSI
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
(( segid " " and resid "9 " and name "HD1 "))
3.800 1.800 1.800 peak 1313 volume 0.622E+07 ppm1 6.053 ppm2 8.201
ASSI
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
(( segid " " and resid "27 " and name "HN "))
3.700 1.700 1.700 peak 1314 volume 0.759E+07 ppm1 5.560 ppm2 9.103
ASSI
(( segid " " and resid "102 " and name "HN "))
(( segid " " and resid "105 " and name "HN "))
3.800 1.800 1.800 peak 1334 volume 0.535E+07 ppm1 7.938 ppm2 7.506
ASSI
(( segid " " and resid "63 " and name "HB1 "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
3.600 1.600 1.600 peak 1339 volume 0.522E+07 ppm1 2.787 ppm2 7.025
ASSI
(( segid " " and resid "67 " and name "HB1 "))
(( segid " " and resid "67 " and name "HN "))
2.400 0.700 0.700 peak 1366 volume 0.605E+08 ppm1 1.776 ppm2 8.016
ASSI
(( segid " " and resid "47 " and name "HN "))
(( segid " " and resid "48 " and name "HN "))
2.700 0.900 0.900 peak 1375 volume 0.417E+08 ppm1 7.754 ppm2 8.105
ASSI
(( segid " " and resid "85 " and name "HG1 ")
OR
( segid " " and resid "85 " and name "HG2 "))
(( segid " " and resid "85 " and name "HN "))
2.500 0.800 0.800 peak 1391 volume 0.480E+08 ppm1 2.121 ppm2 8.881
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "44 " and name "HN "))
2.800 1.000 1.000 peak 1393 volume 0.284E+08 ppm1 4.204 ppm2 7.595
ASSI
(( segid " " and resid "103 " and name "HG21")
OR
( segid " " and resid "103 " and name "HG23")
OR
( segid " " and resid "103 " and name "HG22"))
(( segid " " and resid "63 " and name "HB2 "))
2.400 0.700 0.700 peak 1397 volume 0.421E+08 ppm1 0.926 ppm2 2.654
ASSI
(( segid " " and resid "10 " and name "HB2 "))
(( segid " " and resid "10 " and name "HN "))
2.500 0.800 0.800 peak 1403 volume 0.406E+08 ppm1 1.604 ppm2 8.061
ASSI
(( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "67 " and name "HN "))
2.600 0.800 0.800 peak 1404 volume 0.347E+08 ppm1 1.604 ppm2 8.016
ASSI
(( segid " " and resid "73 " and name "HG2 "))
(( segid " " and resid "73 " and name "HN "))
2.700 0.900 0.900 peak 1409 volume 0.303E+08 ppm1 1.320 ppm2 8.275
ASSI
(( segid " " and resid "100 " and name "HG12"))
(( segid " " and resid "100 " and name "HN "))
2.700 0.900 0.900 peak 1415 volume 0.259E+08 ppm1 0.618 ppm2 8.105
ASSI
(( segid " " and resid "42 " and name "HG1 ")
OR
( segid " " and resid "42 " and name "HG2 "))
(( segid " " and resid "42 " and name "HN "))
2.700 0.900 0.900 peak 1416 volume 0.287E+08 ppm1 1.431 ppm2 8.061
ASSI
(( segid " " and resid "15 " and name "HA "))
(( segid " " and resid "16 " and name "HN "))
2.900 1.100 1.100 peak 1419 volume 0.238E+08 ppm1 4.253 ppm2 7.639
ASSI
(( segid " " and resid "7 " and name "HD1 ")
OR
( segid " " and resid "7 " and name "HD2 "))
(( segid " " and resid "37 " and name "HE1 ")
OR
( segid " " and resid "37 " and name "HE2 "))
2.900 1.100 1.100 peak 1422 volume 0.195E+08 ppm1 2.639 ppm2 7.173
ASSI
(( segid " " and resid "80 " and name "HB2 "))
(( segid " " and resid "80 " and name "HN "))
2.800 1.000 1.000 peak 1423 volume 0.213E+08 ppm1 2.023 ppm2 9.148
ASSI
(( segid " " and resid "91 " and name "HD1 ")
OR
( segid " " and resid "91 " and name "HD2 "))
(( segid " " and resid "91 " and name "HN "))
2.700 0.900 0.900 peak 1426 volume 0.264E+08 ppm1 1.407 ppm2 9.222
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
3.000 1.100 1.100 peak 1428 volume 0.175E+08 ppm1 0.371 ppm2 7.277
ASSI
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
(( segid " " and resid "88 " and name "HN "))
2.700 0.900 0.900 peak 1431 volume 0.295E+08 ppm1 0.827 ppm2 8.918
ASSI
(( segid " " and resid "73 " and name "HB1 ")
OR
( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "73 " and name "HN "))
2.900 1.100 1.100 peak 1436 volume 0.179E+08 ppm1 0.704 ppm2 8.275
ASSI
(( segid " " and resid "73 " and name "HD1 ")
OR
( segid " " and resid "73 " and name "HD2 "))
(( segid " " and resid "73 " and name "HN "))
2.900 1.100 1.100 peak 1438 volume 0.201E+08 ppm1 1.246 ppm2 8.275
ASSI
(( segid " " and resid "74 " and name "HN "))
(( segid " " and resid "74 " and name "HD1 "))
3.300 1.400 1.400 peak 1439 volume 0.132E+08 ppm1 8.813 ppm2 8.231
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "11 " and name "HN "))
2.900 1.100 1.100 peak 1443 volume 0.185E+08 ppm1 2.898 ppm2 7.698
ASSI
(( segid " " and resid "73 " and name "HB1 ")
OR
( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "74 " and name "HD1 "))
3.200 1.300 1.300 peak 1445 volume 0.110E+08 ppm1 0.704 ppm2 8.231
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "69 " and name "HE1 ")
OR
( segid " " and resid "69 " and name "HE2 "))
3.100 1.200 1.200 peak 1447 volume 0.156E+08 ppm1 0.371 ppm2 6.788
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
3.200 1.300 1.300 peak 1456 volume 0.119E+08 ppm1 0.445 ppm2 6.766
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "24 " and name "HD2 "))
3.200 1.300 1.300 peak 1460 volume 0.124E+08 ppm1 0.569 ppm2 6.848
ASSI
(( segid " " and resid "55 " and name "HB1 ")
OR
( segid " " and resid "55 " and name "HB2 "))
(( segid " " and resid "56 " and name "HN "))
3.000 1.100 1.100 peak 1462 volume 0.154E+08 ppm1 1.628 ppm2 8.504
ASSI
(( segid " " and resid "12 " and name "HB1 ")
OR
( segid " " and resid "12 " and name "HB2 "))
(( segid " " and resid "9 " and name "HD1 "))
3.200 1.300 1.300 peak 1464 volume 0.102E+08 ppm1 1.776 ppm2 8.201
ASSI
(( segid " " and resid "5 " and name "HG "))
(( segid " " and resid "5 " and name "HN "))
3.100 1.200 1.200 peak 1466 volume 0.113E+08 ppm1 0.926 ppm2 9.303
ASSI
(( segid " " and resid "48 " and name "HD11")
OR
( segid " " and resid "48 " and name "HD13")
OR
( segid " " and resid "48 " and name "HD12"))
(( segid " " and resid "48 " and name "HN "))
3.100 1.200 1.200 peak 1469 volume 0.126E+08 ppm1 0.938 ppm2 8.105
ASSI
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "11 " and name "HN "))
3.200 1.300 1.300 peak 1470 volume 0.131E+08 ppm1 4.315 ppm2 7.698
ASSI
(( segid " " and resid "85 " and name "HA "))
(( segid " " and resid "86 " and name "HD1 ")
OR
( segid " " and resid "86 " and name "HD2 "))
3.400 1.400 1.400 peak 1473 volume 0.100E+08 ppm1 5.708 ppm2 6.433
ASSI
(( segid " " and resid "103 " and name "HA "))
(( segid " " and resid "104 " and name "HN "))
3.300 1.400 1.400 peak 1478 volume 0.101E+08 ppm1 3.576 ppm2 8.231
ASSI
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
(( segid " " and resid "78 " and name "HN "))
3.300 1.400 1.400 peak 1480 volume 0.876E+07 ppm1 0.643 ppm2 9.259
ASSI
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
(( segid " " and resid "36 " and name "HN "))
3.500 1.500 1.500 peak 1482 volume 0.110E+08 ppm1 6.472 ppm2 8.933
ASSI
(( segid " " and resid "42 " and name "HG1 ")
OR
( segid " " and resid "42 " and name "HG2 "))
(( segid " " and resid "43 " and name "HN "))
3.200 1.300 1.300 peak 1483 volume 0.103E+08 ppm1 1.419 ppm2 8.667
ASSI
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
(( segid " " and resid "71 " and name "HN "))
3.200 1.300 1.300 peak 1487 volume 0.108E+08 ppm1 1.530 ppm2 6.825
ASSI
(( segid " " and resid "51 " and name "HB1 "))
(( segid " " and resid "51 " and name "HN "))
3.300 1.400 1.400 peak 1490 volume 0.837E+07 ppm1 3.206 ppm2 8.933
ASSI
(( segid " " and resid "28 " and name "HB2 "))
(( segid " " and resid "99 " and name "HZ3 "))
3.300 1.400 1.400 peak 1503 volume 0.525E+07 ppm1 2.195 ppm2 6.456
ASSI
(( segid " " and resid "78 " and name "HD21")
OR
( segid " " and resid "78 " and name "HD23")
OR
( segid " " and resid "78 " and name "HD22"))
(( segid " " and resid "79 " and name "HN "))
3.400 1.400 1.400 peak 1515 volume 0.725E+07 ppm1 0.988 ppm2 9.518
ASSI
(( segid " " and resid "59 " and name "HB1 "))
(( segid " " and resid "60 " and name "HN "))
3.500 1.500 1.500 peak 1517 volume 0.636E+07 ppm1 1.826 ppm2 9.421
ASSI
(( segid " " and resid "39 " and name "HG2 "))
(( segid " " and resid "39 " and name "HN "))
3.400 1.400 1.400 peak 1518 volume 0.699E+07 ppm1 1.628 ppm2 10.109
ASSI
(( segid " " and resid "100 " and name "HA "))
(( segid " " and resid "104 " and name "HN "))
3.500 1.500 1.500 peak 1521 volume 0.654E+07 ppm1 3.502 ppm2 8.223
ASSI
(( segid " " and resid "41 " and name "HB1 ")
OR
( segid " " and resid "41 " and name "HB3 ")
OR
( segid " " and resid "41 " and name "HB2 "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
2.400 0.700 0.700 peak 1559 volume 0.737E+08 ppm1 1.037 ppm2 6.396
ASSI
(( segid " " and resid "57 " and name "HB1 "))
(( segid " " and resid "57 " and name "HN "))
2.500 0.800 0.800 peak 1563 volume 0.490E+08 ppm1 4.130 ppm2 8.808
ASSI
(( segid " " and resid "98 " and name "HB "))
(( segid " " and resid "99 " and name "HN "))
2.400 0.700 0.700 peak 1564 volume 0.541E+08 ppm1 4.253 ppm2 8.046
ASSI
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "68 " and name "HN "))
2.700 0.900 0.900 peak 1568 volume 0.333E+08 ppm1 4.192 ppm2 8.815
ASSI
(( segid " " and resid "12 " and name "HA "))
(( segid " " and resid "13 " and name "HN "))
2.800 1.000 1.000 peak 1569 volume 0.289E+08 ppm1 4.648 ppm2 8.038
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "44 " and name "HN "))
2.700 0.900 0.900 peak 1570 volume 0.299E+08 ppm1 2.959 ppm2 7.602
ASSI
(( segid " " and resid "13 " and name "HB1 ")
OR
( segid " " and resid "13 " and name "HB3 ")
OR
( segid " " and resid "13 " and name "HB2 "))
(( segid " " and resid "14 " and name "HN "))
2.700 0.900 0.900 peak 1571 volume 0.305E+08 ppm1 1.333 ppm2 8.453
ASSI
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
(( segid " " and resid "87 " and name "HN "))
2.600 0.800 0.800 peak 1573 volume 0.374E+08 ppm1 0.630 ppm2 8.852
ASSI
(( segid " " and resid "56 " and name "HG11")
OR
( segid " " and resid "56 " and name "HG13")
OR
( segid " " and resid "56 " and name "HG12"))
(( segid " " and resid "56 " and name "HN "))
2.700 0.900 0.900 peak 1574 volume 0.303E+08 ppm1 1.209 ppm2 8.512
ASSI
(( segid " " and resid "88 " and name "HB2 "))
(( segid " " and resid "88 " and name "HD1 ")
OR
( segid " " and resid "88 " and name "HD2 "))
2.900 1.100 1.100 peak 1583 volume 0.215E+08 ppm1 0.704 ppm2 6.870
ASSI
(( segid " " and resid "7 " and name "HG1 ")
OR
( segid " " and resid "7 " and name "HG2 "))
(( segid " " and resid "7 " and name "HD1 ")
OR
( segid " " and resid "7 " and name "HD2 "))
2.500 0.800 0.800 peak 1584 volume 0.274E+08 ppm1 1.111 ppm2 2.639
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "27 " and name "HN "))
2.800 1.000 1.000 peak 1585 volume 0.249E+08 ppm1 0.445 ppm2 9.103
ASSI
(( segid " " and resid "78 " and name "HD11")
OR
( segid " " and resid "78 " and name "HD13")
OR
( segid " " and resid "78 " and name "HD12"))
(( segid " " and resid "63 " and name "HB2 "))
2.600 0.800 0.800 peak 1587 volume 0.223E+08 ppm1 1.049 ppm2 2.661
ASSI
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
(( segid " " and resid "88 " and name "HN "))
2.900 1.100 1.100 peak 1590 volume 0.204E+08 ppm1 0.643 ppm2 8.911
ASSI
(( segid " " and resid "29 " and name "HG11")
OR
( segid " " and resid "29 " and name "HG13")
OR
( segid " " and resid "29 " and name "HG12"))
(( segid " " and resid "2 " and name "HA "))
2.800 1.000 1.000 peak 1594 volume 0.186E+08 ppm1 0.914 ppm2 5.642
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "26 " and name "HN "))
3.000 1.100 1.100 peak 1596 volume 0.182E+08 ppm1 0.445 ppm2 9.140
ASSI
(( segid " " and resid "26 " and name "HB "))
(( segid " " and resid "27 " and name "HN "))
2.900 1.100 1.100 peak 1597 volume 0.190E+08 ppm1 1.739 ppm2 9.103
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "11 " and name "HE3 "))
3.000 1.100 1.100 peak 1599 volume 0.166E+08 ppm1 2.873 ppm2 7.476
ASSI
(( segid " " and resid "41 " and name "HN "))
(( segid " " and resid "4 " and name "HE1 ")
OR
( segid " " and resid "4 " and name "HE2 "))
3.300 1.400 1.400 peak 1604 volume 0.159E+08 ppm1 7.852 ppm2 7.713
ASSI
(( segid " " and resid "8 " and name "HA "))
(( segid " " and resid "8 " and name "HN "))
3.100 1.200 1.200 peak 1606 volume 0.141E+08 ppm1 3.908 ppm2 8.859
ASSI
(( segid " " and resid "29 " and name "HG21")
OR
( segid " " and resid "29 " and name "HG23")
OR
( segid " " and resid "29 " and name "HG22"))
(( segid " " and resid "2 " and name "HA "))
3.000 1.100 1.100 peak 1613 volume 0.115E+08 ppm1 0.852 ppm2 5.635
ASSI
(( segid " " and resid "91 " and name "HG1 ")
OR
( segid " " and resid "91 " and name "HG2 "))
(( segid " " and resid "92 " and name "HN "))
3.100 1.200 1.200 peak 1615 volume 0.122E+08 ppm1 1.665 ppm2 7.484
ASSI
(( segid " " and resid "51 " and name "HD2 "))
(( segid " " and resid "50 " and name "HE1 ")
OR
( segid " " and resid "50 " and name "HE2 "))
3.700 1.700 1.700 peak 1618 volume 0.819E+07 ppm1 6.151 ppm2 6.530
ASSI
(( segid " " and resid "86 " and name "HB1 "))
(( segid " " and resid "87 " and name "HN "))
3.000 1.100 1.100 peak 1619 volume 0.154E+08 ppm1 2.380 ppm2 8.837
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "7 " and name "HN "))
3.100 1.200 1.200 peak 1624 volume 0.130E+08 ppm1 0.569 ppm2 9.725
ASSI
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
(( segid " " and resid "9 " and name "HB2 "))
3.000 1.100 1.100 peak 1630 volume 0.956E+07 ppm1 0.507 ppm2 2.528
ASSI
(( segid " " and resid "96 " and name "HN "))
(( segid " " and resid "92 " and name "HN "))
3.400 1.400 1.400 peak 1633 volume 0.116E+08 ppm1 8.099 ppm2 7.484
ASSI
(( segid " " and resid "51 " and name "HB1 "))
(( segid " " and resid "51 " and name "HD2 "))
3.600 1.600 1.600 peak 1637 volume 0.614E+07 ppm1 3.194 ppm2 6.160
ASSI
(( segid " " and resid "95 " and name "HG1 ")
OR
( segid " " and resid "95 " and name "HG2 "))
(( segid " " and resid "91 " and name "HN "))
3.400 1.400 1.400 peak 1639 volume 0.720E+07 ppm1 2.553 ppm2 9.222
ASSI
(( segid " " and resid "56 " and name "HN "))
(( segid " " and resid "57 " and name "HN "))
3.500 1.500 1.500 peak 1640 volume 0.908E+07 ppm1 8.530 ppm2 8.800
ASSI
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
(( segid " " and resid "77 " and name "HN "))
3.300 1.400 1.400 peak 1646 volume 0.964E+07 ppm1 0.630 ppm2 9.717
ASSI
(( segid " " and resid "80 " and name "HA "))
(( segid " " and resid "82 " and name "HN "))
3.500 1.500 1.500 peak 1648 volume 0.743E+07 ppm1 4.845 ppm2 7.750
ASSI
(( segid " " and resid "39 " and name "HG1 "))
(( segid " " and resid "40 " and name "HN "))
3.400 1.400 1.400 peak 1649 volume 0.772E+07 ppm1 1.715 ppm2 7.454
ASSI
(( segid " " and resid "28 " and name "HA "))
(( segid " " and resid "36 " and name "HN "))
3.400 1.400 1.400 peak 1650 volume 0.881E+07 ppm1 5.461 ppm2 8.933
ASSI
(( segid " " and resid "4 " and name "HD1 ")
OR
( segid " " and resid "4 " and name "HD2 "))
(( segid " " and resid "26 " and name "HN "))
3.700 1.700 1.700 peak 1655 volume 0.728E+07 ppm1 7.408 ppm2 9.148
ASSI
(( segid " " and resid "43 " and name "HN "))
(( segid " " and resid "45 " and name "HN "))
3.700 1.700 1.700 peak 1657 volume 0.647E+07 ppm1 8.690 ppm2 7.646
ASSI
(( segid " " and resid "80 " and name "HB2 "))
(( segid " " and resid "81 " and name "HN "))
2.500 0.800 0.800 peak 1667 volume 0.472E+08 ppm1 2.023 ppm2 9.325
ASSI
(( segid " " and resid "34 " and name "HB2 "))
(( segid " " and resid "34 " and name "HA "))
2.700 0.900 0.900 peak 1673 volume 0.236E+08 ppm1 1.998 ppm2 5.287
ASSI
(( segid " " and resid "79 " and name "HG2 "))
(( segid " " and resid "79 " and name "HA "))
2.600 0.800 0.800 peak 1675 volume 0.243E+08 ppm1 1.592 ppm2 5.280
ASSI
(( segid " " and resid "79 " and name "HB1 "))
(( segid " " and resid "79 " and name "HA "))
2.700 0.900 0.900 peak 1678 volume 0.202E+08 ppm1 1.949 ppm2 5.294
ASSI
(( segid " " and resid "9 " and name "HB1 "))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
3.300 1.400 1.400 peak 1687 volume 0.954E+07 ppm1 3.378 ppm2 6.064
ASSI
(( segid " " and resid "47 " and name "HN "))
(( segid " " and resid "45 " and name "HN "))
3.600 1.600 1.600 peak 1688 volume 0.800E+07 ppm1 7.766 ppm2 7.639
ASSI
(( segid " " and resid "24 " and name "HD1 "))
(( segid " " and resid "24 " and name "HD2 "))
3.800 1.800 1.800 peak 1690 volume 0.630E+07 ppm1 7.975 ppm2 6.848
ASSI
(( segid " " and resid "25 " and name "HA "))
(( segid " " and resid "25 " and name "HN "))
3.400 1.400 1.400 peak 1691 volume 0.818E+07 ppm1 5.387 ppm2 8.970
ASSI
(( segid " " and resid "47 " and name "HN "))
(( segid " " and resid "44 " and name "HN "))
3.700 1.700 1.700 peak 1694 volume 0.650E+07 ppm1 7.754 ppm2 7.609
ASSI
(( segid " " and resid "29 " and name "HB "))
(( segid " " and resid "38 " and name "HE1 ")
OR
( segid " " and resid "38 " and name "HE2 "))
2.200 0.600 0.600 peak 1703 volume 0.111E+09 ppm1 2.047 ppm2 6.463
ASSI
(( segid " " and resid "101 " and name "HB1 ")
OR
( segid " " and resid "101 " and name "HB2 "))
(( segid " " and resid "102 " and name "HN "))
2.300 0.700 0.700 peak 1706 volume 0.718E+08 ppm1 2.084 ppm2 7.935
ASSI
(( segid " " and resid "23 " and name "HZ2 "))
(( segid " " and resid "69 " and name "HE1 ")
OR
( segid " " and resid "69 " and name "HE2 "))
2.800 1.000 1.000 peak 1709 volume 0.267E+08 ppm1 7.014 ppm2 6.796
ASSI
(( segid " " and resid "89 " and name "HG1 ")
OR
( segid " " and resid "89 " and name "HG2 "))
(( segid " " and resid "89 " and name "HA "))
3.100 1.200 1.200 peak 1714 volume 0.102E+08 ppm1 2.725 ppm2 5.265
ASSI
(( segid " " and resid "12 " and name "HN "))
(( segid " " and resid "11 " and name "HN "))
3.800 1.800 1.800 peak 1717 volume 0.535E+07 ppm1 8.690 ppm2 7.698
ASSI
(( segid " " and resid "16 " and name "HN "))
(( segid " " and resid "17 " and name "HN "))
3.800 1.800 1.800 peak 1718 volume 0.531E+07 ppm1 7.630 ppm2 8.756
ASSI
(( segid " " and resid "2 " and name "HB1 "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
3.100 1.200 1.200 peak 1730 volume 0.148E+08 ppm1 2.121 ppm2 6.389
ASSI
(( segid " " and resid "55 " and name "HG1 "))
(( segid " " and resid "55 " and name "HG2 "))
1.600 0.300 0.300 peak 1759 volume 0.455E+09 ppm1 2.060 ppm2 1.944
ASSI
(( segid " " and resid "46 " and name "HB2 "))
(( segid " " and resid "46 " and name "HB1 "))
1.700 0.400 0.400 peak 1765 volume 0.319E+09 ppm1 3.859 ppm2 4.059
ASSI
(( segid " " and resid "49 " and name "HD1 "))
(( segid " " and resid "49 " and name "HD2 "))
1.800 0.400 0.400 peak 1777 volume 0.226E+09 ppm1 4.229 ppm2 3.860
ASSI
(( segid " " and resid "55 " and name "HD2 "))
(( segid " " and resid "55 " and name "HD1 "))
1.900 0.500 0.500 peak 1791 volume 0.141E+09 ppm1 3.650 ppm2 3.941
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB3 ")
OR
( segid " " and resid "66 " and name "HB2 "))
2.100 0.600 0.600 peak 1793 volume 0.114E+09 ppm1 4.857 ppm2 1.367
ASSI
(( segid " " and resid "56 " and name "HG21")
OR
( segid " " and resid "56 " and name "HG23")
OR
( segid " " and resid "56 " and name "HG22"))
(( segid " " and resid "56 " and name "HG11")
OR
( segid " " and resid "56 " and name "HG13")
OR
( segid " " and resid "56 " and name "HG12"))
2.100 0.600 0.600 peak 1795 volume 0.875E+08 ppm1 1.000 ppm2 1.212
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "39 " and name "HB1 "))
1.900 0.500 0.500 peak 1799 volume 0.166E+09 ppm1 1.937 ppm2 2.129
ASSI
(( segid " " and resid "90 " and name "HA "))
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
2.200 0.600 0.600 peak 1805 volume 0.918E+08 ppm1 4.931 ppm2 1.855
ASSI
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
2.100 0.600 0.600 peak 1807 volume 0.970E+08 ppm1 -0.836 ppm2 0.568
ASSI
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
2.100 0.600 0.600 peak 1808 volume 0.899E+08 ppm1 0.643 ppm2 0.376
ASSI
(( segid " " and resid "53 " and name "HB1 "))
(( segid " " and resid "53 " and name "HG1 ")
OR
( segid " " and resid "53 " and name "HG2 "))
1.900 0.500 0.500 peak 1812 volume 0.156E+09 ppm1 2.245 ppm2 2.632
ASSI
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB3 ")
OR
( segid " " and resid "61 " and name "HB2 "))
(( segid " " and resid "78 " and name "HD11")
OR
( segid " " and resid "78 " and name "HD13")
OR
( segid " " and resid "78 " and name "HD12"))
2.000 0.500 0.500 peak 1824 volume 0.124E+09 ppm1 1.382 ppm2 1.064
ASSI
(( segid " " and resid "6 " and name "HB1 "))
(( segid " " and resid "6 " and name "HB2 "))
2.000 0.500 0.500 peak 1827 volume 0.115E+09 ppm1 2.886 ppm2 2.795
ASSI
(( segid " " and resid "5 " and name "HA "))
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
2.200 0.600 0.600 peak 1844 volume 0.711E+08 ppm1 4.562 ppm2 0.568
ASSI
(( segid " " and resid "87 " and name "HA "))
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
2.200 0.600 0.600 peak 1848 volume 0.811E+08 ppm1 4.993 ppm2 0.635
ASSI
(( segid " " and resid "80 " and name "HA "))
(( segid " " and resid "80 " and name "HD21")
OR
( segid " " and resid "80 " and name "HD23")
OR
( segid " " and resid "80 " and name "HD22"))
2.300 0.700 0.700 peak 1856 volume 0.664E+08 ppm1 4.845 ppm2 1.086
ASSI
(( segid " " and resid "90 " and name "HA "))
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
2.300 0.700 0.700 peak 1863 volume 0.662E+08 ppm1 4.931 ppm2 0.568
ASSI
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "62 " and name "HG21")
OR
( segid " " and resid "62 " and name "HG23")
OR
( segid " " and resid "62 " and name "HG22"))
2.300 0.700 0.700 peak 1868 volume 0.610E+08 ppm1 4.426 ppm2 0.916
ASSI
(( segid " " and resid "80 " and name "HG "))
(( segid " " and resid "80 " and name "HD21")
OR
( segid " " and resid "80 " and name "HD23")
OR
( segid " " and resid "80 " and name "HD22"))
2.200 0.600 0.600 peak 1870 volume 0.744E+08 ppm1 1.912 ppm2 1.079
ASSI
(( segid " " and resid "81 " and name "HA "))
(( segid " " and resid "81 " and name "HB1 "))
2.200 0.600 0.600 peak 1880 volume 0.725E+08 ppm1 4.217 ppm2 4.111
ASSI
(( segid " " and resid "3 " and name "HN "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
2.700 0.900 0.900 peak 1881 volume 0.525E+08 ppm1 8.062 ppm2 6.382
ASSI
(( segid " " and resid "8 " and name "HB1 "))
(( segid " " and resid "8 " and name "HB2 "))
2.100 0.600 0.600 peak 1897 volume 0.876E+08 ppm1 0.088 ppm2 -0.955
ASSI
(( segid " " and resid "95 " and name "HG1 ")
OR
( segid " " and resid "95 " and name "HG2 "))
(( segid " " and resid "95 " and name "HB1 "))
2.100 0.600 0.600 peak 1901 volume 0.783E+08 ppm1 2.540 ppm2 2.329
ASSI
(( segid " " and resid "29 " and name "HA "))
(( segid " " and resid "29 " and name "HG21")
OR
( segid " " and resid "29 " and name "HG23")
OR
( segid " " and resid "29 " and name "HG22"))
2.400 0.700 0.700 peak 1904 volume 0.499E+08 ppm1 4.586 ppm2 0.857
ASSI
(( segid " " and resid "87 " and name "HG "))
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
2.300 0.700 0.700 peak 1908 volume 0.537E+08 ppm1 1.320 ppm2 0.376
ASSI
(( segid " " and resid "2 " and name "HG1 ")
OR
( segid " " and resid "2 " and name "HG2 "))
(( segid " " and resid "29 " and name "HG11")
OR
( segid " " and resid "29 " and name "HG13")
OR
( segid " " and resid "29 " and name "HG12"))
2.300 0.700 0.700 peak 1913 volume 0.538E+08 ppm1 2.232 ppm2 0.916
ASSI
(( segid " " and resid "77 " and name "HD1 ")
OR
( segid " " and resid "77 " and name "HD2 "))
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
2.300 0.700 0.700 peak 1921 volume 0.464E+08 ppm1 1.727 ppm2 0.642
ASSI
(( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "67 " and name "HD21")
OR
( segid " " and resid "67 " and name "HD23")
OR
( segid " " and resid "67 " and name "HD22"))
2.400 0.700 0.700 peak 1927 volume 0.452E+08 ppm1 1.604 ppm2 0.953
ASSI
(( segid " " and resid "5 " and name "HD11")
OR
( segid " " and resid "5 " and name "HD13")
OR
( segid " " and resid "5 " and name "HD12"))
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
2.500 0.800 0.800 peak 1933 volume 0.365E+08 ppm1 0.569 ppm2 1.855
ASSI
(( segid " " and resid "7 " and name "HG1 ")
OR
( segid " " and resid "7 " and name "HG2 "))
(( segid " " and resid "7 " and name "HB1 ")
OR
( segid " " and resid "7 " and name "HB2 "))
2.100 0.600 0.600 peak 1934 volume 0.728E+08 ppm1 1.136 ppm2 1.567
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "100 " and name "HG11"))
2.300 0.700 0.700 peak 1939 volume 0.505E+08 ppm1 0.766 ppm2 1.145
ASSI
(( segid " " and resid "71 " and name "HD1 ")
OR
( segid " " and resid "71 " and name "HD2 "))
(( segid " " and resid "71 " and name "HG1 ")
OR
( segid " " and resid "71 " and name "HG2 "))
2.300 0.700 0.700 peak 1950 volume 0.466E+08 ppm1 1.234 ppm2 1.826
ASSI
(( segid " " and resid "26 " and name "HA "))
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
2.600 0.800 0.800 peak 1958 volume 0.292E+08 ppm1 4.414 ppm2 0.443
ASSI
(( segid " " and resid "7 " and name "HB1 ")
OR
( segid " " and resid "7 " and name "HB2 "))
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
2.500 0.800 0.800 peak 1962 volume 0.336E+08 ppm1 1.530 ppm2 0.568
ASSI
(( segid " " and resid "8 " and name "HE2 "))
(( segid " " and resid "8 " and name "HE1 "))
2.300 0.700 0.700 peak 1964 volume 0.522E+08 ppm1 2.442 ppm2 2.698
ASSI
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
(( segid " " and resid "28 " and name "HG "))
2.500 0.800 0.800 peak 1967 volume 0.490E+08 ppm1 0.593 ppm2 2.011
ASSI
(( segid " " and resid "8 " and name "HD2 "))
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
2.600 0.800 0.800 peak 1968 volume 0.239E+08 ppm1 0.519 ppm2 0.376
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "64 " and name "HB1 ")
OR
( segid " " and resid "64 " and name "HB2 "))
2.400 0.700 0.700 peak 1969 volume 0.454E+08 ppm1 4.981 ppm2 2.218
ASSI
(( segid " " and resid "26 " and name "HA "))
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
2.700 0.900 0.900 peak 1975 volume 0.223E+08 ppm1 4.414 ppm2 0.568
ASSI
(( segid " " and resid "37 " and name "HB1 ")
OR
( segid " " and resid "37 " and name "HB2 "))
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
2.500 0.800 0.800 peak 1982 volume 0.284E+08 ppm1 2.627 ppm2 0.443
ASSI
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "24 " and name "HB1 "))
2.400 0.700 0.700 peak 1984 volume 0.400E+08 ppm1 4.919 ppm2 3.142
ASSI
(( segid " " and resid "8 " and name "HG2 "))
(( segid " " and resid "8 " and name "HG1 "))
2.300 0.700 0.700 peak 1989 volume 0.449E+08 ppm1 0.100 ppm2 0.287
ASSI
(( segid " " and resid "73 " and name "HA "))
(( segid " " and resid "73 " and name "HB1 ")
OR
( segid " " and resid "73 " and name "HB2 "))
2.500 0.800 0.800 peak 1996 volume 0.349E+08 ppm1 4.290 ppm2 0.694
ASSI
(( segid " " and resid "80 " and name "HD11")
OR
( segid " " and resid "80 " and name "HD13")
OR
( segid " " and resid "80 " and name "HD12"))
(( segid " " and resid "80 " and name "HB2 "))
2.400 0.700 0.700 peak 1999 volume 0.419E+08 ppm1 1.283 ppm2 2.025
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "57 " and name "HB1 "))
2.600 0.800 0.800 peak 2007 volume 0.286E+08 ppm1 4.623 ppm2 4.133
ASSI
(( segid " " and resid "48 " and name "HA "))
(( segid " " and resid "49 " and name "HD1 "))
2.700 0.900 0.900 peak 2011 volume 0.233E+08 ppm1 4.648 ppm2 4.237
ASSI
(( segid " " and resid "8 " and name "HB2 "))
(( segid " " and resid "8 " and name "HG1 "))
2.400 0.700 0.700 peak 2016 volume 0.360E+08 ppm1 -0.947 ppm2 0.280
ASSI
(( segid " " and resid "80 " and name "HA "))
(( segid " " and resid "80 " and name "HB2 "))
2.500 0.800 0.800 peak 2023 volume 0.319E+08 ppm1 4.845 ppm2 2.033
ASSI
(( segid " " and resid "77 " and name "HN "))
(( segid " " and resid "76 " and name "HD1 ")
OR
( segid " " and resid "76 " and name "HD2 "))
3.200 1.300 1.300 peak 2027 volume 0.186E+08 ppm1 9.701 ppm2 7.032
ASSI
(( segid " " and resid "67 " and name "HB1 "))
(( segid " " and resid "67 " and name "HD21")
OR
( segid " " and resid "67 " and name "HD23")
OR
( segid " " and resid "67 " and name "HD22"))
2.900 1.100 1.100 peak 2039 volume 0.138E+08 ppm1 1.776 ppm2 0.960
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "38 " and name "HB1 "))
2.600 0.800 0.800 peak 2046 volume 0.268E+08 ppm1 4.956 ppm2 3.246
ASSI
(( segid " " and resid "8 " and name "HG1 "))
(( segid " " and resid "8 " and name "HD2 "))
2.500 0.800 0.800 peak 2050 volume 0.283E+08 ppm1 0.285 ppm2 0.546
ASSI
(( segid " " and resid "90 " and name "HB1 ")
OR
( segid " " and resid "90 " and name "HB3 ")
OR
( segid " " and resid "90 " and name "HB2 "))
(( segid " " and resid "95 " and name "HG1 ")
OR
( segid " " and resid "95 " and name "HG2 "))
2.700 0.900 0.900 peak 2056 volume 0.182E+08 ppm1 1.850 ppm2 2.543
ASSI
(( segid " " and resid "8 " and name "HA "))
(( segid " " and resid "8 " and name "HG1 "))
2.600 0.800 0.800 peak 2062 volume 0.247E+08 ppm1 3.908 ppm2 0.280
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "54 " and name "HG11")
OR
( segid " " and resid "54 " and name "HG13")
OR
( segid " " and resid "54 " and name "HG12"))
2.800 1.000 1.000 peak 2066 volume 0.202E+08 ppm1 4.993 ppm2 1.130
ASSI
(( segid " " and resid "100 " and name "HA "))
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
3.000 1.100 1.100 peak 2075 volume 0.138E+08 ppm1 3.514 ppm2 0.761
ASSI
(( segid " " and resid "46 " and name "HA "))
(( segid " " and resid "46 " and name "HB1 "))
2.900 1.100 1.100 peak 2078 volume 0.154E+08 ppm1 4.648 ppm2 4.052
ASSI
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
2.900 1.100 1.100 peak 2084 volume 0.154E+08 ppm1 4.303 ppm2 0.494
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "30 " and name "HG21")
OR
( segid " " and resid "30 " and name "HG23")
OR
( segid " " and resid "30 " and name "HG22"))
2.900 1.100 1.100 peak 2085 volume 0.149E+08 ppm1 4.808 ppm2 0.768
ASSI
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "62 " and name "HD11")
OR
( segid " " and resid "62 " and name "HD13")
OR
( segid " " and resid "62 " and name "HD12"))
3.000 1.100 1.100 peak 2088 volume 0.117E+08 ppm1 4.426 ppm2 0.872
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "28 " and name "HG "))
2.900 1.100 1.100 peak 2091 volume 0.178E+08 ppm1 0.445 ppm2 2.003
ASSI
(( segid " " and resid "80 " and name "HA "))
(( segid " " and resid "80 " and name "HB1 "))
2.700 0.900 0.900 peak 2092 volume 0.208E+08 ppm1 4.845 ppm2 2.336
ASSI
(( segid " " and resid "80 " and name "HA "))
(( segid " " and resid "80 " and name "HD11")
OR
( segid " " and resid "80 " and name "HD13")
OR
( segid " " and resid "80 " and name "HD12"))
3.200 1.300 1.300 peak 2098 volume 0.872E+07 ppm1 4.845 ppm2 1.278
ASSI
(( segid " " and resid "8 " and name "HB1 "))
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
2.800 1.000 1.000 peak 2104 volume 0.163E+08 ppm1 0.088 ppm2 0.376
ASSI
(( segid " " and resid "35 " and name "HG1 "))
(( segid " " and resid "56 " and name "HB "))
2.700 0.900 0.900 peak 2109 volume 0.176E+08 ppm1 1.776 ppm2 2.284
ASSI
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "17 " and name "HG1 "))
3.000 1.100 1.100 peak 2113 volume 0.106E+08 ppm1 3.674 ppm2 0.968
ASSI
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
2.900 1.100 1.100 peak 2115 volume 0.147E+08 ppm1 3.674 ppm2 0.487
ASSI
(( segid " " and resid "24 " and name "HN "))
(( segid " " and resid "24 " and name "HD2 "))
3.500 1.500 1.500 peak 2117 volume 0.103E+08 ppm1 9.048 ppm2 6.848
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "50 " and name "HB1 "))
2.800 1.000 1.000 peak 2118 volume 0.177E+08 ppm1 4.956 ppm2 2.565
ASSI
(( segid " " and resid "5 " and name "HA "))
(( segid " " and resid "5 " and name "HD21")
OR
( segid " " and resid "5 " and name "HD23")
OR
( segid " " and resid "5 " and name "HD22"))
3.000 1.100 1.100 peak 2123 volume 0.117E+08 ppm1 4.562 ppm2 -0.844
ASSI
(( segid " " and resid "87 " and name "HB1 "))
(( segid " " and resid "8 " and name "HB1 "))
2.700 0.900 0.900 peak 2125 volume 0.196E+08 ppm1 1.037 ppm2 0.095
ASSI
(( segid " " and resid "64 " and name "HB1 ")
OR
( segid " " and resid "64 " and name "HB2 "))
(( segid " " and resid "77 " and name "HG1 ")
OR
( segid " " and resid "77 " and name "HG2 "))
2.800 1.000 1.000 peak 2128 volume 0.129E+08 ppm1 2.257 ppm2 1.456
ASSI
(( segid " " and resid "77 " and name "HB1 "))
(( segid " " and resid "77 " and name "HE1 ")
OR
( segid " " and resid "77 " and name "HE2 "))
2.900 1.100 1.100 peak 2134 volume 0.126E+08 ppm1 1.850 ppm2 2.684
ASSI
(( segid " " and resid "8 " and name "HB2 "))
(( segid " " and resid "8 " and name "HD2 "))
2.900 1.100 1.100 peak 2142 volume 0.113E+08 ppm1 -0.947 ppm2 0.539
ASSI
(( segid " " and resid "63 " and name "HB2 "))
(( segid " " and resid "100 " and name "HG21")
OR
( segid " " and resid "100 " and name "HG23")
OR
( segid " " and resid "100 " and name "HG22"))
3.000 1.100 1.100 peak 2143 volume 0.106E+08 ppm1 2.627 ppm2 0.805
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "65 " and name "HG11")
OR
( segid " " and resid "65 " and name "HG13")
OR
( segid " " and resid "65 " and name "HG12"))
3.400 1.400 1.400 peak 2144 volume 0.651E+07 ppm1 4.981 ppm2 1.204
ASSI
(( segid " " and resid "17 " and name "HB1 ")
OR
( segid " " and resid "17 " and name "HB2 "))
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB3 ")
OR
( segid " " and resid "18 " and name "HB2 "))
3.200 1.300 1.300 peak 2148 volume 0.730E+07 ppm1 1.407 ppm2 0.487
ASSI
(( segid " " and resid "39 " and name "HN "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
3.600 1.600 1.600 peak 2156 volume 0.952E+07 ppm1 10.107 ppm2 6.759
ASSI
(( segid " " and resid "28 " and name "HN "))
(( segid " " and resid "27 " and name "HD1 ")
OR
( segid " " and resid "27 " and name "HD2 "))
3.600 1.600 1.600 peak 2164 volume 0.933E+07 ppm1 8.493 ppm2 5.561
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "38 " and name "HB2 "))
3.000 1.100 1.100 peak 2165 volume 0.118E+08 ppm1 4.968 ppm2 2.809
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "29 " and name "HG21")
OR
( segid " " and resid "29 " and name "HG23")
OR
( segid " " and resid "29 " and name "HG22"))
3.400 1.400 1.400 peak 2166 volume 0.547E+07 ppm1 4.783 ppm2 0.849
ASSI
(( segid " " and resid "87 " and name "HA "))
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
3.200 1.300 1.300 peak 2175 volume 0.796E+07 ppm1 4.993 ppm2 0.383
ASSI
(( segid " " and resid "80 " and name "HA "))
(( segid " " and resid "81 " and name "HA "))
3.300 1.400 1.400 peak 2183 volume 0.782E+07 ppm1 4.845 ppm2 4.222
ASSI
(( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
3.400 1.400 1.400 peak 2192 volume 0.533E+07 ppm1 2.935 ppm2 0.443
ASSI
(( segid " " and resid "8 " and name "HD1 "))
(( segid " " and resid "8 " and name "HB2 "))
2.800 1.000 1.000 peak 2196 volume 0.134E+08 ppm1 0.753 ppm2 -0.963
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "8 " and name "HB2 "))
3.300 1.400 1.400 peak 2214 volume 0.631E+07 ppm1 0.371 ppm2 -0.948
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "7 " and name "HB1 ")
OR
( segid " " and resid "7 " and name "HB2 "))
3.100 1.200 1.200 peak 2218 volume 0.918E+07 ppm1 4.993 ppm2 1.559
ASSI
(( segid " " and resid "87 " and name "HA "))
(( segid " " and resid "87 " and name "HG "))
3.100 1.200 1.200 peak 2222 volume 0.930E+07 ppm1 5.005 ppm2 1.323
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "85 " and name "HB2 "))
3.100 1.200 1.200 peak 2223 volume 0.703E+07 ppm1 2.886 ppm2 2.025
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "7 " and name "HB1 ")
OR
( segid " " and resid "7 " and name "HB2 "))
3.100 1.200 1.200 peak 2234 volume 0.803E+07 ppm1 0.445 ppm2 1.574
ASSI
(( segid " " and resid "89 " and name "HN "))
(( segid " " and resid "23 " and name "HE3 "))
3.700 1.700 1.700 peak 2250 volume 0.757E+07 ppm1 9.614 ppm2 6.936
ASSI
(( segid " " and resid "26 " and name "HG21")
OR
( segid " " and resid "26 " and name "HG23")
OR
( segid " " and resid "26 " and name "HG22"))
(( segid " " and resid "27 " and name "HB2 "))
3.300 1.400 1.400 peak 2252 volume 0.613E+07 ppm1 0.445 ppm2 1.937
ASSI
(( segid " " and resid "26 " and name "HA "))
(( segid " " and resid "27 " and name "HA "))
3.300 1.400 1.400 peak 2253 volume 0.721E+07 ppm1 4.414 ppm2 4.089
ASSI
(( segid " " and resid "86 " and name "HN "))
(( segid " " and resid "86 " and name "HE1 ")
OR
( segid " " and resid "86 " and name "HE2 "))
3.900 1.900 1.900 peak 2275 volume 0.553E+07 ppm1 9.245 ppm2 6.056
ASSI
(( segid " " and resid "4 " and name "HZ "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
3.900 1.900 1.900 peak 2293 volume 0.675E+07 ppm1 7.556 ppm2 6.382
ASSI
(( segid " " and resid "8 " and name "HE1 "))
(( segid " " and resid "8 " and name "HG1 "))
3.100 1.200 1.200 peak 2309 volume 0.727E+07 ppm1 2.688 ppm2 0.273
ASSI
(( segid " " and resid "28 " and name "HB1 "))
(( segid " " and resid "5 " and name "HB1 "))
3.200 1.300 1.300 peak 2322 volume 0.645E+07 ppm1 2.787 ppm2 1.515
ASSI
(( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "67 " and name "HB1 "))
1.500 0.300 0.300 peak 2359 volume 0.510E+09 ppm1 1.604 ppm2 1.774
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "58 " and name "HD21")
OR
( segid " " and resid "58 " and name "HD23")
OR
( segid " " and resid "58 " and name "HD22"))
2.100 0.600 0.600 peak 2375 volume 0.104E+09 ppm1 4.426 ppm2 0.790
ASSI
(( segid " " and resid "71 " and name "HG1 ")
OR
( segid " " and resid "71 " and name "HG2 "))
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
1.900 0.500 0.500 peak 2378 volume 0.146E+09 ppm1 1.826 ppm2 1.515
ASSI
(( segid " " and resid "56 " and name "HG21")
OR
( segid " " and resid "56 " and name "HG23")
OR
( segid " " and resid "56 " and name "HG22"))
(( segid " " and resid "80 " and name "HD11")
OR
( segid " " and resid "80 " and name "HD13")
OR
( segid " " and resid "80 " and name "HD12"))
2.200 0.600 0.600 peak 2382 volume 0.695E+08 ppm1 1.000 ppm2 1.278
ASSI
(( segid " " and resid "70 " and name "HE1 ")
OR
( segid " " and resid "70 " and name "HE2 "))
(( segid " " and resid "70 " and name "HD1 "))
2.100 0.600 0.600 peak 2386 volume 0.736E+08 ppm1 2.984 ppm2 1.648
ASSI
(( segid " " and resid "77 " and name "HG1 ")
OR
( segid " " and resid "77 " and name "HG2 "))
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
2.500 0.800 0.800 peak 2409 volume 0.291E+08 ppm1 1.456 ppm2 0.642
ASSI
(( segid " " and resid "89 " and name "HG1 ")
OR
( segid " " and resid "89 " and name "HG2 "))
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
2.400 0.700 0.700 peak 2410 volume 0.433E+08 ppm1 2.738 ppm2 0.775
ASSI
(( segid " " and resid "17 " and name "HD1 ")
OR
( segid " " and resid "17 " and name "HD2 "))
(( segid " " and resid "17 " and name "HG2 "))
2.500 0.800 0.800 peak 2416 volume 0.318E+08 ppm1 1.148 ppm2 0.812
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
2.600 0.800 0.800 peak 2417 volume 0.265E+08 ppm1 0.371 ppm2 0.820
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "31 " and name "HB1 "))
2.500 0.800 0.800 peak 2419 volume 0.308E+08 ppm1 4.808 ppm2 2.691
ASSI
(( segid " " and resid "4 " and name "HN "))
(( segid " " and resid "27 " and name "HE1 ")
OR
( segid " " and resid "27 " and name "HE2 "))
3.100 1.200 1.200 peak 2422 volume 0.241E+08 ppm1 8.875 ppm2 6.382
ASSI
(( segid " " and resid "91 " and name "HD1 ")
OR
( segid " " and resid "91 " and name "HD2 "))
(( segid " " and resid "91 " and name "HB1 "))
2.400 0.700 0.700 peak 2423 volume 0.403E+08 ppm1 1.419 ppm2 1.951
ASSI
(( segid " " and resid "2 " and name "HG1 ")
OR
( segid " " and resid "2 " and name "HG2 "))
(( segid " " and resid "29 " and name "HG21")
OR
( segid " " and resid "29 " and name "HG23")
OR
( segid " " and resid "29 " and name "HG22"))
2.700 0.900 0.900 peak 2425 volume 0.208E+08 ppm1 2.257 ppm2 0.857
ASSI
(( segid " " and resid "7 " and name "HD1 ")
OR
( segid " " and resid "7 " and name "HD2 "))
(( segid " " and resid "26 " and name "HG11")
OR
( segid " " and resid "26 " and name "HG13")
OR
( segid " " and resid "26 " and name "HG12"))
2.600 0.800 0.800 peak 2427 volume 0.229E+08 ppm1 2.651 ppm2 0.568
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB3 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "75 " and name "HB "))
2.500 0.800 0.800 peak 2444 volume 0.314E+08 ppm1 1.357 ppm2 2.122
ASSI
(( segid " " and resid "104 " and name "HA "))
(( segid " " and resid "103 " and name "HG21")
OR
( segid " " and resid "103 " and name "HG23")
OR
( segid " " and resid "103 " and name "HG22"))
2.900 1.100 1.100 peak 2450 volume 0.140E+08 ppm1 4.352 ppm2 0.931
ASSI
(( segid " " and resid "63 " and name "HB1 "))
(( segid " " and resid "63 " and name "HG "))
3.100 1.200 1.200 peak 2460 volume 0.133E+08 ppm1 2.787 ppm2 1.885
ASSI
(( segid " " and resid "95 " and name "HN "))
(( segid " " and resid "92 " and name "HN "))
3.400 1.400 1.400 peak 2467 volume 0.109E+08 ppm1 9.356 ppm2 7.484
ASSI
(( segid " " and resid "8 " and name "HN "))
(( segid " " and resid "23 " and name "HZ3 "))
3.100 1.200 1.200 peak 2477 volume 0.134E+08 ppm1 8.850 ppm2 6.596
ASSI
(( segid " " and resid "56 " and name "HB "))
(( segid " " and resid "35 " and name "HG2 "))
2.800 1.000 1.000 peak 2478 volume 0.157E+08 ppm1 2.294 ppm2 1.670
ASSI
(( segid " " and resid "23 " and name "HE3 "))
(( segid " " and resid "6 " and name "HA "))
3.200 1.300 1.300 peak 2481 volume 0.134E+08 ppm1 6.940 ppm2 5.583
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "8 " and name "HB2 "))
3.000 1.100 1.100 peak 2487 volume 0.116E+08 ppm1 4.648 ppm2 -0.955
ASSI
(( segid " " and resid "24 " and name "HN "))
(( segid " " and resid "6 " and name "HA "))
3.500 1.500 1.500 peak 2494 volume 0.683E+07 ppm1 9.048 ppm2 5.590
ASSI
(( segid " " and resid "7 " and name "HG1 ")
OR
( segid " " and resid "7 " and name "HG2 "))
(( segid " " and resid "86 " and name "HB2 "))
3.000 1.100 1.100 peak 2496 volume 0.932E+07 ppm1 1.148 ppm2 2.011
ASSI
(( segid " " and resid "22 " and name "HB1 "))
(( segid " " and resid "22 " and name "HB2 "))
1.900 0.500 0.500 peak 2537 volume 0.146E+09 ppm1 3.871 ppm2 3.749
ASSI
(( segid " " and resid "75 " and name "HB "))
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
2.000 0.500 0.500 peak 2545 volume 0.109E+09 ppm1 2.121 ppm2 0.775
ASSI
(( segid " " and resid "73 " and name "HG1 "))
(( segid " " and resid "73 " and name "HG2 "))
1.900 0.500 0.500 peak 2549 volume 0.142E+09 ppm1 1.579 ppm2 1.323
ASSI
(( segid " " and resid "100 " and name "HG11"))
(( segid " " and resid "100 " and name "HG12"))
2.000 0.500 0.500 peak 2559 volume 0.111E+09 ppm1 1.160 ppm2 0.613
ASSI
(( segid " " and resid "62 " and name "HG12"))
(( segid " " and resid "62 " and name "HD11")
OR
( segid " " and resid "62 " and name "HD13")
OR
( segid " " and resid "62 " and name "HD12"))
2.300 0.700 0.700 peak 2565 volume 0.485E+08 ppm1 1.234 ppm2 0.864
ASSI
(( segid " " and resid "100 " and name "HG21")
OR
( segid " " and resid "100 " and name "HG23")
OR
( segid " " and resid "100 " and name "HG22"))
(( segid " " and resid "100 " and name "HG12"))
2.500 0.800 0.800 peak 2575 volume 0.303E+08 ppm1 0.827 ppm2 0.635
ASSI
(( segid " " and resid "48 " and name "HD11")
OR
( segid " " and resid "48 " and name "HD13")
OR
( segid " " and resid "48 " and name "HD12"))
(( segid " " and resid "48 " and name "HB "))
2.300 0.700 0.700 peak 2584 volume 0.510E+08 ppm1 0.938 ppm2 1.922
ASSI
(( segid " " and resid "100 " and name "HD11")
OR
( segid " " and resid "100 " and name "HD13")
OR
( segid " " and resid "100 " and name "HD12"))
(( segid " " and resid "100 " and name "HG12"))
2.500 0.800 0.800 peak 2590 volume 0.341E+08 ppm1 0.753 ppm2 0.605
ASSI
(( segid " " and resid "8 " and name "HD1 "))
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
2.600 0.800 0.800 peak 2598 volume 0.242E+08 ppm1 0.741 ppm2 0.376
ASSI
(( segid " " and resid "104 " and name "HA "))
(( segid " " and resid "104 " and name "HB1 "))
2.500 0.800 0.800 peak 2600 volume 0.370E+08 ppm1 4.352 ppm2 4.044
ASSI
(( segid " " and resid "73 " and name "HG2 "))
(( segid " " and resid "73 " and name "HB1 ")
OR
( segid " " and resid "73 " and name "HB2 "))
2.400 0.700 0.700 peak 2602 volume 0.364E+08 ppm1 1.320 ppm2 0.701
ASSI
(( segid " " and resid "73 " and name "HD1 ")
OR
( segid " " and resid "73 " and name "HD2 "))
(( segid " " and resid "73 " and name "HB1 ")
OR
( segid " " and resid "73 " and name "HB2 "))
2.400 0.700 0.700 peak 2607 volume 0.327E+08 ppm1 1.246 ppm2 0.701
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "87 " and name "HB1 "))
2.600 0.800 0.800 peak 2610 volume 0.252E+08 ppm1 0.371 ppm2 1.057
ASSI
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "22 " and name "HB2 "))
2.700 0.900 0.900 peak 2613 volume 0.220E+08 ppm1 4.537 ppm2 3.749
ASSI
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "24 " and name "HB2 "))
2.600 0.800 0.800 peak 2616 volume 0.254E+08 ppm1 4.919 ppm2 2.928
ASSI
(( segid " " and resid "99 " and name "HB2 "))
(( segid " " and resid "103 " and name "HD11")
OR
( segid " " and resid "103 " and name "HD13")
OR
( segid " " and resid "103 " and name "HD12"))
2.700 0.900 0.900 peak 2617 volume 0.212E+08 ppm1 2.701 ppm2 0.886
ASSI
(( segid " " and resid "96 " and name "HE1 ")
OR
( segid " " and resid "96 " and name "HE3 ")
OR
( segid " " and resid "96 " and name "HE2 "))
(( segid " " and resid "65 " and name "HG11")
OR
( segid " " and resid "65 " and name "HG13")
OR
( segid " " and resid "65 " and name "HG12"))
2.900 1.100 1.100 peak 2620 volume 0.133E+08 ppm1 1.887 ppm2 1.197
ASSI
(( segid " " and resid "63 " and name "HB1 "))
(( segid " " and resid "78 " and name "HD11")
OR
( segid " " and resid "78 " and name "HD13")
OR
( segid " " and resid "78 " and name "HD12"))
2.900 1.100 1.100 peak 2623 volume 0.121E+08 ppm1 2.775 ppm2 1.064
ASSI
(( segid " " and resid "80 " and name "HA "))
(( segid " " and resid "80 " and name "HG "))
2.800 1.000 1.000 peak 2633 volume 0.177E+08 ppm1 4.833 ppm2 1.907
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "69 " and name "HB2 "))
3.100 1.200 1.200 peak 2636 volume 0.999E+07 ppm1 4.857 ppm2 2.906
ASSI
(( segid " " and resid "50 " and name "HN "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
3.800 1.800 1.800 peak 2646 volume 0.661E+07 ppm1 8.678 ppm2 6.766
ASSI
(( segid " " and resid "99 " and name "HB1 "))
(( segid " " and resid "100 " and name "HG11"))
3.300 1.400 1.400 peak 2654 volume 0.582E+07 ppm1 2.947 ppm2 1.138
ASSI
(( segid " " and resid "51 " and name "HN "))
(( segid " " and resid "50 " and name "HD1 ")
OR
( segid " " and resid "50 " and name "HD2 "))
3.800 1.800 1.800 peak 2663 volume 0.615E+07 ppm1 8.937 ppm2 6.759
ASSI
(( segid " " and resid "17 " and name "HG1 "))
(( segid " " and resid "17 " and name "HG2 "))
1.800 0.400 0.400 peak 2684 volume 0.211E+09 ppm1 0.975 ppm2 0.783
ASSI
(( segid " " and resid "54 " and name "HB "))
(( segid " " and resid "54 " and name "HG21")
OR
( segid " " and resid "54 " and name "HG23")
OR
( segid " " and resid "54 " and name "HG22"))
2.000 0.500 0.500 peak 2685 volume 0.121E+09 ppm1 2.294 ppm2 1.034
ASSI
(( segid " " and resid "56 " and name "HB "))
(( segid " " and resid "56 " and name "HG21")
OR
( segid " " and resid "56 " and name "HG23")
OR
( segid " " and resid "56 " and name "HG22"))
2.100 0.600 0.600 peak 2691 volume 0.947E+08 ppm1 2.319 ppm2 0.997
ASSI
(( segid " " and resid "103 " and name "HA "))
(( segid " " and resid "103 " and name "HG21")
OR
( segid " " and resid "103 " and name "HG23")
OR
( segid " " and resid "103 " and name "HG22"))
2.200 0.600 0.600 peak 2696 volume 0.735E+08 ppm1 3.576 ppm2 0.931
ASSI
(( segid " " and resid "77 " and name "HB1 "))
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
2.600 0.800 0.800 peak 2711 volume 0.276E+08 ppm1 1.850 ppm2 0.635
ASSI
(( segid " " and resid "63 " and name "HB2 "))
(( segid " " and resid "63 " and name "HG "))
2.700 0.900 0.900 peak 2716 volume 0.243E+08 ppm1 2.651 ppm2 1.892
ASSI
(( segid " " and resid "63 " and name "HG "))
(( segid " " and resid "100 " and name "HG12"))
2.700 0.900 0.900 peak 2720 volume 0.259E+08 ppm1 1.912 ppm2 0.620
ASSI
(( segid " " and resid "96 " and name "HE1 ")
OR
( segid " " and resid "96 " and name "HE3 ")
OR
( segid " " and resid "96 " and name "HE2 "))
(( segid " " and resid "65 " and name "HG21")
OR
( segid " " and resid "65 " and name "HG23")
OR
( segid " " and resid "65 " and name "HG22"))
3.300 1.400 1.400 peak 2750 volume 0.625E+07 ppm1 1.850 ppm2 1.145
ASSI
(( segid " " and resid "7 " and name "HN "))
(( segid " " and resid "25 " and name "HA "))
3.300 1.400 1.400 peak 2751 volume 0.108E+08 ppm1 9.725 ppm2 5.383
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "65 " and name "HA "))
3.200 1.300 1.300 peak 2754 volume 0.941E+07 ppm1 4.981 ppm2 3.956
ASSI
(( segid " " and resid "69 " and name "HB1 "))
(( segid " " and resid "75 " and name "HG21")
OR
( segid " " and resid "75 " and name "HG23")
OR
( segid " " and resid "75 " and name "HG22"))
3.200 1.300 1.300 peak 2757 volume 0.666E+07 ppm1 3.268 ppm2 0.768
ASSI
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "25 " and name "HB1 ")
OR
( segid " " and resid "25 " and name "HB2 "))
3.300 1.400 1.400 peak 2764 volume 0.668E+07 ppm1 4.919 ppm2 2.750
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "8 " and name "HA "))
3.300 1.400 1.400 peak 2768 volume 0.799E+07 ppm1 5.005 ppm2 3.919
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "20 " and name "HB2 "))
2.100 0.600 0.600 peak 2803 volume 0.105E+09 ppm1 4.611 ppm2 3.934
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "57 " and name "HB2 "))
2.200 0.600 0.600 peak 2804 volume 0.754E+08 ppm1 4.611 ppm2 3.963
ASSI
(( segid " " and resid "64 " and name "HB1 ")
OR
( segid " " and resid "64 " and name "HB2 "))
(( segid " " and resid "77 " and name "HB2 "))
2.400 0.700 0.700 peak 2815 volume 0.319E+08 ppm1 2.232 ppm2 1.744
ASSI
(( segid " " and resid "71 " and name "HE1 ")
OR
( segid " " and resid "71 " and name "HE2 "))
(( segid " " and resid "71 " and name "HD1 ")
OR
( segid " " and resid "71 " and name "HD2 "))
2.500 0.800 0.800 peak 2818 volume 0.266E+08 ppm1 2.935 ppm2 1.249
ASSI
(( segid " " and resid "69 " and name "HB2 "))
(( segid " " and resid "75 " and name "HG11")
OR
( segid " " and resid "75 " and name "HG13")
OR
( segid " " and resid "75 " and name "HG12"))
3.000 1.100 1.100 peak 2825 volume 0.111E+08 ppm1 2.910 ppm2 0.820
ASSI
(( segid " " and resid "87 " and name "HA "))
(( segid " " and resid "87 " and name "HB1 "))
2.900 1.100 1.100 peak 2826 volume 0.139E+08 ppm1 5.005 ppm2 1.057
ASSI
(( segid " " and resid "76 " and name "HB2 "))
(( segid " " and resid "96 " and name "HG1 "))
3.300 1.400 1.400 peak 2851 volume 0.525E+07 ppm1 2.996 ppm2 2.417
ASSI
(( segid " " and resid "48 " and name "HG12"))
(( segid " " and resid "48 " and name "HD11")
OR
( segid " " and resid "48 " and name "HD13")
OR
( segid " " and resid "48 " and name "HD12"))
1.800 0.400 0.400 peak 2859 volume 0.193E+09 ppm1 1.111 ppm2 0.931
ASSI
(( segid " " and resid "58 " and name "HG "))
(( segid " " and resid "58 " and name "HD11")
OR
( segid " " and resid "58 " and name "HD13")
OR
( segid " " and resid "58 " and name "HD12"))
2.000 0.500 0.500 peak 2861 volume 0.133E+09 ppm1 1.579 ppm2 0.812
ASSI
(( segid " " and resid "58 " and name "HG "))
(( segid " " and resid "58 " and name "HD21")
OR
( segid " " and resid "58 " and name "HD23")
OR
( segid " " and resid "58 " and name "HD22"))
2.100 0.600 0.600 peak 2862 volume 0.101E+09 ppm1 1.579 ppm2 0.790
ASSI
(( segid " " and resid "87 " and name "HB1 "))
(( segid " " and resid "87 " and name "HD11")
OR
( segid " " and resid "87 " and name "HD13")
OR
( segid " " and resid "87 " and name "HD12"))
2.600 0.800 0.800 peak 2864 volume 0.246E+08 ppm1 1.049 ppm2 0.635
ASSI
(( segid " " and resid "87 " and name "HD21")
OR
( segid " " and resid "87 " and name "HD23")
OR
( segid " " and resid "87 " and name "HD22"))
(( segid " " and resid "87 " and name "HB2 "))
2.700 0.900 0.900 peak 2873 volume 0.192E+08 ppm1 0.371 ppm2 0.990
ASSI
(( segid " " and resid "87 " and name "HA "))
(( segid " " and resid "87 " and name "HB2 "))
2.800 1.000 1.000 peak 2874 volume 0.188E+08 ppm1 5.005 ppm2 1.005
ASSI
(( segid " " and resid "49 " and name "HG1 ")
OR
( segid " " and resid "49 " and name "HG2 "))
(( segid " " and resid "49 " and name "HB1 ")
OR
( segid " " and resid "49 " and name "HB2 "))
1.900 0.500 0.500 peak 2894 volume 0.168E+09 ppm1 2.023 ppm2 2.343
ASSI
(( segid " " and resid "99 " and name "HA "))
(( segid " " and resid "30 " and name "HD11")
OR
( segid " " and resid "30 " and name "HD13")
OR
( segid " " and resid "30 " and name "HD12"))
3.200 1.300 1.300 peak 2902 volume 0.822E+07 ppm1 3.859 ppm2 0.805
Contact the webmaster for help, if required. Saturday, April 27, 2024 11:56:59 PM GMT (wattos1)