NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | in_recoord | stage | position | program | type | subtype | subsubtype |
|
|
13716 |
1vih   |
cing | recoord | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
ASSI
(( segid " " and resid "38 " and name "HE22"))
(( segid " " and resid "38 " and name "HE21"))
1.500 0.300 0.300 peak 16 volume 0.104E+08 ppm1 6.687 ppm2 6.865
ASSI
(( segid " " and resid "60 " and name "HB2 "))
(( segid " " and resid "60 " and name "HB1 "))
1.700 0.400 0.400 peak 18 volume 0.964E+07 ppm1 2.613 ppm2 2.830
ASSI
(( segid " " and resid "15 " and name "HB2 "))
(( segid " " and resid "15 " and name "HB1 "))
1.700 0.400 0.400 peak 20 volume 0.912E+07 ppm1 2.422 ppm2 2.633
ASSI
(( segid " " and resid "52 " and name "HB2 "))
(( segid " " and resid "52 " and name "HB1 "))
1.700 0.400 0.400 peak 27 volume 0.740E+07 ppm1 3.452 ppm2 3.670
ASSI
(( segid " " and resid "49 " and name "HB2 "))
(( segid " " and resid "49 " and name "HB1 "))
1.800 0.400 0.400 peak 34 volume 0.623E+07 ppm1 3.853 ppm2 4.024
ASSI
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
1.800 0.400 0.400 peak 37 volume 0.563E+07 ppm1 6.589 ppm2 7.055
ASSI
(( segid " " and resid "47 " and name "HG2 "))
(( segid " " and resid "47 " and name "HG1 "))
1.800 0.400 0.400 peak 43 volume 0.527E+07 ppm1 1.904 ppm2 1.990
ASSI
(( segid " " and resid "29 " and name "HA2 "))
(( segid " " and resid "29 " and name "HA1 "))
2.000 0.500 0.500 peak 44 volume 0.523E+07 ppm1 3.649 ppm2 3.945
ASSI
(( segid " " and resid "15 " and name "HD22"))
(( segid " " and resid "15 " and name "HD21"))
1.700 0.400 0.400 peak 46 volume 0.519E+07 ppm1 6.773 ppm2 7.233
ASSI
(( segid " " and resid "66 " and name "HE22"))
(( segid " " and resid "66 " and name "HE21"))
1.800 0.400 0.400 peak 50 volume 0.481E+07 ppm1 6.792 ppm2 7.344
ASSI
(( segid " " and resid "12 " and name "HA "))
(( segid " " and resid "13 " and name "HN "))
1.900 0.500 0.500 peak 53 volume 0.449E+07 ppm1 4.227 ppm2 8.374
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "39 " and name "HB1 "))
1.900 0.500 0.500 peak 54 volume 0.445E+07 ppm1 2.508 ppm2 3.230
ASSI
(( segid " " and resid "54 " and name "HA "))
(( segid " " and resid "55 " and name "HN "))
2.000 0.500 0.500 peak 63 volume 0.406E+07 ppm1 4.627 ppm2 8.840
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "58 " and name "HN "))
2.000 0.500 0.500 peak 65 volume 0.402E+07 ppm1 4.909 ppm2 8.486
ASSI
(( segid " " and resid "20 " and name "HB2 "))
(( segid " " and resid "20 " and name "HB1 "))
1.900 0.500 0.500 peak 66 volume 0.401E+07 ppm1 2.928 ppm2 3.302
ASSI
(( segid " " and resid "53 " and name "HD22"))
(( segid " " and resid "53 " and name "HD21"))
1.800 0.400 0.400 peak 67 volume 0.397E+07 ppm1 6.877 ppm2 7.449
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "59 " and name "HN "))
2.000 0.500 0.500 peak 68 volume 0.393E+07 ppm1 5.336 ppm2 8.341
ASSI
(( segid " " and resid "40 " and name "HA "))
(( segid " " and resid "40 " and name "HN "))
2.000 0.500 0.500 peak 69 volume 0.386E+07 ppm1 4.089 ppm2 7.712
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "44 " and name "HN "))
2.000 0.500 0.500 peak 72 volume 0.380E+07 ppm1 4.561 ppm2 9.116
ASSI
(( segid " " and resid "44 " and name "HG2 "))
(( segid " " and resid "44 " and name "HG1 "))
1.900 0.500 0.500 peak 76 volume 0.372E+07 ppm1 1.215 ppm2 1.465
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "14 " and name "HN "))
2.000 0.500 0.500 peak 77 volume 0.371E+07 ppm1 5.250 ppm2 8.866
ASSI
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "67 " and name "HN "))
1.900 0.500 0.500 peak 83 volume 0.354E+07 ppm1 1.064 ppm2 8.243
ASSI
(( segid " " and resid "21 " and name "HB2 "))
(( segid " " and resid "21 " and name "HB1 "))
2.000 0.500 0.500 peak 84 volume 0.354E+07 ppm1 2.960 ppm2 3.158
ASSI
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
1.900 0.500 0.500 peak 85 volume 0.350E+07 ppm1 0.789 ppm2 7.055
ASSI
(( segid " " and resid "55 " and name "HA "))
(( segid " " and resid "56 " and name "HN "))
2.000 0.500 0.500 peak 87 volume 0.344E+07 ppm1 4.305 ppm2 7.574
ASSI
(( segid " " and resid "53 " and name "HB2 "))
(( segid " " and resid "53 " and name "HB1 "))
2.000 0.500 0.500 peak 88 volume 0.339E+07 ppm1 2.632 ppm2 2.928
ASSI
(( segid " " and resid "11 " and name "HA "))
(( segid " " and resid "12 " and name "HN "))
2.000 0.500 0.500 peak 89 volume 0.337E+07 ppm1 5.513 ppm2 8.768
ASSI
(( segid " " and resid "56 " and name "HG2 "))
(( segid " " and resid "56 " and name "HB1 ")
OR
( segid " " and resid "56 " and name "HB2 "))
2.000 0.500 0.500 peak 91 volume 0.330E+07 ppm1 1.353 ppm2 1.623
ASSI
(( segid " " and resid "56 " and name "HA "))
(( segid " " and resid "57 " and name "HN "))
2.000 0.500 0.500 peak 92 volume 0.327E+07 ppm1 5.139 ppm2 8.932
ASSI
(( segid " " and resid "15 " and name "HA "))
(( segid " " and resid "16 " and name "HN "))
2.000 0.500 0.500 peak 94 volume 0.324E+07 ppm1 5.198 ppm2 8.722
ASSI
(( segid " " and resid "46 " and name "HG1 ")
OR
( segid " " and resid "46 " and name "HG2 "))
(( segid " " and resid "46 " and name "HB1 ")
OR
( segid " " and resid "46 " and name "HB2 "))
2.000 0.500 0.500 peak 96 volume 0.324E+07 ppm1 2.048 ppm2 2.246
ASSI
(( segid " " and resid "30 " and name "HB1 ")
OR
( segid " " and resid "30 " and name "HB3 ")
OR
( segid " " and resid "30 " and name "HB2 "))
(( segid " " and resid "30 " and name "HA "))
2.000 0.500 0.500 peak 97 volume 0.322E+07 ppm1 1.392 ppm2 4.037
ASSI
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
(( segid " " and resid "43 " and name "HB "))
2.000 0.500 0.500 peak 99 volume 0.305E+07 ppm1 0.657 ppm2 1.708
ASSI
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
(( segid " " and resid "71 " and name "HN "))
2.000 0.500 0.500 peak 105 volume 0.284E+07 ppm1 1.661 ppm2 8.309
ASSI
(( segid " " and resid "57 " and name "HG12"))
(( segid " " and resid "57 " and name "HB "))
2.000 0.500 0.500 peak 107 volume 0.280E+07 ppm1 0.533 ppm2 1.577
ASSI
(( segid " " and resid "16 " and name "HD11")
OR
( segid " " and resid "16 " and name "HD13")
OR
( segid " " and resid "16 " and name "HD12"))
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
1.900 0.500 0.500 peak 108 volume 0.278E+07 ppm1 0.572 ppm2 0.979
ASSI
(( segid " " and resid "72 " and name "HG "))
(( segid " " and resid "72 " and name "HA "))
2.100 0.600 0.600 peak 110 volume 0.277E+07 ppm1 1.300 ppm2 3.827
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "41 " and name "HB "))
2.000 0.500 0.500 peak 112 volume 0.270E+07 ppm1 0.533 ppm2 1.957
ASSI
(( segid " " and resid "37 " and name "HB2 "))
(( segid " " and resid "37 " and name "HB1 "))
2.000 0.500 0.500 peak 113 volume 0.269E+07 ppm1 2.534 ppm2 2.646
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
2.100 0.600 0.600 peak 114 volume 0.265E+07 ppm1 2.508 ppm2 7.055
ASSI
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
(( segid " " and resid "72 " and name "HN "))
2.000 0.500 0.500 peak 115 volume 0.264E+07 ppm1 1.635 ppm2 7.843
ASSI
(( segid " " and resid "62 " and name "HG1 "))
(( segid " " and resid "62 " and name "HA "))
2.200 0.600 0.600 peak 119 volume 0.258E+07 ppm1 2.271 ppm2 4.063
ASSI
(( segid " " and resid "41 " and name "HB "))
(( segid " " and resid "42 " and name "HN "))
2.000 0.500 0.500 peak 121 volume 0.253E+07 ppm1 1.956 ppm2 8.938
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "64 " and name "HB "))
2.000 0.500 0.500 peak 126 volume 0.237E+07 ppm1 0.552 ppm2 1.852
ASSI
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
(( segid " " and resid "64 " and name "HN "))
2.000 0.500 0.500 peak 127 volume 0.237E+07 ppm1 0.618 ppm2 8.597
ASSI
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "11 " and name "HN "))
2.100 0.600 0.600 peak 128 volume 0.236E+07 ppm1 4.804 ppm2 7.869
ASSI
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "64 " and name "HN "))
2.000 0.500 0.500 peak 130 volume 0.230E+07 ppm1 1.858 ppm2 8.597
ASSI
(( segid " " and resid "65 " and name "HB1 "))
(( segid " " and resid "65 " and name "HA "))
2.200 0.600 0.600 peak 131 volume 0.230E+07 ppm1 1.950 ppm2 3.735
ASSI
(( segid " " and resid "19 " and name "HB1 ")
OR
( segid " " and resid "19 " and name "HB2 "))
(( segid " " and resid "19 " and name "HA "))
2.200 0.600 0.600 peak 144 volume 0.214E+07 ppm1 1.445 ppm2 3.814
ASSI
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
(( segid " " and resid "32 " and name "HB "))
2.100 0.600 0.600 peak 146 volume 0.209E+07 ppm1 0.867 ppm2 1.951
ASSI
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "41 " and name "HN "))
2.000 0.500 0.500 peak 148 volume 0.208E+07 ppm1 0.447 ppm2 7.311
ASSI
(( segid " " and resid "40 " and name "HA "))
(( segid " " and resid "41 " and name "HN "))
2.200 0.600 0.600 peak 151 volume 0.204E+07 ppm1 4.089 ppm2 7.305
ASSI
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "25 " and name "HN "))
2.100 0.600 0.600 peak 152 volume 0.204E+07 ppm1 1.806 ppm2 7.449
ASSI
(( segid " " and resid "39 " and name "HB1 "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
2.200 0.600 0.600 peak 153 volume 0.203E+07 ppm1 3.223 ppm2 7.055
ASSI
(( segid " " and resid "56 " and name "HB1 ")
OR
( segid " " and resid "56 " and name "HB2 "))
(( segid " " and resid "56 " and name "HD1 "))
2.200 0.600 0.600 peak 155 volume 0.201E+07 ppm1 1.628 ppm2 2.961
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
2.300 0.700 0.700 peak 157 volume 0.201E+07 ppm1 3.459 ppm2 7.055
ASSI
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "63 " and name "HN "))
2.200 0.600 0.600 peak 158 volume 0.201E+07 ppm1 4.030 ppm2 8.440
ASSI
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "10 " and name "HN "))
2.200 0.600 0.600 peak 159 volume 0.200E+07 ppm1 4.515 ppm2 8.624
ASSI
(( segid " " and resid "16 " and name "HA "))
(( segid " " and resid "17 " and name "HN "))
2.200 0.600 0.600 peak 160 volume 0.200E+07 ppm1 4.200 ppm2 8.814
ASSI
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
2.100 0.600 0.600 peak 161 volume 0.200E+07 ppm1 0.624 ppm2 0.861
ASSI
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "36 " and name "HA "))
2.200 0.600 0.600 peak 162 volume 0.199E+07 ppm1 0.447 ppm2 4.004
ASSI
(( segid " " and resid "59 " and name "HA1 "))
(( segid " " and resid "60 " and name "HN "))
2.200 0.600 0.600 peak 165 volume 0.197E+07 ppm1 4.463 ppm2 8.158
ASSI
(( segid " " and resid "65 " and name "HE22"))
(( segid " " and resid "65 " and name "HE21"))
2.000 0.500 0.500 peak 166 volume 0.195E+07 ppm1 6.674 ppm2 7.626
ASSI
(( segid " " and resid "68 " and name "HB1 "))
(( segid " " and resid "68 " and name "HN "))
2.100 0.600 0.600 peak 169 volume 0.192E+07 ppm1 1.792 ppm2 7.994
ASSI
(( segid " " and resid "72 " and name "HB1 ")
OR
( segid " " and resid "72 " and name "HB2 "))
(( segid " " and resid "72 " and name "HN "))
2.100 0.600 0.600 peak 171 volume 0.191E+07 ppm1 1.760 ppm2 7.843
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "38 " and name "HA "))
2.300 0.700 0.700 peak 172 volume 0.190E+07 ppm1 1.668 ppm2 3.729
ASSI
(( segid " " and resid "35 " and name "HB "))
(( segid " " and resid "35 " and name "HN "))
2.100 0.600 0.600 peak 175 volume 0.186E+07 ppm1 1.773 ppm2 7.685
ASSI
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "15 " and name "HN "))
2.200 0.600 0.600 peak 176 volume 0.186E+07 ppm1 4.522 ppm2 8.453
ASSI
(( segid " " and resid "33 " and name "HD22"))
(( segid " " and resid "33 " and name "HD21"))
2.100 0.600 0.600 peak 178 volume 0.185E+07 ppm1 6.779 ppm2 7.482
ASSI
(( segid " " and resid "25 " and name "HG11")
OR
( segid " " and resid "25 " and name "HG12"))
(( segid " " and resid "25 " and name "HB "))
2.200 0.600 0.600 peak 179 volume 0.184E+07 ppm1 0.926 ppm2 1.813
ASSI
(( segid " " and resid "55 " and name "HB "))
(( segid " " and resid "55 " and name "HN "))
2.100 0.600 0.600 peak 186 volume 0.181E+07 ppm1 1.523 ppm2 8.834
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "11 " and name "HA "))
2.400 0.700 0.700 peak 187 volume 0.181E+07 ppm1 5.336 ppm2 5.513
ASSI
(( segid " " and resid "69 " and name "HG1 "))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
2.200 0.600 0.600 peak 189 volume 0.180E+07 ppm1 1.622 ppm2 3.053
ASSI
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "38 " and name "HG2 "))
2.200 0.600 0.600 peak 190 volume 0.179E+07 ppm1 1.117 ppm2 1.465
ASSI
(( segid " " and resid "56 " and name "HG1 "))
(( segid " " and resid "56 " and name "HD1 "))
2.200 0.600 0.600 peak 192 volume 0.178E+07 ppm1 1.458 ppm2 2.968
ASSI
(( segid " " and resid "65 " and name "HB1 "))
(( segid " " and resid "65 " and name "HG1 "))
2.200 0.600 0.600 peak 195 volume 0.177E+07 ppm1 1.956 ppm2 2.357
ASSI
(( segid " " and resid "56 " and name "HB1 ")
OR
( segid " " and resid "56 " and name "HB2 "))
(( segid " " and resid "56 " and name "HN "))
2.100 0.600 0.600 peak 197 volume 0.176E+07 ppm1 1.622 ppm2 7.574
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "55 " and name "HB "))
2.200 0.600 0.600 peak 202 volume 0.171E+07 ppm1 0.224 ppm2 1.531
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "66 " and name "HN "))
2.100 0.600 0.600 peak 205 volume 0.170E+07 ppm1 1.300 ppm2 7.456
ASSI
(( segid " " and resid "68 " and name "HG2 "))
(( segid " " and resid "68 " and name "HA "))
2.300 0.700 0.700 peak 206 volume 0.168E+07 ppm1 1.123 ppm2 3.414
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "67 " and name "HN "))
2.200 0.600 0.600 peak 207 volume 0.167E+07 ppm1 1.300 ppm2 8.243
ASSI
(( segid " " and resid "21 " and name "HA "))
(( segid " " and resid "21 " and name "HD2 "))
2.400 0.700 0.700 peak 211 volume 0.161E+07 ppm1 4.148 ppm2 6.373
ASSI
(( segid " " and resid "19 " and name "HD1 ")
OR
( segid " " and resid "19 " and name "HD2 "))
(( segid " " and resid "19 " and name "HE1 ")
OR
( segid " " and resid "19 " and name "HE2 "))
2.200 0.600 0.600 peak 214 volume 0.159E+07 ppm1 1.307 ppm2 2.607
ASSI
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "36 " and name "HA "))
2.400 0.700 0.700 peak 215 volume 0.159E+07 ppm1 1.897 ppm2 4.004
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "11 " and name "HA "))
2.400 0.700 0.700 peak 216 volume 0.158E+07 ppm1 2.790 ppm2 5.513
ASSI
(( segid " " and resid "57 " and name "HG12"))
(( segid " " and resid "68 " and name "HA "))
2.400 0.700 0.700 peak 218 volume 0.155E+07 ppm1 0.533 ppm2 3.414
ASSI
(( segid " " and resid "74 " and name "HA "))
(( segid " " and resid "74 " and name "HN "))
2.300 0.700 0.700 peak 219 volume 0.155E+07 ppm1 4.089 ppm2 7.593
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
2.200 0.600 0.600 peak 223 volume 0.152E+07 ppm1 0.231 ppm2 0.684
ASSI
(( segid " " and resid "35 " and name "HB "))
(( segid " " and resid "35 " and name "HA "))
2.400 0.700 0.700 peak 225 volume 0.151E+07 ppm1 1.779 ppm2 3.466
ASSI
(( segid " " and resid "62 " and name "HB1 ")
OR
( segid " " and resid "62 " and name "HB2 "))
(( segid " " and resid "62 " and name "HN "))
2.200 0.600 0.600 peak 226 volume 0.151E+07 ppm1 2.035 ppm2 8.171
ASSI
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
(( segid " " and resid "42 " and name "HN "))
2.200 0.600 0.600 peak 230 volume 0.147E+07 ppm1 3.689 ppm2 8.938
ASSI
(( segid " " and resid "36 " and name "HA "))
(( segid " " and resid "41 " and name "HN "))
2.300 0.700 0.700 peak 232 volume 0.146E+07 ppm1 4.004 ppm2 7.311
ASSI
(( segid " " and resid "65 " and name "HB1 "))
(( segid " " and resid "65 " and name "HN "))
2.200 0.600 0.600 peak 235 volume 0.144E+07 ppm1 1.950 ppm2 7.088
ASSI
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "64 " and name "HA "))
2.400 0.700 0.700 peak 240 volume 0.141E+07 ppm1 1.851 ppm2 3.224
ASSI
(( segid " " and resid "17 " and name "HB1 ")
OR
( segid " " and resid "17 " and name "HB2 "))
(( segid " " and resid "17 " and name "HN "))
2.200 0.600 0.600 peak 241 volume 0.140E+07 ppm1 2.554 ppm2 8.807
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "66 " and name "HG2 "))
2.300 0.700 0.700 peak 242 volume 0.140E+07 ppm1 1.294 ppm2 2.141
ASSI
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "67 " and name "HN "))
2.300 0.700 0.700 peak 243 volume 0.139E+07 ppm1 3.459 ppm2 8.243
ASSI
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "37 " and name "HN "))
2.200 0.600 0.600 peak 245 volume 0.137E+07 ppm1 1.891 ppm2 7.751
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "64 " and name "HN "))
2.300 0.700 0.700 peak 246 volume 0.137E+07 ppm1 3.223 ppm2 8.597
ASSI
(( segid " " and resid "36 " and name "HA "))
(( segid " " and resid "36 " and name "HN "))
2.300 0.700 0.700 peak 247 volume 0.137E+07 ppm1 4.010 ppm2 8.171
ASSI
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "59 " and name "HN "))
2.200 0.600 0.600 peak 249 volume 0.136E+07 ppm1 0.618 ppm2 8.341
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
2.400 0.700 0.700 peak 250 volume 0.136E+07 ppm1 4.693 ppm2 7.173
ASSI
(( segid " " and resid "20 " and name "HB2 "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
2.300 0.700 0.700 peak 252 volume 0.135E+07 ppm1 2.921 ppm2 7.180
ASSI
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
2.300 0.700 0.700 peak 253 volume 0.135E+07 ppm1 0.979 ppm2 7.180
ASSI
(( segid " " and resid "34 " and name "HG2 "))
(( segid " " and resid "34 " and name "HG1 "))
2.300 0.700 0.700 peak 254 volume 0.134E+07 ppm1 1.668 ppm2 1.826
ASSI
(( segid " " and resid "70 " and name "HN "))
(( segid " " and resid "71 " and name "HN "))
2.200 0.600 0.600 peak 262 volume 0.131E+07 ppm1 7.665 ppm2 8.309
ASSI
(( segid " " and resid "65 " and name "HG1 "))
(( segid " " and resid "65 " and name "HN "))
2.200 0.600 0.600 peak 263 volume 0.131E+07 ppm1 2.370 ppm2 7.088
ASSI
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "38 " and name "HN "))
2.200 0.600 0.600 peak 264 volume 0.130E+07 ppm1 1.090 ppm2 8.532
ASSI
(( segid " " and resid "68 " and name "HA "))
(( segid " " and resid "68 " and name "HN "))
2.400 0.700 0.700 peak 268 volume 0.129E+07 ppm1 3.413 ppm2 7.994
ASSI
(( segid " " and resid "65 " and name "HN "))
(( segid " " and resid "66 " and name "HN "))
2.200 0.600 0.600 peak 270 volume 0.129E+07 ppm1 7.087 ppm2 7.456
ASSI
(( segid " " and resid "72 " and name "HN "))
(( segid " " and resid "71 " and name "HN "))
2.200 0.600 0.600 peak 272 volume 0.129E+07 ppm1 7.842 ppm2 8.309
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "64 " and name "HN "))
2.200 0.600 0.600 peak 273 volume 0.129E+07 ppm1 0.539 ppm2 8.597
ASSI
(( segid " " and resid "68 " and name "HN "))
(( segid " " and resid "67 " and name "HN "))
2.200 0.600 0.600 peak 276 volume 0.127E+07 ppm1 7.993 ppm2 8.250
ASSI
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "24 " and name "HA "))
2.400 0.700 0.700 peak 280 volume 0.125E+07 ppm1 1.825 ppm2 3.860
ASSI
(( segid " " and resid "63 " and name "HA2 "))
(( segid " " and resid "63 " and name "HN "))
2.400 0.700 0.700 peak 281 volume 0.125E+07 ppm1 3.735 ppm2 8.440
ASSI
(( segid " " and resid "33 " and name "HB2 "))
(( segid " " and resid "33 " and name "HN "))
2.300 0.700 0.700 peak 284 volume 0.120E+07 ppm1 2.691 ppm2 8.210
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "38 " and name "HN "))
2.400 0.700 0.700 peak 285 volume 0.120E+07 ppm1 3.728 ppm2 8.532
ASSI
(( segid " " and resid "33 " and name "HA "))
(( segid " " and resid "33 " and name "HN "))
2.400 0.700 0.700 peak 287 volume 0.117E+07 ppm1 4.325 ppm2 8.204
ASSI
(( segid " " and resid "76 " and name "HB1 ")
OR
( segid " " and resid "76 " and name "HB2 "))
(( segid " " and resid "76 " and name "HN "))
2.300 0.700 0.700 peak 288 volume 0.117E+07 ppm1 3.695 ppm2 7.160
ASSI
(( segid " " and resid "69 " and name "HN "))
(( segid " " and resid "70 " and name "HN "))
2.200 0.600 0.600 peak 289 volume 0.116E+07 ppm1 7.114 ppm2 7.672
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "35 " and name "HN "))
2.400 0.700 0.700 peak 290 volume 0.116E+07 ppm1 3.466 ppm2 7.685
ASSI
(( segid " " and resid "37 " and name "HB2 "))
(( segid " " and resid "37 " and name "HN "))
2.300 0.700 0.700 peak 296 volume 0.114E+07 ppm1 2.547 ppm2 7.751
ASSI
(( segid " " and resid "20 " and name "HB2 "))
(( segid " " and resid "20 " and name "HN "))
2.300 0.700 0.700 peak 297 volume 0.114E+07 ppm1 2.921 ppm2 8.282
ASSI
(( segid " " and resid "68 " and name "HG2 "))
(( segid " " and resid "68 " and name "HB1 "))
2.400 0.700 0.700 peak 298 volume 0.114E+07 ppm1 1.130 ppm2 1.800
ASSI
(( segid " " and resid "68 " and name "HG1 "))
(( segid " " and resid "68 " and name "HE1 "))
2.400 0.700 0.700 peak 300 volume 0.113E+07 ppm1 1.615 ppm2 2.830
ASSI
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "56 " and name "HN "))
2.200 0.600 0.600 peak 302 volume 0.112E+07 ppm1 0.447 ppm2 7.580
ASSI
(( segid " " and resid "62 " and name "HN "))
(( segid " " and resid "63 " and name "HN "))
2.200 0.600 0.600 peak 303 volume 0.111E+07 ppm1 8.164 ppm2 8.440
ASSI
(( segid " " and resid "43 " and name "HG21")
OR
( segid " " and resid "43 " and name "HG23")
OR
( segid " " and resid "43 " and name "HG22"))
(( segid " " and resid "44 " and name "HN "))
2.300 0.700 0.700 peak 304 volume 0.111E+07 ppm1 0.559 ppm2 9.116
ASSI
(( segid " " and resid "20 " and name "HB1 "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
2.400 0.700 0.700 peak 305 volume 0.110E+07 ppm1 3.295 ppm2 7.180
ASSI
(( segid " " and resid "12 " and name "HA "))
(( segid " " and resid "12 " and name "HN "))
2.400 0.700 0.700 peak 313 volume 0.107E+07 ppm1 4.227 ppm2 8.768
ASSI
(( segid " " and resid "66 " and name "HG2 "))
(( segid " " and resid "66 " and name "HA "))
2.500 0.800 0.800 peak 315 volume 0.106E+07 ppm1 2.134 ppm2 3.748
ASSI
(( segid " " and resid "36 " and name "HG2 "))
(( segid " " and resid "36 " and name "HA "))
2.500 0.800 0.800 peak 317 volume 0.106E+07 ppm1 1.477 ppm2 4.004
ASSI
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
(( segid " " and resid "14 " and name "HN "))
2.300 0.700 0.700 peak 318 volume 0.105E+07 ppm1 0.848 ppm2 8.866
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "39 " and name "HN "))
2.300 0.700 0.700 peak 319 volume 0.105E+07 ppm1 2.508 ppm2 7.593
ASSI
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
(( segid " " and resid "25 " and name "HN "))
2.300 0.700 0.700 peak 323 volume 0.104E+07 ppm1 1.051 ppm2 7.449
ASSI
(( segid " " and resid "25 " and name "HN "))
(( segid " " and resid "24 " and name "HN "))
2.300 0.700 0.700 peak 329 volume 0.100E+07 ppm1 7.448 ppm2 7.790
ASSI
(( segid " " and resid "52 " and name "HA "))
(( segid " " and resid "53 " and name "HN "))
2.500 0.800 0.800 peak 330 volume 0.100E+07 ppm1 4.496 ppm2 8.368
ASSI
(( segid " " and resid "34 " and name "HB1 ")
OR
( segid " " and resid "34 " and name "HB2 "))
(( segid " " and resid "34 " and name "HN "))
2.300 0.700 0.700 peak 331 volume 0.100E+07 ppm1 2.042 ppm2 7.541
ASSI
(( segid " " and resid "57 " and name "HG11"))
(( segid " " and resid "57 " and name "HN "))
2.400 0.700 0.700 peak 338 volume 0.970E+06 ppm1 1.379 ppm2 8.932
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "12 " and name "HN "))
2.400 0.700 0.700 peak 348 volume 0.946E+06 ppm1 2.783 ppm2 8.768
ASSI
(( segid " " and resid "59 " and name "HA2 "))
(( segid " " and resid "59 " and name "HN "))
2.500 0.800 0.800 peak 351 volume 0.933E+06 ppm1 3.918 ppm2 8.341
ASSI
(( segid " " and resid "69 " and name "HB2 "))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
2.400 0.700 0.700 peak 352 volume 0.931E+06 ppm1 1.760 ppm2 3.053
ASSI
(( segid " " and resid "15 " and name "HB1 "))
(( segid " " and resid "15 " and name "HN "))
2.400 0.700 0.700 peak 354 volume 0.926E+06 ppm1 2.619 ppm2 8.446
ASSI
(( segid " " and resid "37 " and name "HN "))
(( segid " " and resid "36 " and name "HN "))
2.300 0.700 0.700 peak 362 volume 0.883E+06 ppm1 7.750 ppm2 8.171
ASSI
(( segid " " and resid "65 " and name "HN "))
(( segid " " and resid "64 " and name "HN "))
2.300 0.700 0.700 peak 363 volume 0.880E+06 ppm1 7.081 ppm2 8.597
ASSI
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "39 " and name "HN "))
2.400 0.700 0.700 peak 364 volume 0.879E+06 ppm1 7.042 ppm2 7.593
ASSI
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "21 " and name "HN "))
2.400 0.700 0.700 peak 366 volume 0.874E+06 ppm1 6.372 ppm2 7.981
ASSI
(( segid " " and resid "35 " and name "HD11")
OR
( segid " " and resid "35 " and name "HD13")
OR
( segid " " and resid "35 " and name "HD12"))
(( segid " " and resid "35 " and name "HA "))
2.500 0.800 0.800 peak 367 volume 0.871E+06 ppm1 0.684 ppm2 3.460
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "16 " and name "HD11")
OR
( segid " " and resid "16 " and name "HD13")
OR
( segid " " and resid "16 " and name "HD12"))
2.400 0.700 0.700 peak 369 volume 0.868E+06 ppm1 0.224 ppm2 0.566
ASSI
(( segid " " and resid "44 " and name "HG2 "))
(( segid " " and resid "44 " and name "HB1 "))
2.500 0.800 0.800 peak 371 volume 0.863E+06 ppm1 1.222 ppm2 1.682
ASSI
(( segid " " and resid "39 " and name "HB1 "))
(( segid " " and resid "63 " and name "HA2 "))
2.600 0.800 0.800 peak 374 volume 0.853E+06 ppm1 3.223 ppm2 3.735
ASSI
(( segid " " and resid "73 " and name "HN "))
(( segid " " and resid "72 " and name "HN "))
2.300 0.700 0.700 peak 375 volume 0.849E+06 ppm1 7.658 ppm2 7.843
ASSI
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
(( segid " " and resid "13 " and name "HN "))
2.400 0.700 0.700 peak 381 volume 0.840E+06 ppm1 0.710 ppm2 8.368
ASSI
(( segid " " and resid "74 " and name "HG "))
(( segid " " and resid "74 " and name "HN "))
2.400 0.700 0.700 peak 383 volume 0.824E+06 ppm1 1.392 ppm2 7.593
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "41 " and name "HN "))
2.600 0.800 0.800 peak 385 volume 0.820E+06 ppm1 5.060 ppm2 7.305
ASSI
(( segid " " and resid "11 " and name "HA "))
(( segid " " and resid "11 " and name "HN "))
2.600 0.800 0.800 peak 386 volume 0.819E+06 ppm1 5.513 ppm2 7.869
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "75 " and name "HN "))
2.600 0.800 0.800 peak 388 volume 0.817E+06 ppm1 3.971 ppm2 7.252
ASSI
(( segid " " and resid "16 " and name "HB "))
(( segid " " and resid "16 " and name "HN "))
2.400 0.700 0.700 peak 390 volume 0.813E+06 ppm1 1.537 ppm2 8.729
ASSI
(( segid " " and resid "38 " and name "HG2 "))
(( segid " " and resid "38 " and name "HA "))
2.600 0.800 0.800 peak 391 volume 0.811E+06 ppm1 1.445 ppm2 3.729
ASSI
(( segid " " and resid "63 " and name "HN "))
(( segid " " and resid "64 " and name "HN "))
2.400 0.700 0.700 peak 392 volume 0.808E+06 ppm1 8.433 ppm2 8.591
ASSI
(( segid " " and resid "58 " and name "HB1 "))
(( segid " " and resid "58 " and name "HA "))
2.600 0.800 0.800 peak 395 volume 0.806E+06 ppm1 1.970 ppm2 5.336
ASSI
(( segid " " and resid "69 " and name "HG2 "))
(( segid " " and resid "69 " and name "HA "))
2.600 0.800 0.800 peak 396 volume 0.804E+06 ppm1 1.399 ppm2 3.768
ASSI
(( segid " " and resid "54 " and name "HA "))
(( segid " " and resid "15 " and name "HA "))
2.800 1.000 1.000 peak 397 volume 0.803E+06 ppm1 4.647 ppm2 5.205
ASSI
(( segid " " and resid "68 " and name "HG2 "))
(( segid " " and resid "68 " and name "HE2 "))
2.500 0.800 0.800 peak 402 volume 0.787E+06 ppm1 1.136 ppm2 2.731
ASSI
(( segid " " and resid "50 " and name "HG1 ")
OR
( segid " " and resid "50 " and name "HG2 "))
(( segid " " and resid "50 " and name "HA "))
2.700 0.900 0.900 peak 403 volume 0.773E+06 ppm1 2.193 ppm2 3.965
ASSI
(( segid " " and resid "24 " and name "HG "))
(( segid " " and resid "24 " and name "HN "))
2.500 0.800 0.800 peak 405 volume 0.769E+06 ppm1 1.340 ppm2 7.790
ASSI
(( segid " " and resid "62 " and name "HB1 ")
OR
( segid " " and resid "62 " and name "HB2 "))
(( segid " " and resid "63 " and name "HN "))
2.500 0.800 0.800 peak 406 volume 0.767E+06 ppm1 2.009 ppm2 8.440
ASSI
(( segid " " and resid "71 " and name "HG "))
(( segid " " and resid "71 " and name "HN "))
2.500 0.800 0.800 peak 408 volume 0.765E+06 ppm1 1.110 ppm2 8.302
ASSI
(( segid " " and resid "21 " and name "HA "))
(( segid " " and resid "21 " and name "HN "))
2.600 0.800 0.800 peak 409 volume 0.764E+06 ppm1 4.148 ppm2 7.981
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
2.500 0.800 0.800 peak 410 volume 0.762E+06 ppm1 1.281 ppm2 6.590
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "57 " and name "HN "))
2.600 0.800 0.800 peak 414 volume 0.750E+06 ppm1 4.909 ppm2 8.938
ASSI
(( segid " " and resid "66 " and name "HG1 "))
(( segid " " and resid "66 " and name "HA "))
2.700 0.900 0.900 peak 415 volume 0.749E+06 ppm1 2.199 ppm2 3.735
ASSI
(( segid " " and resid "52 " and name "HB2 "))
(( segid " " and resid "52 " and name "HN "))
2.500 0.800 0.800 peak 416 volume 0.749E+06 ppm1 3.452 ppm2 8.505
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "58 " and name "HN "))
2.600 0.800 0.800 peak 420 volume 0.737E+06 ppm1 5.336 ppm2 8.486
ASSI
(( segid " " and resid "60 " and name "HB1 "))
(( segid " " and resid "61 " and name "HD2 "))
2.600 0.800 0.800 peak 421 volume 0.735E+06 ppm1 2.823 ppm2 3.702
ASSI
(( segid " " and resid "46 " and name "HD2 "))
(( segid " " and resid "21 " and name "HE1 "))
2.600 0.800 0.800 peak 424 volume 0.730E+06 ppm1 3.531 ppm2 7.954
ASSI
(( segid " " and resid "34 " and name "HG2 "))
(( segid " " and resid "34 " and name "HA "))
2.700 0.900 0.900 peak 425 volume 0.730E+06 ppm1 1.622 ppm2 4.050
ASSI
(( segid " " and resid "55 " and name "HA "))
(( segid " " and resid "55 " and name "HN "))
2.600 0.800 0.800 peak 426 volume 0.727E+06 ppm1 4.305 ppm2 8.840
ASSI
(( segid " " and resid "25 " and name "HG11")
OR
( segid " " and resid "25 " and name "HG12"))
(( segid " " and resid "25 " and name "HN "))
2.500 0.800 0.800 peak 427 volume 0.720E+06 ppm1 0.926 ppm2 7.442
ASSI
(( segid " " and resid "19 " and name "HB1 ")
OR
( segid " " and resid "19 " and name "HB2 "))
(( segid " " and resid "19 " and name "HN "))
2.500 0.800 0.800 peak 433 volume 0.695E+06 ppm1 1.445 ppm2 8.236
ASSI
(( segid " " and resid "16 " and name "HA "))
(( segid " " and resid "16 " and name "HN "))
2.600 0.800 0.800 peak 436 volume 0.690E+06 ppm1 4.194 ppm2 8.722
ASSI
(( segid " " and resid "40 " and name "HG2 "))
(( segid " " and resid "40 " and name "HA "))
2.700 0.900 0.900 peak 438 volume 0.675E+06 ppm1 1.274 ppm2 4.090
ASSI
(( segid " " and resid "46 " and name "HB1 ")
OR
( segid " " and resid "46 " and name "HB2 "))
(( segid " " and resid "46 " and name "HD1 "))
2.600 0.800 0.800 peak 440 volume 0.671E+06 ppm1 2.239 ppm2 3.932
ASSI
(( segid " " and resid "37 " and name "HB1 "))
(( segid " " and resid "38 " and name "HN "))
2.500 0.800 0.800 peak 442 volume 0.667E+06 ppm1 2.645 ppm2 8.532
ASSI
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "14 " and name "HN "))
2.700 0.900 0.900 peak 448 volume 0.643E+06 ppm1 4.522 ppm2 8.860
ASSI
(( segid " " and resid "58 " and name "HB2 "))
(( segid " " and resid "58 " and name "HA "))
2.700 0.900 0.900 peak 452 volume 0.637E+06 ppm1 1.858 ppm2 5.336
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "60 " and name "HN "))
2.700 0.900 0.900 peak 462 volume 0.622E+06 ppm1 4.771 ppm2 8.158
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
2.600 0.800 0.800 peak 464 volume 0.622E+06 ppm1 1.287 ppm2 7.062
ASSI
(( segid " " and resid "60 " and name "HB2 "))
(( segid " " and resid "61 " and name "HD2 "))
2.600 0.800 0.800 peak 466 volume 0.617E+06 ppm1 2.619 ppm2 3.716
ASSI
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
(( segid " " and resid "17 " and name "HN "))
2.500 0.800 0.800 peak 471 volume 0.604E+06 ppm1 0.985 ppm2 8.807
ASSI
(( segid " " and resid "70 " and name "HG1 ")
OR
( segid " " and resid "70 " and name "HG2 "))
(( segid " " and resid "67 " and name "HA "))
2.800 1.000 1.000 peak 472 volume 0.603E+06 ppm1 2.396 ppm2 3.460
ASSI
(( segid " " and resid "73 " and name "HG1 ")
OR
( segid " " and resid "73 " and name "HG2 "))
(( segid " " and resid "73 " and name "HA "))
2.800 1.000 1.000 peak 474 volume 0.600E+06 ppm1 2.344 ppm2 3.912
ASSI
(( segid " " and resid "65 " and name "HG1 "))
(( segid " " and resid "62 " and name "HA "))
2.800 1.000 1.000 peak 479 volume 0.594E+06 ppm1 2.403 ppm2 4.063
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "41 " and name "HN "))
2.500 0.800 0.800 peak 483 volume 0.591E+06 ppm1 0.533 ppm2 7.305
ASSI
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "65 " and name "HN "))
2.700 0.900 0.900 peak 487 volume 0.588E+06 ppm1 4.063 ppm2 7.082
ASSI
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "36 " and name "HN "))
2.500 0.800 0.800 peak 488 volume 0.584E+06 ppm1 0.789 ppm2 8.171
ASSI
(( segid " " and resid "53 " and name "HB2 "))
(( segid " " and resid "53 " and name "HD21"))
2.600 0.800 0.800 peak 491 volume 0.574E+06 ppm1 2.632 ppm2 7.449
ASSI
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB2 "))
(( segid " " and resid "18 " and name "HN "))
2.600 0.800 0.800 peak 496 volume 0.568E+06 ppm1 3.000 ppm2 7.534
ASSI
(( segid " " and resid "19 " and name "HA "))
(( segid " " and resid "19 " and name "HN "))
2.700 0.900 0.900 peak 498 volume 0.567E+06 ppm1 3.813 ppm2 8.230
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "13 " and name "HN "))
2.700 0.900 0.900 peak 503 volume 0.560E+06 ppm1 5.250 ppm2 8.374
ASSI
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
(( segid " " and resid "20 " and name "HB1 "))
2.600 0.800 0.800 peak 504 volume 0.560E+06 ppm1 0.979 ppm2 3.296
ASSI
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
(( segid " " and resid "65 " and name "HN "))
2.500 0.800 0.800 peak 506 volume 0.559E+06 ppm1 0.618 ppm2 7.088
ASSI
(( segid " " and resid "46 " and name "HB1 ")
OR
( segid " " and resid "46 " and name "HB2 "))
(( segid " " and resid "21 " and name "HE1 "))
2.700 0.900 0.900 peak 510 volume 0.541E+06 ppm1 2.239 ppm2 7.954
ASSI
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
(( segid " " and resid "32 " and name "HN "))
2.500 0.800 0.800 peak 512 volume 0.540E+06 ppm1 0.867 ppm2 7.659
ASSI
(( segid " " and resid "38 " and name "HG2 "))
(( segid " " and resid "38 " and name "HE21"))
2.600 0.800 0.800 peak 514 volume 0.537E+06 ppm1 1.458 ppm2 6.859
ASSI
(( segid " " and resid "23 " and name "HB2 "))
(( segid " " and resid "23 " and name "HD2 "))
2.700 0.900 0.900 peak 515 volume 0.537E+06 ppm1 3.026 ppm2 6.872
ASSI
(( segid " " and resid "12 " and name "HA "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
2.800 1.000 1.000 peak 516 volume 0.535E+06 ppm1 4.227 ppm2 6.754
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "21 " and name "HD2 "))
2.600 0.800 0.800 peak 517 volume 0.531E+06 ppm1 0.224 ppm2 6.373
ASSI
(( segid " " and resid "44 " and name "HA "))
(( segid " " and resid "44 " and name "HN "))
2.700 0.900 0.900 peak 518 volume 0.531E+06 ppm1 4.476 ppm2 9.116
ASSI
(( segid " " and resid "53 " and name "HA "))
(( segid " " and resid "54 " and name "HN "))
2.700 0.900 0.900 peak 521 volume 0.525E+06 ppm1 4.962 ppm2 7.725
ASSI
(( segid " " and resid "35 " and name "HD11")
OR
( segid " " and resid "35 " and name "HD13")
OR
( segid " " and resid "35 " and name "HD12"))
(( segid " " and resid "35 " and name "HN "))
2.600 0.800 0.800 peak 525 volume 0.521E+06 ppm1 0.684 ppm2 7.692
ASSI
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
(( segid " " and resid "57 " and name "HG11"))
2.700 0.900 0.900 peak 531 volume 0.513E+06 ppm1 0.874 ppm2 1.367
ASSI
(( segid " " and resid "70 " and name "HG1 ")
OR
( segid " " and resid "70 " and name "HG2 "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
2.700 0.900 0.900 peak 532 volume 0.511E+06 ppm1 2.409 ppm2 6.590
ASSI
(( segid " " and resid "58 " and name "HB2 "))
(( segid " " and resid "58 " and name "HN "))
2.600 0.800 0.800 peak 533 volume 0.510E+06 ppm1 1.858 ppm2 8.479
ASSI
(( segid " " and resid "62 " and name "HG1 "))
(( segid " " and resid "62 " and name "HN "))
2.600 0.800 0.800 peak 536 volume 0.507E+06 ppm1 2.298 ppm2 8.171
ASSI
(( segid " " and resid "19 " and name "HG1 "))
(( segid " " and resid "19 " and name "HN "))
2.600 0.800 0.800 peak 538 volume 0.505E+06 ppm1 0.789 ppm2 8.243
ASSI
(( segid " " and resid "11 " and name "HA "))
(( segid " " and resid "59 " and name "HN "))
2.800 1.000 1.000 peak 539 volume 0.503E+06 ppm1 5.513 ppm2 8.341
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "39 " and name "HB2 "))
2.600 0.800 0.800 peak 540 volume 0.501E+06 ppm1 0.533 ppm2 2.508
ASSI
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
(( segid " " and resid "35 " and name "HN "))
2.600 0.800 0.800 peak 546 volume 0.498E+06 ppm1 1.031 ppm2 7.692
ASSI
(( segid " " and resid "56 " and name "HA "))
(( segid " " and resid "56 " and name "HN "))
2.800 1.000 1.000 peak 548 volume 0.494E+06 ppm1 5.132 ppm2 7.574
ASSI
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
(( segid " " and resid "45 " and name "HN "))
2.600 0.800 0.800 peak 551 volume 0.483E+06 ppm1 1.307 ppm2 8.486
ASSI
(( segid " " and resid "34 " and name "HN "))
(( segid " " and resid "33 " and name "HN "))
2.600 0.800 0.800 peak 553 volume 0.480E+06 ppm1 7.540 ppm2 8.210
ASSI
(( segid " " and resid "31 " and name "HB1 "))
(( segid " " and resid "31 " and name "HN "))
2.700 0.900 0.900 peak 555 volume 0.478E+06 ppm1 2.809 ppm2 8.046
ASSI
(( segid " " and resid "33 " and name "HB1 "))
(( segid " " and resid "34 " and name "HN "))
2.700 0.900 0.900 peak 562 volume 0.462E+06 ppm1 2.790 ppm2 7.547
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
2.600 0.800 0.800 peak 563 volume 0.462E+06 ppm1 0.231 ppm2 0.979
ASSI
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "33 " and name "HA "))
2.900 1.100 1.100 peak 567 volume 0.457E+06 ppm1 1.911 ppm2 4.339
ASSI
(( segid " " and resid "23 " and name "HB1 "))
(( segid " " and resid "24 " and name "HN "))
2.700 0.900 0.900 peak 568 volume 0.456E+06 ppm1 3.111 ppm2 7.790
ASSI
(( segid " " and resid "53 " and name "HB1 "))
(( segid " " and resid "16 " and name "HN "))
2.700 0.900 0.900 peak 570 volume 0.452E+06 ppm1 2.921 ppm2 8.729
ASSI
(( segid " " and resid "11 " and name "HA "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
2.900 1.100 1.100 peak 572 volume 0.446E+06 ppm1 5.506 ppm2 6.754
ASSI
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "75 " and name "HN "))
2.800 1.000 1.000 peak 573 volume 0.446E+06 ppm1 3.840 ppm2 7.252
ASSI
(( segid " " and resid "47 " and name "HB1 ")
OR
( segid " " and resid "47 " and name "HB2 "))
(( segid " " and resid "47 " and name "HD1 "))
2.800 1.000 1.000 peak 577 volume 0.443E+06 ppm1 2.304 ppm2 3.683
ASSI
(( segid " " and resid "38 " and name "HG2 "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
2.800 1.000 1.000 peak 579 volume 0.440E+06 ppm1 1.464 ppm2 6.596
ASSI
(( segid " " and resid "23 " and name "HB1 "))
(( segid " " and resid "23 " and name "HD2 "))
2.800 1.000 1.000 peak 586 volume 0.432E+06 ppm1 3.105 ppm2 6.878
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "44 " and name "HN "))
2.800 1.000 1.000 peak 588 volume 0.431E+06 ppm1 4.903 ppm2 9.122
ASSI
(( segid " " and resid "23 " and name "HB2 "))
(( segid " " and resid "24 " and name "HN "))
2.700 0.900 0.900 peak 590 volume 0.424E+06 ppm1 3.026 ppm2 7.784
ASSI
(( segid " " and resid "31 " and name "HB1 "))
(( segid " " and resid "32 " and name "HN "))
2.700 0.900 0.900 peak 591 volume 0.422E+06 ppm1 2.796 ppm2 7.659
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "38 " and name "HN "))
2.900 1.100 1.100 peak 596 volume 0.420E+06 ppm1 4.338 ppm2 8.525
ASSI
(( segid " " and resid "33 " and name "HB2 "))
(( segid " " and resid "34 " and name "HN "))
2.700 0.900 0.900 peak 598 volume 0.420E+06 ppm1 2.685 ppm2 7.534
ASSI
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "20 " and name "HB2 "))
2.700 0.900 0.900 peak 599 volume 0.419E+06 ppm1 0.684 ppm2 2.915
ASSI
(( segid " " and resid "65 " and name "HG2 "))
(( segid " " and resid "66 " and name "HN "))
2.700 0.900 0.900 peak 602 volume 0.411E+06 ppm1 2.042 ppm2 7.462
ASSI
(( segid " " and resid "19 " and name "HG2 "))
(( segid " " and resid "19 " and name "HE1 ")
OR
( segid " " and resid "19 " and name "HE2 "))
2.800 1.000 1.000 peak 605 volume 0.410E+06 ppm1 0.415 ppm2 2.594
ASSI
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
2.800 1.000 1.000 peak 608 volume 0.406E+06 ppm1 2.134 ppm2 6.767
ASSI
(( segid " " and resid "68 " and name "HA "))
(( segid " " and resid "69 " and name "HN "))
2.900 1.100 1.100 peak 612 volume 0.403E+06 ppm1 3.407 ppm2 7.121
ASSI
(( segid " " and resid "53 " and name "HB2 "))
(( segid " " and resid "53 " and name "HN "))
2.700 0.900 0.900 peak 613 volume 0.400E+06 ppm1 2.619 ppm2 8.361
ASSI
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
(( segid " " and resid "20 " and name "HN "))
2.700 0.900 0.900 peak 614 volume 0.398E+06 ppm1 7.173 ppm2 8.282
ASSI
(( segid " " and resid "56 " and name "HG1 "))
(( segid " " and resid "46 " and name "HG1 ")
OR
( segid " " and resid "46 " and name "HG2 "))
2.800 1.000 1.000 peak 616 volume 0.396E+06 ppm1 1.471 ppm2 2.029
ASSI
(( segid " " and resid "21 " and name "HB2 "))
(( segid " " and resid "22 " and name "HN "))
2.700 0.900 0.900 peak 624 volume 0.388E+06 ppm1 2.980 ppm2 8.492
ASSI
(( segid " " and resid "13 " and name "HB2 "))
(( segid " " and resid "14 " and name "HN "))
2.800 1.000 1.000 peak 626 volume 0.382E+06 ppm1 1.740 ppm2 8.866
ASSI
(( segid " " and resid "53 " and name "HB1 "))
(( segid " " and resid "53 " and name "HD21"))
2.800 1.000 1.000 peak 633 volume 0.370E+06 ppm1 2.914 ppm2 7.449
ASSI
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "44 " and name "HN "))
2.700 0.900 0.900 peak 635 volume 0.370E+06 ppm1 0.447 ppm2 9.116
ASSI
(( segid " " and resid "23 " and name "HB2 "))
(( segid " " and resid "23 " and name "HN "))
2.800 1.000 1.000 peak 636 volume 0.369E+06 ppm1 3.026 ppm2 7.705
ASSI
(( segid " " and resid "31 " and name "HB2 "))
(( segid " " and resid "32 " and name "HN "))
2.800 1.000 1.000 peak 642 volume 0.363E+06 ppm1 2.573 ppm2 7.659
ASSI
(( segid " " and resid "18 " and name "HA "))
(( segid " " and resid "18 " and name "HN "))
2.900 1.100 1.100 peak 644 volume 0.362E+06 ppm1 3.958 ppm2 7.541
ASSI
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
(( segid " " and resid "75 " and name "HN "))
2.800 1.000 1.000 peak 645 volume 0.362E+06 ppm1 1.845 ppm2 7.252
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "24 " and name "HN "))
2.900 1.100 1.100 peak 649 volume 0.358E+06 ppm1 4.397 ppm2 7.784
ASSI
(( segid " " and resid "19 " and name "HG2 "))
(( segid " " and resid "19 " and name "HA "))
3.000 1.100 1.100 peak 650 volume 0.357E+06 ppm1 0.428 ppm2 3.807
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "23 " and name "HN "))
2.900 1.100 1.100 peak 651 volume 0.357E+06 ppm1 4.397 ppm2 7.705
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "57 " and name "HN "))
2.900 1.100 1.100 peak 653 volume 0.354E+06 ppm1 5.257 ppm2 8.932
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "11 " and name "HN "))
2.800 1.000 1.000 peak 654 volume 0.354E+06 ppm1 2.836 ppm2 7.862
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "12 " and name "HN "))
2.900 1.100 1.100 peak 658 volume 0.351E+06 ppm1 5.342 ppm2 8.755
ASSI
(( segid " " and resid "68 " and name "HA "))
(( segid " " and resid "71 " and name "HN "))
2.900 1.100 1.100 peak 661 volume 0.349E+06 ppm1 3.413 ppm2 8.309
ASSI
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
(( segid " " and resid "18 " and name "HN "))
2.700 0.900 0.900 peak 662 volume 0.347E+06 ppm1 0.966 ppm2 7.541
ASSI
(( segid " " and resid "46 " and name "HG1 ")
OR
( segid " " and resid "46 " and name "HG2 "))
(( segid " " and resid "21 " and name "HE1 "))
2.900 1.100 1.100 peak 663 volume 0.346E+06 ppm1 2.042 ppm2 7.948
ASSI
(( segid " " and resid "21 " and name "HB2 "))
(( segid " " and resid "22 " and name "HA "))
3.000 1.100 1.100 peak 666 volume 0.342E+06 ppm1 2.960 ppm2 3.991
ASSI
(( segid " " and resid "38 " and name "HG1 "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
2.900 1.100 1.100 peak 675 volume 0.334E+06 ppm1 1.865 ppm2 6.603
ASSI
(( segid " " and resid "46 " and name "HD1 "))
(( segid " " and resid "21 " and name "HE1 "))
2.900 1.100 1.100 peak 678 volume 0.331E+06 ppm1 3.938 ppm2 7.954
ASSI
(( segid " " and resid "33 " and name "HB1 "))
(( segid " " and resid "33 " and name "HD21"))
2.800 1.000 1.000 peak 684 volume 0.325E+06 ppm1 2.777 ppm2 7.469
ASSI
(( segid " " and resid "53 " and name "HB1 "))
(( segid " " and resid "17 " and name "HA "))
3.100 1.200 1.200 peak 687 volume 0.322E+06 ppm1 2.908 ppm2 4.070
ASSI
(( segid " " and resid "14 " and name "HB "))
(( segid " " and resid "14 " and name "HN "))
2.800 1.000 1.000 peak 688 volume 0.321E+06 ppm1 1.655 ppm2 8.860
ASSI
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "17 " and name "HN "))
3.000 1.100 1.100 peak 689 volume 0.321E+06 ppm1 4.069 ppm2 8.814
ASSI
(( segid " " and resid "38 " and name "HG2 "))
(( segid " " and resid "38 " and name "HE22"))
2.800 1.000 1.000 peak 690 volume 0.320E+06 ppm1 1.464 ppm2 6.688
ASSI
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
(( segid " " and resid "15 " and name "HD22"))
2.800 1.000 1.000 peak 693 volume 0.316E+06 ppm1 0.723 ppm2 6.773
ASSI
(( segid " " and resid "15 " and name "HA "))
(( segid " " and resid "15 " and name "HN "))
3.000 1.100 1.100 peak 700 volume 0.312E+06 ppm1 5.204 ppm2 8.453
ASSI
(( segid " " and resid "23 " and name "HB1 "))
(( segid " " and resid "23 " and name "HN "))
2.900 1.100 1.100 peak 704 volume 0.308E+06 ppm1 3.111 ppm2 7.698
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "67 " and name "HN "))
2.800 1.000 1.000 peak 705 volume 0.307E+06 ppm1 0.526 ppm2 8.250
ASSI
(( segid " " and resid "40 " and name "HB1 ")
OR
( segid " " and resid "40 " and name "HB2 "))
(( segid " " and resid "40 " and name "HN "))
2.900 1.100 1.100 peak 716 volume 0.299E+06 ppm1 2.166 ppm2 7.712
ASSI
(( segid " " and resid "38 " and name "HG1 "))
(( segid " " and resid "38 " and name "HE21"))
2.900 1.100 1.100 peak 724 volume 0.292E+06 ppm1 1.825 ppm2 6.872
ASSI
(( segid " " and resid "15 " and name "HB2 "))
(( segid " " and resid "15 " and name "HD21"))
2.900 1.100 1.100 peak 725 volume 0.292E+06 ppm1 2.429 ppm2 7.239
ASSI
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
(( segid " " and resid "69 " and name "HA "))
3.100 1.200 1.200 peak 732 volume 0.284E+06 ppm1 3.059 ppm2 3.768
ASSI
(( segid " " and resid "61 " and name "HG1 ")
OR
( segid " " and resid "61 " and name "HG2 "))
(( segid " " and resid "60 " and name "HB2 "))
3.000 1.100 1.100 peak 736 volume 0.281E+06 ppm1 1.044 ppm2 2.633
ASSI
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "76 " and name "HN "))
3.100 1.200 1.200 peak 744 volume 0.275E+06 ppm1 3.826 ppm2 7.160
ASSI
(( segid " " and resid "41 " and name "HB "))
(( segid " " and resid "41 " and name "HN "))
2.900 1.100 1.100 peak 751 volume 0.267E+06 ppm1 1.956 ppm2 7.311
ASSI
(( segid " " and resid "44 " and name "HG1 "))
(( segid " " and resid "44 " and name "HN "))
2.900 1.100 1.100 peak 772 volume 0.257E+06 ppm1 1.451 ppm2 9.116
ASSI
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
(( segid " " and resid "17 " and name "HB1 ")
OR
( segid " " and resid "17 " and name "HB2 "))
3.000 1.100 1.100 peak 773 volume 0.256E+06 ppm1 0.972 ppm2 2.541
ASSI
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
(( segid " " and resid "11 " and name "HA "))
3.200 1.300 1.300 peak 776 volume 0.254E+06 ppm1 2.134 ppm2 5.513
ASSI
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "20 " and name "HN "))
3.000 1.100 1.100 peak 777 volume 0.254E+06 ppm1 6.359 ppm2 8.282
ASSI
(( segid " " and resid "31 " and name "HB2 "))
(( segid " " and resid "31 " and name "HN "))
3.000 1.100 1.100 peak 780 volume 0.252E+06 ppm1 2.560 ppm2 8.040
ASSI
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "36 " and name "HN "))
2.900 1.100 1.100 peak 792 volume 0.246E+06 ppm1 0.447 ppm2 8.164
ASSI
(( segid " " and resid "21 " and name "HB1 "))
(( segid " " and resid "22 " and name "HN "))
3.000 1.100 1.100 peak 794 volume 0.246E+06 ppm1 3.144 ppm2 8.492
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "36 " and name "HA "))
3.200 1.300 1.300 peak 795 volume 0.246E+06 ppm1 2.488 ppm2 4.004
ASSI
(( segid " " and resid "15 " and name "HA "))
(( segid " " and resid "15 " and name "HD21"))
3.100 1.200 1.200 peak 796 volume 0.245E+06 ppm1 5.211 ppm2 7.233
ASSI
(( segid " " and resid "66 " and name "HG2 "))
(( segid " " and resid "66 " and name "HE21"))
3.000 1.100 1.100 peak 797 volume 0.245E+06 ppm1 2.127 ppm2 7.344
ASSI
(( segid " " and resid "66 " and name "HG1 "))
(( segid " " and resid "66 " and name "HE21"))
3.000 1.100 1.100 peak 798 volume 0.245E+06 ppm1 2.212 ppm2 7.344
ASSI
(( segid " " and resid "8 " and name "HA "))
(( segid " " and resid "9 " and name "HN "))
3.100 1.200 1.200 peak 816 volume 0.239E+06 ppm1 4.273 ppm2 8.302
ASSI
(( segid " " and resid "54 " and name "HG "))
(( segid " " and resid "15 " and name "HD22"))
3.000 1.100 1.100 peak 818 volume 0.238E+06 ppm1 1.340 ppm2 6.754
ASSI
(( segid " " and resid "13 " and name "HG1 "))
(( segid " " and resid "13 " and name "HA "))
3.200 1.300 1.300 peak 819 volume 0.238E+06 ppm1 2.206 ppm2 5.251
ASSI
(( segid " " and resid "51 " and name "HB2 "))
(( segid " " and resid "52 " and name "HB2 "))
3.100 1.200 1.200 peak 825 volume 0.234E+06 ppm1 2.120 ppm2 3.460
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "55 " and name "HN "))
2.900 1.100 1.100 peak 833 volume 0.229E+06 ppm1 0.224 ppm2 8.840
ASSI
(( segid " " and resid "65 " and name "HG1 "))
(( segid " " and resid "66 " and name "HN "))
3.000 1.100 1.100 peak 842 volume 0.224E+06 ppm1 2.370 ppm2 7.456
ASSI
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "46 " and name "HG1 ")
OR
( segid " " and resid "46 " and name "HG2 "))
3.000 1.100 1.100 peak 857 volume 0.220E+06 ppm1 0.493 ppm2 2.056
ASSI
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
2.100 0.600 0.600 peak 861 volume 0.190E+07 ppm1 0.579 ppm2 1.084
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "38 " and name "HN "))
2.100 0.600 0.600 peak 863 volume 0.171E+07 ppm1 1.668 ppm2 8.532
ASSI
(( segid " " and resid "69 " and name "HG1 "))
(( segid " " and resid "69 " and name "HA "))
2.500 0.800 0.800 peak 867 volume 0.112E+07 ppm1 1.609 ppm2 3.768
ASSI
(( segid " " and resid "35 " and name "HN "))
(( segid " " and resid "36 " and name "HN "))
2.300 0.700 0.700 peak 869 volume 0.993E+06 ppm1 7.691 ppm2 8.171
ASSI
(( segid " " and resid "73 " and name "HG1 ")
OR
( segid " " and resid "73 " and name "HG2 "))
(( segid " " and resid "73 " and name "HN "))
2.500 0.800 0.800 peak 873 volume 0.678E+06 ppm1 2.330 ppm2 7.659
ASSI
(( segid " " and resid "32 " and name "HN "))
(( segid " " and resid "33 " and name "HN "))
2.400 0.700 0.700 peak 874 volume 0.669E+06 ppm1 7.658 ppm2 8.210
ASSI
(( segid " " and resid "69 " and name "HB1 "))
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
2.600 0.800 0.800 peak 875 volume 0.634E+06 ppm1 1.845 ppm2 3.059
ASSI
(( segid " " and resid "65 " and name "HG1 "))
(( segid " " and resid "65 " and name "HE21"))
2.500 0.800 0.800 peak 876 volume 0.627E+06 ppm1 2.370 ppm2 7.639
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
2.100 0.600 0.600 peak 890 volume 0.205E+07 ppm1 2.790 ppm2 6.754
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
2.100 0.600 0.600 peak 891 volume 0.205E+07 ppm1 2.823 ppm2 6.754
ASSI
(( segid " " and resid "47 " and name "HG1 "))
(( segid " " and resid "47 " and name "HD2 "))
2.200 0.600 0.600 peak 892 volume 0.170E+07 ppm1 2.002 ppm2 3.598
ASSI
(( segid " " and resid "25 " and name "HG11")
OR
( segid " " and resid "25 " and name "HG12"))
(( segid " " and resid "22 " and name "HA "))
3.000 1.100 1.100 peak 901 volume 0.350E+06 ppm1 0.926 ppm2 3.985
ASSI
(( segid " " and resid "54 " and name "HA "))
(( segid " " and resid "16 " and name "HN "))
3.000 1.100 1.100 peak 904 volume 0.322E+06 ppm1 4.594 ppm2 8.729
ASSI
(( segid " " and resid "47 " and name "HD2 "))
(( segid " " and resid "46 " and name "HA "))
3.100 1.200 1.200 peak 942 volume 0.298E+06 ppm1 3.630 ppm2 4.503
ASSI
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "46 " and name "HD2 "))
2.900 1.100 1.100 peak 979 volume 0.282E+06 ppm1 0.559 ppm2 3.532
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
3.000 1.100 1.100 peak 982 volume 0.262E+06 ppm1 0.224 ppm2 1.800
ASSI
(( segid " " and resid "68 " and name "HE2 "))
(( segid " " and resid "69 " and name "HA "))
3.200 1.300 1.300 peak 992 volume 0.231E+06 ppm1 2.744 ppm2 3.748
ASSI
(( segid " " and resid "61 " and name "HD1 "))
(( segid " " and resid "61 " and name "HD2 "))
1.800 0.400 0.400 peak 1019 volume 0.596E+07 ppm1 3.912 ppm2 3.709
ASSI
(( segid " " and resid "59 " and name "HA1 "))
(( segid " " and resid "59 " and name "HA2 "))
2.000 0.500 0.500 peak 1021 volume 0.578E+07 ppm1 4.463 ppm2 3.926
ASSI
(( segid " " and resid "46 " and name "HD1 "))
(( segid " " and resid "46 " and name "HD2 "))
1.800 0.400 0.400 peak 1023 volume 0.544E+07 ppm1 3.931 ppm2 3.532
ASSI
(( segid " " and resid "62 " and name "HG1 "))
(( segid " " and resid "62 " and name "HG2 "))
1.800 0.400 0.400 peak 1026 volume 0.530E+07 ppm1 2.265 ppm2 1.859
ASSI
(( segid " " and resid "65 " and name "HG1 "))
(( segid " " and resid "65 " and name "HG2 "))
1.800 0.400 0.400 peak 1027 volume 0.526E+07 ppm1 2.376 ppm2 2.029
ASSI
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "63 " and name "HA2 "))
2.000 0.500 0.500 peak 1029 volume 0.518E+07 ppm1 4.030 ppm2 3.729
ASSI
(( segid " " and resid "31 " and name "HB1 "))
(( segid " " and resid "31 " and name "HB2 "))
1.900 0.500 0.500 peak 1039 volume 0.462E+07 ppm1 2.796 ppm2 2.567
ASSI
(( segid " " and resid "52 " and name "HA "))
(( segid " " and resid "52 " and name "HB1 "))
2.000 0.500 0.500 peak 1042 volume 0.452E+07 ppm1 4.515 ppm2 3.676
ASSI
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
1.900 0.500 0.500 peak 1053 volume 0.391E+07 ppm1 0.841 ppm2 0.612
ASSI
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
1.900 0.500 0.500 peak 1060 volume 0.373E+07 ppm1 1.051 ppm2 0.763
ASSI
(( segid " " and resid "74 " and name "HA "))
(( segid " " and resid "74 " and name "HD21")
OR
( segid " " and resid "74 " and name "HD23")
OR
( segid " " and resid "74 " and name "HD22"))
2.000 0.500 0.500 peak 1066 volume 0.365E+07 ppm1 4.089 ppm2 0.776
ASSI
(( segid " " and resid "47 " and name "HB1 ")
OR
( segid " " and resid "47 " and name "HB2 "))
(( segid " " and resid "47 " and name "HG2 "))
2.000 0.500 0.500 peak 1067 volume 0.361E+07 ppm1 2.317 ppm2 1.911
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
2.000 0.500 0.500 peak 1073 volume 0.349E+07 ppm1 3.971 ppm2 1.084
ASSI
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
1.900 0.500 0.500 peak 1074 volume 0.348E+07 ppm1 1.851 ppm2 0.619
ASSI
(( segid " " and resid "32 " and name "HA "))
(( segid " " and resid "32 " and name "HB "))
2.100 0.600 0.600 peak 1076 volume 0.324E+07 ppm1 3.689 ppm2 1.964
ASSI
(( segid " " and resid "57 " and name "HG11"))
(( segid " " and resid "57 " and name "HG12"))
2.000 0.500 0.500 peak 1082 volume 0.309E+07 ppm1 1.386 ppm2 0.527
ASSI
(( segid " " and resid "8 " and name "HB1 ")
OR
( segid " " and resid "8 " and name "HB2 "))
(( segid " " and resid "8 " and name "HG1 ")
OR
( segid " " and resid "8 " and name "HG2 "))
2.000 0.500 0.500 peak 1089 volume 0.279E+07 ppm1 2.206 ppm2 1.931
ASSI
(( segid " " and resid "16 " and name "HB "))
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
2.000 0.500 0.500 peak 1090 volume 0.275E+07 ppm1 1.530 ppm2 0.979
ASSI
(( segid " " and resid "55 " and name "HB "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
2.000 0.500 0.500 peak 1092 volume 0.267E+07 ppm1 1.523 ppm2 0.455
ASSI
(( segid " " and resid "45 " and name "HA "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
2.100 0.600 0.600 peak 1093 volume 0.263E+07 ppm1 4.364 ppm2 0.770
ASSI
(( segid " " and resid "45 " and name "HA "))
(( segid " " and resid "46 " and name "HD1 "))
2.200 0.600 0.600 peak 1094 volume 0.260E+07 ppm1 4.364 ppm2 3.932
ASSI
(( segid " " and resid "41 " and name "HB "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
2.000 0.500 0.500 peak 1095 volume 0.260E+07 ppm1 1.956 ppm2 0.448
ASSI
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
2.000 0.500 0.500 peak 1097 volume 0.252E+07 ppm1 1.064 ppm2 0.448
ASSI
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
2.000 0.500 0.500 peak 1098 volume 0.249E+07 ppm1 0.789 ppm2 0.231
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "41 " and name "HB "))
2.200 0.600 0.600 peak 1100 volume 0.245E+07 ppm1 5.060 ppm2 1.964
ASSI
(( segid " " and resid "54 " and name "HB1 ")
OR
( segid " " and resid "54 " and name "HB2 "))
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
2.000 0.500 0.500 peak 1103 volume 0.242E+07 ppm1 1.438 ppm2 0.724
ASSI
(( segid " " and resid "42 " and name "HA "))
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
2.200 0.600 0.600 peak 1105 volume 0.240E+07 ppm1 4.601 ppm2 3.689
ASSI
(( segid " " and resid "23 " and name "HB1 "))
(( segid " " and resid "23 " and name "HB2 "))
2.100 0.600 0.600 peak 1113 volume 0.231E+07 ppm1 3.124 ppm2 3.020
ASSI
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
2.100 0.600 0.600 peak 1118 volume 0.227E+07 ppm1 1.287 ppm2 1.078
ASSI
(( segid " " and resid "13 " and name "HG1 "))
(( segid " " and resid "13 " and name "HG2 "))
2.100 0.600 0.600 peak 1122 volume 0.224E+07 ppm1 2.186 ppm2 1.977
ASSI
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
2.000 0.500 0.500 peak 1125 volume 0.221E+07 ppm1 0.454 ppm2 0.225
ASSI
(( segid " " and resid "45 " and name "HA "))
(( segid " " and resid "46 " and name "HD2 "))
2.200 0.600 0.600 peak 1128 volume 0.216E+07 ppm1 4.364 ppm2 3.532
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "37 " and name "HB2 "))
2.200 0.600 0.600 peak 1131 volume 0.212E+07 ppm1 4.338 ppm2 2.541
ASSI
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "9 " and name "HB2 "))
2.300 0.700 0.700 peak 1134 volume 0.207E+07 ppm1 4.522 ppm2 2.390
ASSI
(( segid " " and resid "36 " and name "HN "))
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
2.100 0.600 0.600 peak 1135 volume 0.207E+07 ppm1 8.170 ppm2 1.878
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "43 " and name "HG21")
OR
( segid " " and resid "43 " and name "HG23")
OR
( segid " " and resid "43 " and name "HG22"))
2.200 0.600 0.600 peak 1138 volume 0.204E+07 ppm1 4.561 ppm2 0.560
ASSI
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
(( segid " " and resid "35 " and name "HD11")
OR
( segid " " and resid "35 " and name "HD13")
OR
( segid " " and resid "35 " and name "HD12"))
2.100 0.600 0.600 peak 1144 volume 0.200E+07 ppm1 1.044 ppm2 0.671
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
2.200 0.600 0.600 peak 1146 volume 0.197E+07 ppm1 4.909 ppm2 0.750
ASSI
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "14 " and name "HB "))
2.300 0.700 0.700 peak 1150 volume 0.192E+07 ppm1 4.509 ppm2 1.655
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
2.200 0.600 0.600 peak 1152 volume 0.188E+07 ppm1 5.060 ppm2 0.527
ASSI
(( segid " " and resid "16 " and name "HA "))
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
2.200 0.600 0.600 peak 1153 volume 0.188E+07 ppm1 4.200 ppm2 0.986
ASSI
(( segid " " and resid "69 " and name "HD1 ")
OR
( segid " " and resid "69 " and name "HD2 "))
(( segid " " and resid "69 " and name "HG2 "))
2.200 0.600 0.600 peak 1155 volume 0.186E+07 ppm1 3.046 ppm2 1.419
ASSI
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
2.300 0.700 0.700 peak 1164 volume 0.177E+07 ppm1 4.522 ppm2 0.724
ASSI
(( segid " " and resid "33 " and name "HA "))
(( segid " " and resid "33 " and name "HB2 "))
2.300 0.700 0.700 peak 1176 volume 0.164E+07 ppm1 4.312 ppm2 2.672
ASSI
(( segid " " and resid "47 " and name "HA "))
(( segid " " and resid "47 " and name "HB1 ")
OR
( segid " " and resid "47 " and name "HB2 "))
2.300 0.700 0.700 peak 1182 volume 0.161E+07 ppm1 4.456 ppm2 2.325
ASSI
(( segid " " and resid "12 " and name "HA "))
(( segid " " and resid "12 " and name "HB "))
2.400 0.700 0.700 peak 1199 volume 0.150E+07 ppm1 4.233 ppm2 1.787
ASSI
(( segid " " and resid "55 " and name "HA "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
2.300 0.700 0.700 peak 1208 volume 0.141E+07 ppm1 4.305 ppm2 0.448
ASSI
(( segid " " and resid "38 " and name "HG1 "))
(( segid " " and resid "38 " and name "HB1 "))
2.300 0.700 0.700 peak 1209 volume 0.141E+07 ppm1 1.825 ppm2 1.668
ASSI
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "70 " and name "HB2 "))
2.400 0.700 0.700 peak 1216 volume 0.139E+07 ppm1 3.479 ppm2 1.937
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "60 " and name "HB1 "))
2.400 0.700 0.700 peak 1217 volume 0.138E+07 ppm1 4.771 ppm2 2.830
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
2.400 0.700 0.700 peak 1231 volume 0.130E+07 ppm1 5.329 ppm2 2.134
ASSI
(( segid " " and resid "70 " and name "HG1 ")
OR
( segid " " and resid "70 " and name "HG2 "))
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
2.300 0.700 0.700 peak 1236 volume 0.129E+07 ppm1 2.376 ppm2 0.796
ASSI
(( segid " " and resid "56 " and name "HA "))
(( segid " " and resid "56 " and name "HB1 ")
OR
( segid " " and resid "56 " and name "HB2 "))
2.400 0.700 0.700 peak 1237 volume 0.129E+07 ppm1 5.139 ppm2 1.623
ASSI
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "17 " and name "HB1 ")
OR
( segid " " and resid "17 " and name "HB2 "))
2.400 0.700 0.700 peak 1238 volume 0.128E+07 ppm1 4.063 ppm2 2.548
ASSI
(( segid " " and resid "58 " and name "HN "))
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
2.200 0.600 0.600 peak 1241 volume 0.126E+07 ppm1 8.485 ppm2 0.750
ASSI
(( segid " " and resid "21 " and name "HA "))
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
2.400 0.700 0.700 peak 1242 volume 0.126E+07 ppm1 4.148 ppm2 0.684
ASSI
(( segid " " and resid "54 " and name "HN "))
(( segid " " and resid "54 " and name "HB1 ")
OR
( segid " " and resid "54 " and name "HB2 "))
2.300 0.700 0.700 peak 1250 volume 0.123E+07 ppm1 7.724 ppm2 1.426
ASSI
(( segid " " and resid "54 " and name "HA "))
(( segid " " and resid "54 " and name "HG "))
2.500 0.800 0.800 peak 1252 volume 0.122E+07 ppm1 4.633 ppm2 1.334
ASSI
(( segid " " and resid "9 " and name "HB2 "))
(( segid " " and resid "9 " and name "HG1 ")
OR
( segid " " and resid "9 " and name "HG2 "))
2.300 0.700 0.700 peak 1253 volume 0.122E+07 ppm1 2.429 ppm2 1.918
ASSI
(( segid " " and resid "33 " and name "HA "))
(( segid " " and resid "33 " and name "HB1 "))
2.500 0.800 0.800 peak 1256 volume 0.120E+07 ppm1 4.332 ppm2 2.790
ASSI
(( segid " " and resid "69 " and name "HN "))
(( segid " " and resid "69 " and name "HB2 "))
2.300 0.700 0.700 peak 1263 volume 0.118E+07 ppm1 7.114 ppm2 1.747
ASSI
(( segid " " and resid "38 " and name "HN "))
(( segid " " and resid "37 " and name "HN "))
2.200 0.600 0.600 peak 1264 volume 0.118E+07 ppm1 8.531 ppm2 7.751
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "23 " and name "HB2 "))
2.500 0.800 0.800 peak 1269 volume 0.116E+07 ppm1 4.397 ppm2 3.020
ASSI
(( segid " " and resid "12 " and name "HA "))
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
2.400 0.700 0.700 peak 1273 volume 0.115E+07 ppm1 4.220 ppm2 0.704
ASSI
(( segid " " and resid "44 " and name "HD1 ")
OR
( segid " " and resid "44 " and name "HD2 "))
(( segid " " and resid "44 " and name "HG2 "))
2.400 0.700 0.700 peak 1275 volume 0.113E+07 ppm1 2.967 ppm2 1.216
ASSI
(( segid " " and resid "60 " and name "HN "))
(( segid " " and resid "60 " and name "HB1 "))
2.300 0.700 0.700 peak 1279 volume 0.111E+07 ppm1 8.157 ppm2 2.830
ASSI
(( segid " " and resid "11 " and name "HA "))
(( segid " " and resid "11 " and name "HB1 "))
2.500 0.800 0.800 peak 1282 volume 0.111E+07 ppm1 5.513 ppm2 2.843
ASSI
(( segid " " and resid "21 " and name "HA "))
(( segid " " and resid "21 " and name "HB2 "))
2.500 0.800 0.800 peak 1292 volume 0.107E+07 ppm1 4.148 ppm2 2.954
ASSI
(( segid " " and resid "59 " and name "HA1 "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
2.500 0.800 0.800 peak 1293 volume 0.107E+07 ppm1 4.463 ppm2 0.533
ASSI
(( segid " " and resid "12 " and name "HA "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
2.500 0.800 0.800 peak 1294 volume 0.107E+07 ppm1 4.220 ppm2 0.638
ASSI
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
2.300 0.700 0.700 peak 1301 volume 0.105E+07 ppm1 6.372 ppm2 0.979
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "23 " and name "HB1 "))
2.500 0.800 0.800 peak 1305 volume 0.103E+07 ppm1 4.397 ppm2 3.112
ASSI
(( segid " " and resid "54 " and name "HA "))
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
2.500 0.800 0.800 peak 1306 volume 0.103E+07 ppm1 4.627 ppm2 0.730
ASSI
(( segid " " and resid "21 " and name "HA "))
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
2.500 0.800 0.800 peak 1314 volume 0.101E+07 ppm1 4.168 ppm2 1.787
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "7 " and name "HB1 "))
2.500 0.800 0.800 peak 1321 volume 0.985E+06 ppm1 4.607 ppm2 2.738
ASSI
(( segid " " and resid "51 " and name "HA "))
(( segid " " and resid "51 " and name "HG1 ")
OR
( segid " " and resid "51 " and name "HG2 "))
2.600 0.800 0.800 peak 1333 volume 0.949E+06 ppm1 3.964 ppm2 1.997
ASSI
(( segid " " and resid "15 " and name "HA "))
(( segid " " and resid "15 " and name "HB1 "))
2.600 0.800 0.800 peak 1337 volume 0.942E+06 ppm1 5.198 ppm2 2.633
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
2.400 0.700 0.700 peak 1338 volume 0.939E+06 ppm1 2.508 ppm2 0.441
ASSI
(( segid " " and resid "57 " and name "HG11"))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
2.400 0.700 0.700 peak 1339 volume 0.930E+06 ppm1 1.392 ppm2 0.448
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "20 " and name "HB1 "))
2.600 0.800 0.800 peak 1341 volume 0.916E+06 ppm1 4.712 ppm2 3.296
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "31 " and name "HB2 "))
2.600 0.800 0.800 peak 1343 volume 0.912E+06 ppm1 4.515 ppm2 2.574
ASSI
(( segid " " and resid "40 " and name "HN "))
(( segid " " and resid "41 " and name "HN "))
2.300 0.700 0.700 peak 1348 volume 0.906E+06 ppm1 7.717 ppm2 7.305
ASSI
(( segid " " and resid "34 " and name "HB1 ")
OR
( segid " " and resid "34 " and name "HB2 "))
(( segid " " and resid "35 " and name "HD11")
OR
( segid " " and resid "35 " and name "HD13")
OR
( segid " " and resid "35 " and name "HD12"))
2.400 0.700 0.700 peak 1350 volume 0.897E+06 ppm1 2.009 ppm2 0.678
ASSI
(( segid " " and resid "49 " and name "HA "))
(( segid " " and resid "49 " and name "HB2 "))
2.600 0.800 0.800 peak 1353 volume 0.893E+06 ppm1 4.292 ppm2 3.853
ASSI
(( segid " " and resid "55 " and name "HB "))
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
2.500 0.800 0.800 peak 1357 volume 0.881E+06 ppm1 1.530 ppm2 0.822
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "23 " and name "HB1 "))
2.600 0.800 0.800 peak 1380 volume 0.816E+06 ppm1 4.673 ppm2 3.112
ASSI
(( segid " " and resid "19 " and name "HE1 ")
OR
( segid " " and resid "19 " and name "HE2 "))
(( segid " " and resid "19 " and name "HG1 "))
2.500 0.800 0.800 peak 1382 volume 0.812E+06 ppm1 2.573 ppm2 0.783
ASSI
(( segid " " and resid "55 " and name "HA "))
(( segid " " and resid "55 " and name "HB "))
2.600 0.800 0.800 peak 1385 volume 0.802E+06 ppm1 4.299 ppm2 1.518
ASSI
(( segid " " and resid "15 " and name "HA "))
(( segid " " and resid "15 " and name "HB2 "))
2.600 0.800 0.800 peak 1386 volume 0.800E+06 ppm1 5.204 ppm2 2.430
ASSI
(( segid " " and resid "57 " and name "HN "))
(( segid " " and resid "57 " and name "HB "))
2.400 0.700 0.700 peak 1389 volume 0.797E+06 ppm1 8.925 ppm2 1.570
ASSI
(( segid " " and resid "68 " and name "HA "))
(( segid " " and resid "68 " and name "HB1 "))
2.600 0.800 0.800 peak 1390 volume 0.796E+06 ppm1 3.407 ppm2 1.806
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
2.600 0.800 0.800 peak 1392 volume 0.785E+06 ppm1 4.903 ppm2 0.651
ASSI
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
2.600 0.800 0.800 peak 1393 volume 0.783E+06 ppm1 4.030 ppm2 0.533
ASSI
(( segid " " and resid "52 " and name "HA "))
(( segid " " and resid "52 " and name "HB2 "))
2.700 0.900 0.900 peak 1398 volume 0.768E+06 ppm1 4.496 ppm2 3.460
ASSI
(( segid " " and resid "53 " and name "HA "))
(( segid " " and resid "53 " and name "HB1 "))
2.700 0.900 0.900 peak 1404 volume 0.760E+06 ppm1 4.962 ppm2 2.935
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "13 " and name "HB2 "))
2.700 0.900 0.900 peak 1408 volume 0.744E+06 ppm1 5.250 ppm2 1.741
ASSI
(( segid " " and resid "42 " and name "HN "))
(( segid " " and resid "58 " and name "HN "))
2.400 0.700 0.700 peak 1410 volume 0.741E+06 ppm1 8.931 ppm2 8.479
ASSI
(( segid " " and resid "16 " and name "HA "))
(( segid " " and resid "16 " and name "HB "))
2.700 0.900 0.900 peak 1414 volume 0.724E+06 ppm1 4.207 ppm2 1.531
ASSI
(( segid " " and resid "8 " and name "HA "))
(( segid " " and resid "8 " and name "HB1 ")
OR
( segid " " and resid "8 " and name "HB2 "))
2.700 0.900 0.900 peak 1418 volume 0.708E+06 ppm1 4.273 ppm2 2.193
ASSI
(( segid " " and resid "55 " and name "HA "))
(( segid " " and resid "55 " and name "HG11"))
2.700 0.900 0.900 peak 1425 volume 0.689E+06 ppm1 4.305 ppm2 1.314
ASSI
(( segid " " and resid "53 " and name "HB1 "))
(( segid " " and resid "16 " and name "HB "))
2.600 0.800 0.800 peak 1426 volume 0.683E+06 ppm1 2.941 ppm2 1.550
ASSI
(( segid " " and resid "12 " and name "HN "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
2.400 0.700 0.700 peak 1431 volume 0.672E+06 ppm1 8.761 ppm2 0.632
ASSI
(( segid " " and resid "68 " and name "HA "))
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
2.700 0.900 0.900 peak 1433 volume 0.669E+06 ppm1 3.413 ppm2 1.642
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "43 " and name "HB "))
2.700 0.900 0.900 peak 1436 volume 0.661E+06 ppm1 4.574 ppm2 1.714
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
2.700 0.900 0.900 peak 1438 volume 0.656E+06 ppm1 5.060 ppm2 0.448
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
2.600 0.800 0.800 peak 1444 volume 0.646E+06 ppm1 2.836 ppm2 2.147
ASSI
(( segid " " and resid "35 " and name "HN "))
(( segid " " and resid "34 " and name "HN "))
2.500 0.800 0.800 peak 1468 volume 0.595E+06 ppm1 7.691 ppm2 7.528
ASSI
(( segid " " and resid "12 " and name "HN "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
2.600 0.800 0.800 peak 1469 volume 0.594E+06 ppm1 8.767 ppm2 6.754
ASSI
(( segid " " and resid "49 " and name "HA "))
(( segid " " and resid "49 " and name "HB1 "))
2.800 1.000 1.000 peak 1470 volume 0.594E+06 ppm1 4.299 ppm2 4.017
ASSI
(( segid " " and resid "53 " and name "HA "))
(( segid " " and resid "53 " and name "HB2 "))
2.800 1.000 1.000 peak 1475 volume 0.588E+06 ppm1 4.962 ppm2 2.626
ASSI
(( segid " " and resid "11 " and name "HN "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
2.600 0.800 0.800 peak 1477 volume 0.581E+06 ppm1 7.868 ppm2 6.754
ASSI
(( segid " " and resid "56 " and name "HA "))
(( segid " " and resid "56 " and name "HG1 "))
2.800 1.000 1.000 peak 1482 volume 0.574E+06 ppm1 5.139 ppm2 1.465
ASSI
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
2.600 0.800 0.800 peak 1487 volume 0.563E+06 ppm1 6.589 ppm2 0.789
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "57 " and name "HB "))
2.800 1.000 1.000 peak 1489 volume 0.559E+06 ppm1 4.909 ppm2 1.583
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "13 " and name "HB1 "))
2.800 1.000 1.000 peak 1490 volume 0.558E+06 ppm1 5.250 ppm2 1.846
ASSI
(( segid " " and resid "60 " and name "HN "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
2.500 0.800 0.800 peak 1493 volume 0.552E+06 ppm1 8.157 ppm2 0.533
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "13 " and name "HG2 "))
2.800 1.000 1.000 peak 1494 volume 0.551E+06 ppm1 5.250 ppm2 1.964
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
2.600 0.800 0.800 peak 1497 volume 0.548E+06 ppm1 2.501 ppm2 1.065
ASSI
(( segid " " and resid "21 " and name "HA "))
(( segid " " and resid "21 " and name "HB1 "))
2.800 1.000 1.000 peak 1503 volume 0.540E+06 ppm1 4.141 ppm2 3.164
ASSI
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "36 " and name "HG1 "))
2.700 0.900 0.900 peak 1504 volume 0.537E+06 ppm1 1.904 ppm2 1.655
ASSI
(( segid " " and resid "16 " and name "HA "))
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
2.800 1.000 1.000 peak 1505 volume 0.535E+06 ppm1 4.194 ppm2 1.301
ASSI
(( segid " " and resid "45 " and name "HA "))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
2.800 1.000 1.000 peak 1512 volume 0.529E+06 ppm1 4.364 ppm2 0.540
ASSI
(( segid " " and resid "20 " and name "HB1 "))
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
2.600 0.800 0.800 peak 1516 volume 0.520E+06 ppm1 3.302 ppm2 0.697
ASSI
(( segid " " and resid "44 " and name "HA "))
(( segid " " and resid "44 " and name "HG1 "))
2.800 1.000 1.000 peak 1521 volume 0.514E+06 ppm1 4.483 ppm2 1.445
ASSI
(( segid " " and resid "51 " and name "HA "))
(( segid " " and resid "51 " and name "HB1 "))
2.800 1.000 1.000 peak 1524 volume 0.513E+06 ppm1 3.964 ppm2 2.193
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "57 " and name "HG11"))
2.800 1.000 1.000 peak 1527 volume 0.508E+06 ppm1 4.909 ppm2 1.386
ASSI
(( segid " " and resid "61 " and name "HD1 "))
(( segid " " and resid "60 " and name "HB1 "))
2.700 0.900 0.900 peak 1530 volume 0.505E+06 ppm1 3.918 ppm2 2.830
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "57 " and name "HG12"))
2.800 1.000 1.000 peak 1531 volume 0.505E+06 ppm1 4.909 ppm2 0.533
ASSI
(( segid " " and resid "15 " and name "HN "))
(( segid " " and resid "14 " and name "HB "))
2.600 0.800 0.800 peak 1537 volume 0.493E+06 ppm1 8.452 ppm2 1.662
ASSI
(( segid " " and resid "62 " and name "HN "))
(( segid " " and resid "62 " and name "HA "))
2.800 1.000 1.000 peak 1539 volume 0.489E+06 ppm1 8.164 ppm2 4.063
ASSI
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "21 " and name "HB1 "))
2.700 0.900 0.900 peak 1546 volume 0.473E+06 ppm1 7.980 ppm2 3.164
ASSI
(( segid " " and resid "40 " and name "HN "))
(( segid " " and resid "39 " and name "HN "))
2.600 0.800 0.800 peak 1575 volume 0.428E+06 ppm1 7.717 ppm2 7.600
ASSI
(( segid " " and resid "12 " and name "HN "))
(( segid " " and resid "12 " and name "HB "))
2.700 0.900 0.900 peak 1578 volume 0.425E+06 ppm1 8.767 ppm2 1.787
ASSI
(( segid " " and resid "33 " and name "HN "))
(( segid " " and resid "33 " and name "HB1 "))
2.700 0.900 0.900 peak 1582 volume 0.422E+06 ppm1 8.203 ppm2 2.790
ASSI
(( segid " " and resid "56 " and name "HA "))
(( segid " " and resid "56 " and name "HG2 "))
2.900 1.100 1.100 peak 1585 volume 0.411E+06 ppm1 5.139 ppm2 1.347
ASSI
(( segid " " and resid "61 " and name "HD1 "))
(( segid " " and resid "60 " and name "HB2 "))
2.800 1.000 1.000 peak 1587 volume 0.409E+06 ppm1 3.905 ppm2 2.613
ASSI
(( segid " " and resid "46 " and name "HA "))
(( segid " " and resid "46 " and name "HB1 ")
OR
( segid " " and resid "46 " and name "HB2 "))
3.000 1.100 1.100 peak 1590 volume 0.403E+06 ppm1 4.515 ppm2 2.233
ASSI
(( segid " " and resid "13 " and name "HN "))
(( segid " " and resid "13 " and name "HG2 "))
2.800 1.000 1.000 peak 1607 volume 0.383E+06 ppm1 8.354 ppm2 1.970
ASSI
(( segid " " and resid "52 " and name "HN "))
(( segid " " and resid "51 " and name "HB2 "))
2.800 1.000 1.000 peak 1623 volume 0.372E+06 ppm1 8.485 ppm2 2.134
ASSI
(( segid " " and resid "14 " and name "HB "))
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
2.900 1.100 1.100 peak 1629 volume 0.369E+06 ppm1 1.628 ppm2 0.829
ASSI
(( segid " " and resid "45 " and name "HA "))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
2.900 1.100 1.100 peak 1630 volume 0.367E+06 ppm1 4.358 ppm2 0.225
ASSI
(( segid " " and resid "11 " and name "HA "))
(( segid " " and resid "58 " and name "HB1 "))
3.000 1.100 1.100 peak 1634 volume 0.365E+06 ppm1 5.552 ppm2 1.944
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
3.000 1.100 1.100 peak 1645 volume 0.359E+06 ppm1 5.053 ppm2 3.689
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "11 " and name "HB1 "))
3.000 1.100 1.100 peak 1657 volume 0.351E+06 ppm1 5.336 ppm2 2.836
ASSI
(( segid " " and resid "42 " and name "HN "))
(( segid " " and resid "41 " and name "HA "))
2.900 1.100 1.100 peak 1667 volume 0.343E+06 ppm1 8.944 ppm2 5.061
ASSI
(( segid " " and resid "39 " and name "HN "))
(( segid " " and resid "39 " and name "HB1 "))
2.800 1.000 1.000 peak 1670 volume 0.340E+06 ppm1 7.599 ppm2 3.237
ASSI
(( segid " " and resid "20 " and name "HN "))
(( segid " " and resid "20 " and name "HB1 "))
2.800 1.000 1.000 peak 1673 volume 0.339E+06 ppm1 8.282 ppm2 3.302
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
3.000 1.100 1.100 peak 1676 volume 0.337E+06 ppm1 5.244 ppm2 0.842
ASSI
(( segid " " and resid "39 " and name "HA "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
3.000 1.100 1.100 peak 1679 volume 0.335E+06 ppm1 4.673 ppm2 0.435
ASSI
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
2.800 1.000 1.000 peak 1680 volume 0.335E+06 ppm1 7.048 ppm2 0.448
ASSI
(( segid " " and resid "11 " and name "HN "))
(( segid " " and resid "10 " and name "HB2 "))
2.800 1.000 1.000 peak 1682 volume 0.335E+06 ppm1 7.868 ppm2 2.403
ASSI
(( segid " " and resid "15 " and name "HB2 "))
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
2.800 1.000 1.000 peak 1688 volume 0.331E+06 ppm1 2.462 ppm2 0.737
ASSI
(( segid " " and resid "31 " and name "HD21"))
(( segid " " and resid "31 " and name "HB1 "))
2.800 1.000 1.000 peak 1690 volume 0.331E+06 ppm1 7.560 ppm2 2.804
ASSI
(( segid " " and resid "28 " and name "HA "))
(( segid " " and resid "28 " and name "HB1 ")
OR
( segid " " and resid "28 " and name "HB2 "))
3.100 1.200 1.200 peak 1703 volume 0.322E+06 ppm1 4.128 ppm2 3.755
ASSI
(( segid " " and resid "10 " and name "HN "))
(( segid " " and resid "10 " and name "HB2 "))
2.800 1.000 1.000 peak 1706 volume 0.321E+06 ppm1 8.629 ppm2 2.416
ASSI
(( segid " " and resid "44 " and name "HA "))
(( segid " " and resid "44 " and name "HG2 "))
3.100 1.200 1.200 peak 1731 volume 0.305E+06 ppm1 4.476 ppm2 1.216
ASSI
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
2.900 1.100 1.100 peak 1735 volume 0.303E+06 ppm1 6.359 ppm2 0.678
ASSI
(( segid " " and resid "15 " and name "HN "))
(( segid " " and resid "15 " and name "HB2 "))
2.900 1.100 1.100 peak 1747 volume 0.296E+06 ppm1 8.446 ppm2 2.436
ASSI
(( segid " " and resid "15 " and name "HA "))
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
3.000 1.100 1.100 peak 1755 volume 0.292E+06 ppm1 5.172 ppm2 0.730
ASSI
(( segid " " and resid "72 " and name "HN "))
(( segid " " and resid "69 " and name "HA "))
3.000 1.100 1.100 peak 1756 volume 0.292E+06 ppm1 7.842 ppm2 3.775
ASSI
(( segid " " and resid "54 " and name "HA "))
(( segid " " and resid "16 " and name "HB "))
3.100 1.200 1.200 peak 1766 volume 0.289E+06 ppm1 4.627 ppm2 1.544
ASSI
(( segid " " and resid "16 " and name "HN "))
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
2.900 1.100 1.100 peak 1784 volume 0.279E+06 ppm1 8.708 ppm2 1.294
ASSI
(( segid " " and resid "53 " and name "HD21"))
(( segid " " and resid "53 " and name "HA "))
3.100 1.200 1.200 peak 1792 volume 0.275E+06 ppm1 7.442 ppm2 4.943
ASSI
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "16 " and name "HB "))
3.000 1.100 1.100 peak 1799 volume 0.272E+06 ppm1 6.359 ppm2 1.518
ASSI
(( segid " " and resid "55 " and name "HA "))
(( segid " " and resid "46 " and name "HD2 "))
3.200 1.300 1.300 peak 1804 volume 0.270E+06 ppm1 4.279 ppm2 3.532
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "59 " and name "HA1 "))
3.300 1.400 1.400 peak 1808 volume 0.268E+06 ppm1 5.067 ppm2 4.444
ASSI
(( segid " " and resid "25 " and name "HN "))
(( segid " " and resid "22 " and name "HA "))
3.100 1.200 1.200 peak 1813 volume 0.266E+06 ppm1 7.442 ppm2 3.978
ASSI
(( segid " " and resid "29 " and name "HA2 "))
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
3.100 1.200 1.200 peak 1830 volume 0.260E+06 ppm1 3.643 ppm2 0.855
ASSI
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "36 " and name "HG2 "))
3.000 1.100 1.100 peak 1841 volume 0.257E+06 ppm1 1.917 ppm2 1.465
ASSI
(( segid " " and resid "69 " and name "HN "))
(( segid " " and resid "68 " and name "HG2 "))
3.000 1.100 1.100 peak 1847 volume 0.252E+06 ppm1 7.107 ppm2 1.130
ASSI
(( segid " " and resid "39 " and name "HA "))
(( segid " " and resid "39 " and name "HB2 "))
3.200 1.300 1.300 peak 1848 volume 0.251E+06 ppm1 4.725 ppm2 2.521
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
3.100 1.200 1.200 peak 1853 volume 0.250E+06 ppm1 4.673 ppm2 0.973
ASSI
(( segid " " and resid "8 " and name "HA "))
(( segid " " and resid "8 " and name "HG1 ")
OR
( segid " " and resid "8 " and name "HG2 "))
3.200 1.300 1.300 peak 1872 volume 0.244E+06 ppm1 4.273 ppm2 1.924
ASSI
(( segid " " and resid "38 " and name "HE21"))
(( segid " " and resid "38 " and name "HA "))
3.100 1.200 1.200 peak 1881 volume 0.241E+06 ppm1 6.891 ppm2 3.709
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "30 " and name "HB1 ")
OR
( segid " " and resid "30 " and name "HB3 ")
OR
( segid " " and resid "30 " and name "HB2 "))
3.200 1.300 1.300 peak 1883 volume 0.241E+06 ppm1 4.522 ppm2 1.373
ASSI
(( segid " " and resid "47 " and name "HD1 "))
(( segid " " and resid "46 " and name "HB1 ")
OR
( segid " " and resid "46 " and name "HB2 "))
3.100 1.200 1.200 peak 1894 volume 0.238E+06 ppm1 3.682 ppm2 2.252
ASSI
(( segid " " and resid "59 " and name "HN "))
(( segid " " and resid "59 " and name "HA1 "))
3.100 1.200 1.200 peak 1901 volume 0.234E+06 ppm1 8.354 ppm2 4.444
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
3.200 1.300 1.300 peak 1907 volume 0.233E+06 ppm1 5.336 ppm2 0.750
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "11 " and name "HB2 "))
3.200 1.300 1.300 peak 1915 volume 0.230E+06 ppm1 5.349 ppm2 2.790
ASSI
(( segid " " and resid "47 " and name "HB1 ")
OR
( segid " " and resid "47 " and name "HB2 "))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
3.000 1.100 1.100 peak 1930 volume 0.226E+06 ppm1 2.376 ppm2 0.553
ASSI
(( segid " " and resid "66 " and name "HE21"))
(( segid " " and resid "62 " and name "HB1 ")
OR
( segid " " and resid "62 " and name "HB2 "))
3.000 1.100 1.100 peak 1934 volume 0.226E+06 ppm1 7.350 ppm2 2.016
ASSI
(( segid " " and resid "60 " and name "HN "))
(( segid " " and resid "61 " and name "HD2 "))
3.000 1.100 1.100 peak 1953 volume 0.223E+06 ppm1 8.164 ppm2 3.696
ASSI
(( segid " " and resid "46 " and name "HD1 "))
(( segid " " and resid "46 " and name "HG1 ")
OR
( segid " " and resid "46 " and name "HG2 "))
2.200 0.600 0.600 peak 1972 volume 0.165E+07 ppm1 3.918 ppm2 2.049
ASSI
(( segid " " and resid "46 " and name "HD2 "))
(( segid " " and resid "46 " and name "HG1 ")
OR
( segid " " and resid "46 " and name "HG2 "))
2.500 0.800 0.800 peak 1975 volume 0.892E+06 ppm1 3.544 ppm2 2.042
ASSI
(( segid " " and resid "31 " and name "HD21"))
(( segid " " and resid "31 " and name "HD22"))
2.300 0.700 0.700 peak 1976 volume 0.847E+06 ppm1 7.580 ppm2 7.009
ASSI
(( segid " " and resid "26 " and name "HN "))
(( segid " " and resid "26 " and name "HA1 ")
OR
( segid " " and resid "26 " and name "HA2 "))
2.600 0.800 0.800 peak 1978 volume 0.807E+06 ppm1 7.586 ppm2 3.912
ASSI
(( segid " " and resid "70 " and name "HG1 ")
OR
( segid " " and resid "70 " and name "HG2 "))
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
2.700 0.900 0.900 peak 1993 volume 0.541E+06 ppm1 2.389 ppm2 1.813
ASSI
(( segid " " and resid "56 " and name "HD1 "))
(( segid " " and resid "56 " and name "HG2 "))
2.800 1.000 1.000 peak 2002 volume 0.406E+06 ppm1 2.947 ppm2 1.334
ASSI
(( segid " " and resid "12 " and name "HN "))
(( segid " " and resid "57 " and name "HB "))
2.800 1.000 1.000 peak 2008 volume 0.334E+06 ppm1 8.761 ppm2 1.563
ASSI
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "39 " and name "HB1 "))
2.700 0.900 0.900 peak 2069 volume 0.658E+06 ppm1 4.030 ppm2 3.217
ASSI
(( segid " " and resid "32 " and name "HA "))
(( segid " " and resid "43 " and name "HG21")
OR
( segid " " and resid "43 " and name "HG23")
OR
( segid " " and resid "43 " and name "HG22"))
2.900 1.100 1.100 peak 2072 volume 0.419E+06 ppm1 3.728 ppm2 0.560
ASSI
(( segid " " and resid "32 " and name "HA "))
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
3.000 1.100 1.100 peak 2089 volume 0.348E+06 ppm1 3.715 ppm2 0.868
ASSI
(( segid " " and resid "10 " and name "HN "))
(( segid " " and resid "59 " and name "HN "))
3.700 1.900 1.700 peak 1 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "12 " and name "HN "))
(( segid " " and resid "57 " and name "HN "))
3.500 1.700 1.500 peak 2 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "55 " and name "HN "))
4.200 2.400 1.800 peak 3 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "44 " and name "HN "))
(( segid " " and resid "56 " and name "HN "))
3.600 1.800 1.600 peak 5 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HN "))
(( segid " " and resid "21 " and name "HN "))
2.900 1.100 1.100 peak 6 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "22 " and name "HN "))
3.700 1.900 1.700 peak 7 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HN "))
(( segid " " and resid "26 " and name "HN "))
4.200 2.400 1.800 peak 9 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "31 " and name "HN "))
(( segid " " and resid "32 " and name "HN "))
4.200 2.400 1.800 peak 10 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "HN "))
(( segid " " and resid "39 " and name "HN "))
2.900 1.100 1.100 peak 17 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "44 " and name "HN "))
(( segid " " and resid "45 " and name "HN "))
3.600 1.800 1.600 peak 20 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "53 " and name "HN "))
(( segid " " and resid "54 " and name "HN "))
3.200 1.400 1.300 peak 21 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
4.800 3.000 1.200 peak 22 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "13 " and name "HN "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
5.000 3.200 1.000 peak 23 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
(( segid " " and resid "58 " and name "HA "))
6.000 4.200 0.000 peak 29 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
(( segid " " and resid "21 " and name "HD2 "))
4.700 2.900 1.300 peak 34 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "16 " and name "HD11")
OR
( segid " " and resid "16 " and name "HD13")
OR
( segid " " and resid "16 " and name "HD12"))
(( segid " " and resid "21 " and name "HD2 "))
4.900 3.100 1.100 peak 36 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HB1 "))
(( segid " " and resid "21 " and name "HD2 "))
4.500 2.700 1.500 peak 45 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HE1 "))
(( segid " " and resid "53 " and name "HA "))
4.100 2.300 1.900 peak 50 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HE1 "))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
6.000 4.200 0.000 peak 52 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
4.200 2.400 1.800 peak 56 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
3.600 1.800 1.600 peak 57 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "35 " and name "HD11")
OR
( segid " " and resid "35 " and name "HD13")
OR
( segid " " and resid "35 " and name "HD12"))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
4.700 2.900 1.300 peak 61 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "36 " and name "HA "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
4.500 2.700 1.500 peak 62 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
5.500 3.700 0.500 peak 63 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
6.000 4.200 0.000 peak 64 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "9 " and name "HN "))
3.400 1.600 1.400 peak 66 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "10 " and name "HN "))
3.100 1.300 1.200 peak 67 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "20 " and name "HN "))
3.200 1.400 1.300 peak 77 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "22 " and name "HN "))
3.100 1.300 1.200 peak 79 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "24 " and name "HN "))
2.900 1.100 1.100 peak 81 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HA "))
(( segid " " and resid "25 " and name "HN "))
2.900 1.100 1.100 peak 82 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "28 " and name "HA "))
(( segid " " and resid "28 " and name "HN "))
3.400 1.600 1.400 peak 84 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "29 " and name "HA1 "))
(( segid " " and resid "29 " and name "HN "))
3.600 1.800 1.600 peak 85 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "29 " and name "HA2 "))
(( segid " " and resid "29 " and name "HN "))
3.400 1.600 1.400 peak 86 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "30 " and name "HA "))
(( segid " " and resid "30 " and name "HN "))
3.500 1.700 1.500 peak 87 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "31 " and name "HN "))
3.100 1.300 1.200 peak 88 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "32 " and name "HA "))
(( segid " " and resid "32 " and name "HN "))
3.000 1.200 1.100 peak 89 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "34 " and name "HN "))
3.200 1.400 1.300 peak 91 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "37 " and name "HN "))
2.800 1.000 1.000 peak 94 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "39 " and name "HA "))
(( segid " " and resid "39 " and name "HN "))
3.100 1.300 1.200 peak 96 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "42 " and name "HA "))
(( segid " " and resid "42 " and name "HN "))
3.200 1.400 1.300 peak 99 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "43 " and name "HN "))
3.200 1.400 1.300 peak 100 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "45 " and name "HA "))
(( segid " " and resid "45 " and name "HN "))
3.400 1.600 1.400 peak 102 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "48 " and name "HA "))
(( segid " " and resid "48 " and name "HN "))
3.700 1.900 1.700 peak 103 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "49 " and name "HA "))
(( segid " " and resid "49 " and name "HN "))
3.200 1.400 1.300 peak 104 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "50 " and name "HA "))
(( segid " " and resid "50 " and name "HN "))
3.200 1.400 1.300 peak 105 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "51 " and name "HA "))
(( segid " " and resid "51 " and name "HN "))
3.200 1.400 1.300 peak 106 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "52 " and name "HA "))
(( segid " " and resid "52 " and name "HN "))
3.200 1.400 1.300 peak 107 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "53 " and name "HA "))
(( segid " " and resid "53 " and name "HN "))
3.400 1.600 1.400 peak 108 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "54 " and name "HA "))
(( segid " " and resid "54 " and name "HN "))
3.200 1.400 1.300 peak 109 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "7 " and name "HA "))
(( segid " " and resid "8 " and name "HN "))
3.500 1.700 1.500 peak 117 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "19 " and name "HA "))
(( segid " " and resid "20 " and name "HN "))
3.500 1.700 1.500 peak 128 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "21 " and name "HN "))
3.800 2.000 1.800 peak 129 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HA "))
(( segid " " and resid "22 " and name "HN "))
3.800 2.000 1.800 peak 130 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "23 " and name "HN "))
3.500 1.700 1.500 peak 131 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "25 " and name "HN "))
3.800 2.000 1.800 peak 133 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HA "))
(( segid " " and resid "26 " and name "HN "))
3.700 1.900 1.700 peak 134 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "28 " and name "HA "))
(( segid " " and resid "29 " and name "HN "))
3.800 2.000 1.800 peak 135 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "29 " and name "HA1 "))
(( segid " " and resid "30 " and name "HN "))
3.700 1.900 1.700 peak 136 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "30 " and name "HA "))
(( segid " " and resid "31 " and name "HN "))
3.700 1.900 1.700 peak 137 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "32 " and name "HN "))
3.700 1.900 1.700 peak 138 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "32 " and name "HA "))
(( segid " " and resid "33 " and name "HN "))
3.500 1.700 1.500 peak 139 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "33 " and name "HA "))
(( segid " " and resid "34 " and name "HN "))
3.700 1.900 1.700 peak 140 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "35 " and name "HN "))
3.800 2.000 1.800 peak 141 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "36 " and name "HN "))
3.400 1.600 1.400 peak 142 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "36 " and name "HA "))
(( segid " " and resid "37 " and name "HN "))
3.800 2.000 1.800 peak 143 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "39 " and name "HN "))
3.500 1.700 1.500 peak 145 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "39 " and name "HA "))
(( segid " " and resid "40 " and name "HN "))
3.800 2.000 1.800 peak 146 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "42 " and name "HA "))
(( segid " " and resid "43 " and name "HN "))
3.000 1.200 1.100 peak 149 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "44 " and name "HA "))
(( segid " " and resid "45 " and name "HN "))
2.700 0.900 0.900 peak 151 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "49 " and name "HA "))
(( segid " " and resid "50 " and name "HN "))
4.000 2.200 2.000 peak 152 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "50 " and name "HA "))
(( segid " " and resid "51 " and name "HN "))
4.000 2.200 2.000 peak 153 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "51 " and name "HA "))
(( segid " " and resid "52 " and name "HN "))
4.000 2.200 2.000 peak 154 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HA "))
(( segid " " and resid "24 " and name "HN "))
3.700 1.900 1.700 peak 162 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "26 " and name "HN "))
4.000 2.200 2.000 peak 164 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "29 " and name "HA1 "))
(( segid " " and resid "31 " and name "HN "))
3.700 1.900 1.700 peak 165 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "30 " and name "HA "))
(( segid " " and resid "33 " and name "HN "))
3.700 1.900 1.700 peak 166 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "34 " and name "HN "))
3.500 1.700 1.500 peak 167 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "32 " and name "HA "))
(( segid " " and resid "35 " and name "HN "))
3.700 1.900 1.700 peak 168 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "33 " and name "HA "))
(( segid " " and resid "36 " and name "HN "))
3.500 1.700 1.500 peak 169 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "37 " and name "HN "))
3.700 1.900 1.700 peak 170 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "38 " and name "HN "))
3.700 1.900 1.700 peak 171 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "15 " and name "HA "))
(( segid " " and resid "55 " and name "HN "))
3.500 1.700 1.500 peak 175 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "60 " and name "HN "))
4.000 2.200 2.000 peak 177 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "42 " and name "HN "))
(( segid " " and resid "59 " and name "HA1 "))
4.000 2.200 2.000 peak 178 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "58 " and name "HN "))
4.000 2.200 2.000 peak 179 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "13 " and name "HA "))
(( segid " " and resid "56 " and name "HA "))
2.800 1.000 1.000 peak 182 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "41 " and name "HA "))
(( segid " " and resid "59 " and name "HA2 "))
2.900 1.100 1.100 peak 184 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "57 " and name "HA "))
2.900 1.100 1.100 peak 185 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "9 " and name "HB2 "))
(( segid " " and resid "9 " and name "HN "))
3.800 2.000 1.800 peak 186 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "9 " and name "HB1 "))
(( segid " " and resid "9 " and name "HN "))
3.500 1.700 1.500 peak 187 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "13 " and name "HB1 "))
(( segid " " and resid "13 " and name "HN "))
3.100 1.300 1.200 peak 192 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "13 " and name "HB2 "))
(( segid " " and resid "13 " and name "HN "))
3.500 1.700 1.500 peak 193 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HB2 "))
(( segid " " and resid "21 " and name "HN "))
3.200 1.400 1.300 peak 203 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "24 " and name "HN "))
2.900 1.100 1.100 peak 206 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HB "))
(( segid " " and resid "25 " and name "HN "))
2.800 1.000 1.000 peak 207 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "32 " and name "HN "))
3.500 1.700 1.500 peak 210 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "37 " and name "HB1 "))
(( segid " " and resid "37 " and name "HN "))
3.100 1.300 1.200 peak 217 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "43 " and name "HB "))
(( segid " " and resid "43 " and name "HN "))
3.500 1.700 1.500 peak 226 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "53 " and name "HB1 "))
(( segid " " and resid "53 " and name "HN "))
3.200 1.400 1.300 peak 230 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "58 " and name "HB1 "))
(( segid " " and resid "58 " and name "HN "))
3.200 1.400 1.300 peak 234 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "60 " and name "HB2 "))
(( segid " " and resid "60 " and name "HN "))
2.900 1.100 1.100 peak 236 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "9 " and name "HB2 "))
(( segid " " and resid "10 " and name "HN "))
4.000 2.200 2.000 peak 238 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "9 " and name "HB1 "))
(( segid " " and resid "10 " and name "HN "))
3.500 1.700 1.500 peak 239 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "10 " and name "HB1 "))
(( segid " " and resid "11 " and name "HN "))
4.000 2.200 2.000 peak 240 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "13 " and name "HB1 "))
(( segid " " and resid "14 " and name "HN "))
3.400 1.600 1.400 peak 243 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "15 " and name "HB2 "))
(( segid " " and resid "16 " and name "HN "))
3.400 1.600 1.400 peak 246 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "17 " and name "HB1 ")
OR
( segid " " and resid "17 " and name "HB2 "))
(( segid " " and resid "20 " and name "HN "))
6.000 4.200 0.000 peak 247 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HB2 "))
(( segid " " and resid "21 " and name "HN "))
4.200 2.400 1.800 peak 248 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HB1 "))
(( segid " " and resid "21 " and name "HN "))
4.000 2.200 2.000 peak 249 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HB "))
(( segid " " and resid "26 " and name "HN "))
4.500 2.700 1.500 peak 256 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "33 " and name "HN "))
3.300 1.500 1.400 peak 259 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "37 " and name "HB2 "))
(( segid " " and resid "38 " and name "HN "))
3.400 1.600 1.400 peak 263 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "39 " and name "HN "))
3.100 1.300 1.200 peak 265 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
(( segid " " and resid "43 " and name "HN "))
3.600 1.800 1.600 peak 267 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "43 " and name "HB "))
(( segid " " and resid "44 " and name "HN "))
5.000 3.200 1.000 peak 268 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "58 " and name "HB1 "))
(( segid " " and resid "59 " and name "HN "))
3.000 1.200 1.100 peak 269 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
(( segid " " and resid "58 " and name "HN "))
4.000 2.200 2.000 peak 270 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "41 " and name "HB "))
(( segid " " and resid "60 " and name "HN "))
6.000 4.200 0.000 peak 271 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "53 " and name "HB2 "))
(( segid " " and resid "16 " and name "HN "))
3.500 1.700 1.500 peak 272 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "9 " and name "HG1 ")
OR
( segid " " and resid "9 " and name "HG2 "))
(( segid " " and resid "9 " and name "HN "))
3.300 1.500 1.400 peak 274 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
(( segid " " and resid "12 " and name "HN "))
3.500 1.700 1.500 peak 275 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
(( segid " " and resid "14 " and name "HN "))
5.000 3.200 1.000 peak 279 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "14 " and name "HN "))
3.900 2.100 1.900 peak 280 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
(( segid " " and resid "16 " and name "HN "))
3.300 1.500 1.400 peak 281 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "16 " and name "HD11")
OR
( segid " " and resid "16 " and name "HD13")
OR
( segid " " and resid "16 " and name "HD12"))
(( segid " " and resid "16 " and name "HN "))
5.700 3.900 0.300 peak 283 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "24 " and name "HN "))
3.500 1.700 1.500 peak 285 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "25 " and name "HN "))
5.200 3.400 0.800 peak 287 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
(( segid " " and resid "32 " and name "HN "))
3.600 1.800 1.600 peak 289 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "35 " and name "HN "))
3.100 1.300 1.200 peak 291 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "HG2 "))
(( segid " " and resid "38 " and name "HN "))
5.000 3.200 1.000 peak 294 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "HG1 "))
(( segid " " and resid "38 " and name "HN "))
5.000 3.200 1.000 peak 295 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "40 " and name "HG1 "))
(( segid " " and resid "40 " and name "HN "))
4.000 2.200 2.000 peak 296 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "40 " and name "HG2 "))
(( segid " " and resid "40 " and name "HN "))
5.000 3.200 1.000 peak 297 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
(( segid " " and resid "43 " and name "HN "))
3.300 1.500 1.400 peak 300 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "43 " and name "HG21")
OR
( segid " " and resid "43 " and name "HG23")
OR
( segid " " and resid "43 " and name "HG22"))
(( segid " " and resid "43 " and name "HN "))
5.700 3.900 0.300 peak 301 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "45 " and name "HN "))
3.000 1.200 1.100 peak 303 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "45 " and name "HN "))
3.200 1.400 1.300 peak 304 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "54 " and name "HG "))
(( segid " " and resid "54 " and name "HN "))
3.800 2.000 1.800 peak 305 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "55 " and name "HN "))
3.500 1.700 1.500 peak 307 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
(( segid " " and resid "57 " and name "HN "))
3.700 1.900 1.700 peak 311 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
(( segid " " and resid "57 " and name "HN "))
3.500 1.700 1.500 peak 312 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
(( segid " " and resid "58 " and name "HN "))
3.300 1.500 1.400 peak 313 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "9 " and name "HG1 ")
OR
( segid " " and resid "9 " and name "HG2 "))
(( segid " " and resid "10 " and name "HN "))
3.500 1.700 1.500 peak 314 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "13 " and name "HN "))
3.700 1.900 1.700 peak 316 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
(( segid " " and resid "17 " and name "HN "))
3.700 1.900 1.700 peak 317 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
(( segid " " and resid "33 " and name "HN "))
3.300 1.500 1.400 peak 318 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
(( segid " " and resid "36 " and name "HN "))
5.000 3.200 1.000 peak 319 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "42 " and name "HN "))
3.400 1.600 1.400 peak 320 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
(( segid " " and resid "44 " and name "HN "))
3.600 1.800 1.600 peak 321 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
(( segid " " and resid "59 " and name "HN "))
2.500 0.800 0.800 peak 324 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
(( segid " " and resid "12 " and name "HN "))
5.700 3.900 0.300 peak 325 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "31 " and name "HB2 "))
(( segid " " and resid "31 " and name "HD21"))
3.300 1.500 1.400 peak 326 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "33 " and name "HB2 "))
(( segid " " and resid "33 " and name "HD21"))
3.300 1.500 1.400 peak 328 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "53 " and name "HB2 "))
(( segid " " and resid "53 " and name "HD22"))
4.200 2.400 1.800 peak 331 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "53 " and name "HB1 "))
(( segid " " and resid "53 " and name "HD22"))
4.200 2.400 1.800 peak 333 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "9 " and name "HB1 "))
(( segid " " and resid "9 " and name "HA "))
2.600 0.800 0.800 peak 335 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "10 " and name "HB2 "))
(( segid " " and resid "10 " and name "HA "))
2.900 1.100 1.100 peak 336 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB2 "))
(( segid " " and resid "18 " and name "HA "))
3.700 1.900 1.700 peak 351 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HB2 "))
(( segid " " and resid "20 " and name "HA "))
3.000 1.200 1.100 peak 352 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
(( segid " " and resid "25 " and name "HA "))
3.100 1.300 1.200 peak 357 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "25 " and name "HA "))
3.000 1.200 1.100 peak 358 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "31 " and name "HB1 "))
(( segid " " and resid "31 " and name "HA "))
3.100 1.300 1.200 peak 360 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
(( segid " " and resid "32 " and name "HA "))
3.000 1.200 1.100 peak 362 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
(( segid " " and resid "35 " and name "HA "))
2.900 1.100 1.100 peak 365 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "37 " and name "HB1 "))
(( segid " " and resid "37 " and name "HA "))
2.900 1.100 1.100 peak 367 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "45 " and name "HB "))
(( segid " " and resid "45 " and name "HA "))
2.900 1.100 1.100 peak 378 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
(( segid " " and resid "45 " and name "HA "))
3.200 1.400 1.300 peak 379 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "55 " and name "HG12"))
(( segid " " and resid "55 " and name "HA "))
2.900 1.100 1.100 peak 387 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "55 " and name "HA "))
3.400 1.600 1.400 peak 390 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "60 " and name "HB2 "))
(( segid " " and resid "60 " and name "HA "))
2.700 0.900 0.900 peak 400 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "10 " and name "HN "))
(( segid " " and resid "59 " and name "HA2 "))
6.000 4.200 0.000 peak 401 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "11 " and name "HA "))
(( segid " " and resid "58 " and name "HB2 "))
5.000 3.200 1.000 peak 402 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "13 " and name "HA "))
3.500 1.700 1.500 peak 405 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "15 " and name "HA "))
(( segid " " and resid "54 " and name "HD21")
OR
( segid " " and resid "54 " and name "HD23")
OR
( segid " " and resid "54 " and name "HD22"))
3.500 1.700 1.500 peak 406 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HB1 "))
(( segid " " and resid "21 " and name "HA "))
3.100 1.300 1.200 peak 408 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "47 " and name "HD1 "))
(( segid " " and resid "46 " and name "HA "))
2.700 0.900 0.900 peak 413 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "46 " and name "HD1 "))
5.000 3.200 1.000 peak 415 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "45 " and name "HA "))
5.500 3.700 0.500 peak 417 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
5.500 3.700 0.500 peak 419 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "59 " and name "HA2 "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
3.300 1.500 1.400 peak 421 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "62 " and name "HN "))
(( segid " " and resid "64 " and name "HN "))
4.200 2.400 1.800 peak 423 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "63 " and name "HN "))
(( segid " " and resid "65 " and name "HN "))
4.200 2.400 1.800 peak 425 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "65 " and name "HN "))
(( segid " " and resid "67 " and name "HN "))
4.200 2.400 1.800 peak 428 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "66 " and name "HN "))
(( segid " " and resid "67 " and name "HN "))
2.900 1.100 1.100 peak 429 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "67 " and name "HN "))
(( segid " " and resid "69 " and name "HN "))
4.200 2.400 1.800 peak 431 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "68 " and name "HN "))
(( segid " " and resid "69 " and name "HN "))
3.100 1.300 1.200 peak 432 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "73 " and name "HN "))
(( segid " " and resid "75 " and name "HN "))
4.200 2.400 1.800 peak 437 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "74 " and name "HN "))
(( segid " " and resid "75 " and name "HN "))
3.000 1.200 1.100 peak 438 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "67 " and name "HN "))
4.200 2.400 1.800 peak 441 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "68 " and name "HN "))
3.900 2.100 1.900 peak 442 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "65 " and name "HN "))
2.900 1.100 1.100 peak 449 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "66 " and name "HN "))
2.900 1.100 1.100 peak 450 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "69 " and name "HA "))
(( segid " " and resid "69 " and name "HN "))
2.900 1.100 1.100 peak 453 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "70 " and name "HA "))
(( segid " " and resid "70 " and name "HN "))
3.000 1.200 1.100 peak 454 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "73 " and name "HA "))
(( segid " " and resid "73 " and name "HN "))
3.000 1.200 1.100 peak 457 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "76 " and name "HA "))
(( segid " " and resid "76 " and name "HN "))
3.000 1.200 1.100 peak 460 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "63 " and name "HN "))
3.800 2.000 1.800 peak 461 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "64 " and name "HN "))
3.500 1.700 1.500 peak 462 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "63 " and name "HA2 "))
(( segid " " and resid "64 " and name "HN "))
3.600 1.800 1.600 peak 463 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "65 " and name "HN "))
3.800 2.000 1.800 peak 464 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "66 " and name "HN "))
3.800 2.000 1.800 peak 465 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "67 " and name "HN "))
3.300 1.500 1.400 peak 466 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "68 " and name "HN "))
3.800 2.000 1.800 peak 467 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "69 " and name "HA "))
(( segid " " and resid "70 " and name "HN "))
3.200 1.400 1.300 peak 469 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "72 " and name "HA "))
(( segid " " and resid "73 " and name "HN "))
3.800 2.000 1.800 peak 472 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "73 " and name "HA "))
(( segid " " and resid "74 " and name "HN "))
3.800 2.000 1.800 peak 473 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "74 " and name "HA "))
(( segid " " and resid "75 " and name "HN "))
3.500 1.700 1.500 peak 474 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "76 " and name "HN "))
3.800 2.000 1.800 peak 475 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "66 " and name "HN "))
3.400 1.600 1.400 peak 477 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "67 " and name "HN "))
3.400 1.600 1.400 peak 478 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "68 " and name "HN "))
4.500 2.700 1.500 peak 479 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "68 " and name "HN "))
3.500 1.700 1.500 peak 480 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "69 " and name "HN "))
4.200 2.400 1.800 peak 481 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "69 " and name "HN "))
3.700 1.900 1.700 peak 482 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "70 " and name "HN "))
4.500 2.700 1.500 peak 483 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "70 " and name "HN "))
3.700 1.900 1.700 peak 484 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "68 " and name "HA "))
(( segid " " and resid "72 " and name "HN "))
4.500 2.700 1.500 peak 486 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "70 " and name "HA "))
(( segid " " and resid "73 " and name "HN "))
3.700 1.900 1.700 peak 488 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "70 " and name "HA "))
(( segid " " and resid "74 " and name "HN "))
4.500 2.700 1.500 peak 489 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "74 " and name "HN "))
3.700 1.900 1.700 peak 490 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "71 " and name "HN "))
(( segid " " and resid "75 " and name "HN "))
4.500 2.700 1.500 peak 491 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "72 " and name "HA "))
(( segid " " and resid "75 " and name "HN "))
3.500 1.700 1.500 peak 492 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "68 " and name "HB2 "))
(( segid " " and resid "68 " and name "HN "))
2.800 1.000 1.000 peak 498 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
(( segid " " and resid "74 " and name "HN "))
3.000 1.200 1.100 peak 505 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
(( segid " " and resid "75 " and name "HN "))
3.200 1.400 1.300 peak 506 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "65 " and name "HN "))
3.700 1.900 1.700 peak 509 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "68 " and name "HN "))
4.400 2.600 1.600 peak 512 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "68 " and name "HB1 "))
(( segid " " and resid "69 " and name "HN "))
3.300 1.500 1.400 peak 513 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "70 " and name "HB1 "))
(( segid " " and resid "71 " and name "HN "))
3.400 1.600 1.400 peak 514 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
(( segid " " and resid "76 " and name "HN "))
3.700 1.900 1.700 peak 517 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "64 " and name "HN "))
3.000 1.200 1.100 peak 520 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "65 " and name "HG2 "))
(( segid " " and resid "65 " and name "HN "))
3.000 1.200 1.100 peak 521 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "66 " and name "HG2 "))
(( segid " " and resid "66 " and name "HN "))
3.400 1.600 1.400 peak 523 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "66 " and name "HG1 "))
(( segid " " and resid "66 " and name "HN "))
3.500 1.700 1.500 peak 524 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "68 " and name "HG1 "))
(( segid " " and resid "68 " and name "HN "))
4.700 2.900 1.300 peak 525 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "68 " and name "HG2 "))
(( segid " " and resid "68 " and name "HN "))
3.900 2.100 1.900 peak 526 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "69 " and name "HG2 "))
(( segid " " and resid "69 " and name "HN "))
3.100 1.300 1.200 peak 527 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "69 " and name "HG1 "))
(( segid " " and resid "69 " and name "HN "))
4.000 2.200 2.000 peak 528 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "70 " and name "HG1 ")
OR
( segid " " and resid "70 " and name "HG2 "))
(( segid " " and resid "70 " and name "HN "))
3.300 1.500 1.400 peak 529 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "72 " and name "HG "))
(( segid " " and resid "72 " and name "HN "))
3.100 1.300 1.200 peak 531 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "72 " and name "HD11")
OR
( segid " " and resid "72 " and name "HD13")
OR
( segid " " and resid "72 " and name "HD12"))
(( segid " " and resid "72 " and name "HN "))
3.200 1.400 1.300 peak 532 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "72 " and name "HD21")
OR
( segid " " and resid "72 " and name "HD23")
OR
( segid " " and resid "72 " and name "HD22"))
(( segid " " and resid "72 " and name "HN "))
5.200 3.400 0.800 peak 533 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
(( segid " " and resid "74 " and name "HN "))
3.000 1.200 1.100 peak 535 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "29 " and name "HA1 "))
3.400 3.400 0.300 peak 2 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "29 " and name "HA2 "))
3.500 3.500 0.300 peak 3 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HA "))
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
3.700 3.700 0.300 peak 4 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HN "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
6.500 6.500 0.300 peak 5 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "25 " and name "HN "))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
6.000 6.000 0.300 peak 6 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
(( segid " " and resid "33 " and name "HA "))
6.000 6.000 0.300 peak 7 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "11 " and name "HA "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
4.500 4.500 0.300 peak 9 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "36 " and name "HN "))
5.700 5.700 0.300 peak 10 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
(( segid " " and resid "58 " and name "HA "))
3.500 3.500 0.300 peak 13 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "11 " and name "HN "))
(( segid " " and resid "12 " and name "HN "))
4.500 4.500 0.300 peak 15 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "16 " and name "HN "))
(( segid " " and resid "17 " and name "HN "))
4.500 4.500 0.300 peak 16 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "10 " and name "HN "))
(( segid " " and resid "11 " and name "HE1 ")
OR
( segid " " and resid "11 " and name "HE2 "))
7.000 7.000 0.300 peak 17 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "11 " and name "HN "))
(( segid " " and resid "11 " and name "HE1 ")
OR
( segid " " and resid "11 " and name "HE2 "))
7.000 7.000 0.300 peak 18 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
(( segid " " and resid "57 " and name "HN "))
7.000 7.000 0.300 peak 19 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "21 " and name "HD2 "))
7.500 7.500 0.300 peak 20 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HB2 "))
(( segid " " and resid "23 " and name "HD2 "))
7.500 7.500 0.300 peak 22 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "23 " and name "HD2 "))
7.500 7.500 0.300 peak 23 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
5.500 5.500 0.300 peak 28 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "22 " and name "HN "))
7.500 7.500 0.300 peak 30 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
6.700 6.700 0.300 peak 31 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
5.000 5.000 0.300 peak 32 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
5.000 5.000 0.300 peak 33 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "23 " and name "HD2 "))
(( segid " " and resid "23 " and name "HA "))
7.500 7.500 0.300 peak 35 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "26 " and name "HA1 ")
OR
( segid " " and resid "26 " and name "HA2 "))
(( segid " " and resid "31 " and name "HN "))
5.000 5.000 0.300 peak 37 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "39 " and name "HN "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
7.000 7.000 0.300 peak 39 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
(( segid " " and resid "40 " and name "HN "))
7.000 7.000 0.300 peak 40 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "40 " and name "HN "))
7.000 7.000 0.300 peak 41 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "39 " and name "HN "))
6.500 6.500 0.300 peak 42 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "37 " and name "HA "))
(( segid " " and resid "40 " and name "HN "))
6.500 6.500 0.300 peak 43 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "39 " and name "HB1 "))
(( segid " " and resid "40 " and name "HN "))
5.000 5.000 0.300 peak 44 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "39 " and name "HB2 "))
(( segid " " and resid "40 " and name "HN "))
5.000 5.000 0.300 peak 45 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "39 " and name "HN "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
5.000 5.000 0.300 peak 46 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "40 " and name "HN "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
5.000 5.000 0.300 peak 47 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "16 " and name "HB "))
(( segid " " and resid "17 " and name "HN "))
6.000 6.000 0.300 peak 49 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "38 " and name "NE2 "))
6.000 6.000 0.300 peak 50 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
3.300 3.300 0.300 peak 55 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "59 " and name "HA1 "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
2.700 2.700 0.300 peak 57 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "59 " and name "HA2 "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
3.100 3.100 0.300 peak 58 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "HN "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
7.500 7.500 0.300 peak 59 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "38 " and name "NE2 "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
7.000 7.000 0.300 peak 60 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
5.500 5.500 0.300 peak 61 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
ASSI
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
(( segid " " and resid "21 " and name "HA "))
2.800 1.000 1.000 peak 631 volume 0.374E+06 ppm1 1.340 ppm2 4.129
ASSI
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "21 " and name "HE1 "))
2.900 1.100 1.100 peak 720 volume 0.295E+06 ppm1 0.775 ppm2 7.948
ASSI
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "21 " and name "HB1 "))
2.900 1.100 1.100 peak 741 volume 0.277E+06 ppm1 0.775 ppm2 3.145
ASSI
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "58 " and name "HA "))
2.500 0.800 0.800 peak 443 volume 0.667E+06 ppm1 0.611 ppm2 5.336
ASSI
(( segid " " and resid "59 " and name "HN "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
2.300 0.700 0.700 peak 1258 volume 0.119E+07 ppm1 8.334 ppm2 0.619
ASSI
(( segid " " and resid "10 " and name "HB2 "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
2.500 0.800 0.800 peak 1413 volume 0.725E+06 ppm1 2.396 ppm2 0.612
ASSI
(( segid " " and resid "10 " and name "HB1 "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
2.600 0.800 0.800 peak 1544 volume 0.479E+06 ppm1 2.626 ppm2 0.619
ASSI
(( segid " " and resid "10 " and name "HN "))
(( segid " " and resid "10 " and name "HB1 "))
2.900 1.100 1.100 peak 1695 volume 0.329E+06 ppm1 8.623 ppm2 2.613
ASSI
(( segid " " and resid "29 " and name "HA1 "))
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
2.900 1.100 1.100 peak 2010 volume 0.311E+06 ppm1 3.938 ppm2 0.619
ASSI
(( segid " " and resid "55 " and name "HG12"))
(( segid " " and resid "55 " and name "HG11"))
1.700 0.400 0.400 peak 19 volume 0.958E+07 ppm1 0.815 ppm2 1.308
OR
(( segid " " and resid "19 " and name "HG1 "))
(( segid " " and resid "19 " and name "HD1 ")
OR
( segid " " and resid "19 " and name "HD2 "))
OR
(( segid " " and resid "55 " and name "HG12"))
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
ASSI
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "38 " and name "HB1 "))
1.700 0.400 0.400 peak 22 volume 0.839E+07 ppm1 1.103 ppm2 1.655
OR
(( segid " " and resid "71 " and name "HG "))
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
ASSI
(( segid " " and resid "44 " and name "HG1 "))
(( segid " " and resid "44 " and name "HB1 "))
1.700 0.400 0.400 peak 28 volume 0.727E+07 ppm1 1.477 ppm2 1.675
OR
(( segid " " and resid "36 " and name "HG2 "))
(( segid " " and resid "36 " and name "HG1 "))
ASSI
(( segid " " and resid "72 " and name "HD11")
OR
( segid " " and resid "72 " and name "HD13")
OR
( segid " " and resid "72 " and name "HD12"))
(( segid " " and resid "72 " and name "HA "))
1.900 0.500 0.500 peak 40 volume 0.542E+07 ppm1 0.716 ppm2 3.847
OR
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "24 " and name "HA "))
OR
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
(( segid " " and resid "24 " and name "HA "))
ASSI
(( segid " " and resid "72 " and name "HD11")
OR
( segid " " and resid "72 " and name "HD13")
OR
( segid " " and resid "72 " and name "HD12"))
(( segid " " and resid "14 " and name "HB "))
1.800 0.400 0.400 peak 41 volume 0.531E+07 ppm1 0.723 ppm2 1.649
OR
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
(( segid " " and resid "14 " and name "HB "))
OR
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
ASSI
(( segid " " and resid "65 " and name "HG2 "))
(( segid " " and resid "65 " and name "HG1 "))
1.800 0.400 0.400 peak 45 volume 0.522E+07 ppm1 2.035 ppm2 2.390
OR
(( segid " " and resid "70 " and name "HB1 "))
(( segid " " and resid "70 " and name "HG1 ")
OR
( segid " " and resid "70 " and name "HG2 "))
ASSI
(( segid " " and resid "35 " and name "HD11")
OR
( segid " " and resid "35 " and name "HD13")
OR
( segid " " and resid "35 " and name "HD12"))
(( segid " " and resid "35 " and name "HB "))
1.800 0.400 0.400 peak 47 volume 0.514E+07 ppm1 0.703 ppm2 1.773
OR
(( segid " " and resid "72 " and name "HD11")
OR
( segid " " and resid "72 " and name "HD13")
OR
( segid " " and resid "72 " and name "HD12"))
(( segid " " and resid "72 " and name "HB1 ")
OR
( segid " " and resid "72 " and name "HB2 "))
OR
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
(( segid " " and resid "12 " and name "HB "))
ASSI
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "67 " and name "HA "))
1.900 0.500 0.500 peak 48 volume 0.490E+07 ppm1 1.064 ppm2 3.460
OR
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "35 " and name "HA "))
OR
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
(( segid " " and resid "35 " and name "HA "))
ASSI
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
1.800 0.400 0.400 peak 55 volume 0.442E+07 ppm1 0.775 ppm2 1.800
OR
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
OR
(( segid " " and resid "74 " and name "HD21")
OR
( segid " " and resid "74 " and name "HD23")
OR
( segid " " and resid "74 " and name "HD22"))
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
OR
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "25 " and name "HB "))
ASSI
(( segid " " and resid "19 " and name "HG2 "))
(( segid " " and resid "19 " and name "HG1 "))
1.900 0.500 0.500 peak 56 volume 0.442E+07 ppm1 0.441 ppm2 0.796
OR
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
ASSI
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
1.800 0.400 0.400 peak 57 volume 0.436E+07 ppm1 0.611 ppm2 1.662
OR
(( segid " " and resid "72 " and name "HD21")
OR
( segid " " and resid "72 " and name "HD23")
OR
( segid " " and resid "72 " and name "HD22"))
(( segid " " and resid "14 " and name "HB "))
OR
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "14 " and name "HB "))
ASSI
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
(( segid " " and resid "35 " and name "HB "))
1.900 0.500 0.500 peak 58 volume 0.436E+07 ppm1 1.031 ppm2 1.787
OR
(( segid " " and resid "68 " and name "HB2 "))
(( segid " " and resid "68 " and name "HB1 "))
OR
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
(( segid " " and resid "25 " and name "HB "))
ASSI
(( segid " " and resid "57 " and name "HG12"))
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
1.800 0.400 0.400 peak 61 volume 0.417E+07 ppm1 0.533 ppm2 0.756
OR
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
OR
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "64 " and name "HA "))
1.900 0.500 0.500 peak 62 volume 0.408E+07 ppm1 0.539 ppm2 3.224
OR
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "39 " and name "HB1 "))
ASSI
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
1.900 0.500 0.500 peak 71 volume 0.383E+07 ppm1 0.775 ppm2 1.065
OR
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
OR
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
OR
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
ASSI
(( segid " " and resid "43 " and name "HG21")
OR
( segid " " and resid "43 " and name "HG23")
OR
( segid " " and resid "43 " and name "HG22"))
(( segid " " and resid "43 " and name "HB "))
1.900 0.500 0.500 peak 75 volume 0.372E+07 ppm1 0.552 ppm2 1.714
OR
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "45 " and name "HB "))
ASSI
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "36 " and name "HN "))
1.900 0.500 0.500 peak 78 volume 0.370E+07 ppm1 1.878 ppm2 8.171
OR
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "60 " and name "HN "))
OR
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB2 "))
(( segid " " and resid "62 " and name "HN "))
ASSI
(( segid " " and resid "62 " and name "HG2 "))
(( segid " " and resid "62 " and name "HA "))
2.000 0.500 0.500 peak 79 volume 0.367E+07 ppm1 1.851 ppm2 4.057
OR
(( segid " " and resid "34 " and name "HG1 "))
(( segid " " and resid "34 " and name "HA "))
ASSI
(( segid " " and resid "16 " and name "HD11")
OR
( segid " " and resid "16 " and name "HD13")
OR
( segid " " and resid "16 " and name "HD12"))
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
1.900 0.500 0.500 peak 81 volume 0.360E+07 ppm1 0.559 ppm2 1.314
OR
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
ASSI
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "32 " and name "HA "))
2.000 0.500 0.500 peak 82 volume 0.359E+07 ppm1 1.970 ppm2 3.683
OR
(( segid " " and resid "47 " and name "HG1 "))
(( segid " " and resid "47 " and name "HD1 "))
ASSI
(( segid " " and resid "38 " and name "HG1 "))
(( segid " " and resid "38 " and name "HA "))
2.100 0.600 0.600 peak 86 volume 0.346E+07 ppm1 1.819 ppm2 3.729
OR
(( segid " " and resid "25 " and name "HB "))
(( segid " " and resid "25 " and name "HA "))
OR
(( segid " " and resid "68 " and name "HB1 "))
(( segid " " and resid "65 " and name "HA "))
ASSI
(( segid " " and resid "52 " and name "HA "))
(( segid " " and resid "52 " and name "HN "))
2.000 0.500 0.500 peak 98 volume 0.309E+07 ppm1 4.483 ppm2 8.499
OR
(( segid " " and resid "44 " and name "HA "))
(( segid " " and resid "45 " and name "HN "))
ASSI
(( segid " " and resid "69 " and name "HB2 "))
(( segid " " and resid "69 " and name "HA "))
2.100 0.600 0.600 peak 100 volume 0.305E+07 ppm1 1.746 ppm2 3.775
OR
(( segid " " and resid "72 " and name "HB1 ")
OR
( segid " " and resid "72 " and name "HB2 "))
(( segid " " and resid "69 " and name "HA "))
ASSI
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "72 " and name "HA "))
2.100 0.600 0.600 peak 102 volume 0.298E+07 ppm1 0.611 ppm2 3.827
OR
(( segid " " and resid "72 " and name "HD21")
OR
( segid " " and resid "72 " and name "HD23")
OR
( segid " " and resid "72 " and name "HD22"))
(( segid " " and resid "72 " and name "HA "))
ASSI
(( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "73 " and name "HN "))
2.000 0.500 0.500 peak 109 volume 0.278E+07 ppm1 1.989 ppm2 7.659
OR
(( segid " " and resid "70 " and name "HB2 "))
(( segid " " and resid "70 " and name "HN "))
ASSI
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "24 " and name "HG "))
2.000 0.500 0.500 peak 111 volume 0.273E+07 ppm1 0.729 ppm2 1.321
OR
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
(( segid " " and resid "24 " and name "HG "))
OR
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
(( segid " " and resid "54 " and name "HG "))
ASSI
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "64 " and name "HB "))
2.000 0.500 0.500 peak 118 volume 0.259E+07 ppm1 0.618 ppm2 1.852
OR
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
(( segid " " and resid "64 " and name "HB "))
ASSI
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "35 " and name "HA "))
2.100 0.600 0.600 peak 120 volume 0.254E+07 ppm1 0.789 ppm2 3.460
OR
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "67 " and name "HA "))
ASSI
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "63 " and name "HA2 "))
2.200 0.600 0.600 peak 122 volume 0.252E+07 ppm1 1.287 ppm2 3.742
OR
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "66 " and name "HA "))
ASSI
(( segid " " and resid "70 " and name "HA "))
(( segid " " and resid "73 " and name "HN "))
2.100 0.600 0.600 peak 132 volume 0.230E+07 ppm1 3.879 ppm2 7.666
OR
(( segid " " and resid "72 " and name "HA "))
(( segid " " and resid "73 " and name "HN "))
OR
(( segid " " and resid "70 " and name "HA "))
(( segid " " and resid "70 " and name "HN "))
ASSI
(( segid " " and resid "72 " and name "HG "))
(( segid " " and resid "14 " and name "HB "))
2.100 0.600 0.600 peak 135 volume 0.228E+07 ppm1 1.294 ppm2 1.662
OR
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
(( segid " " and resid "14 " and name "HB "))
ASSI
(( segid " " and resid "68 " and name "HB1 "))
(( segid " " and resid "69 " and name "HN "))
2.000 0.500 0.500 peak 136 volume 0.227E+07 ppm1 1.819 ppm2 7.114
OR
(( segid " " and resid "69 " and name "HB1 "))
(( segid " " and resid "69 " and name "HN "))
ASSI
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "64 " and name "HA "))
2.200 0.600 0.600 peak 137 volume 0.226E+07 ppm1 0.618 ppm2 3.217
OR
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
(( segid " " and resid "64 " and name "HA "))
ASSI
(( segid " " and resid "22 " and name "HB1 "))
(( segid " " and resid "22 " and name "HA "))
2.200 0.600 0.600 peak 138 volume 0.225E+07 ppm1 1.674 ppm2 3.998
OR
(( segid " " and resid "36 " and name "HG1 "))
(( segid " " and resid "36 " and name "HA "))
ASSI
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
(( segid " " and resid "71 " and name "HA "))
2.200 0.600 0.600 peak 142 volume 0.218E+07 ppm1 1.097 ppm2 3.834
OR
(( segid " " and resid "71 " and name "HG "))
(( segid " " and resid "71 " and name "HA "))
OR
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
(( segid " " and resid "72 " and name "HA "))
ASSI
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
(( segid " " and resid "74 " and name "HA "))
2.200 0.600 0.600 peak 145 volume 0.212E+07 ppm1 1.799 ppm2 4.090
OR
(( segid " " and resid "40 " and name "HG1 "))
(( segid " " and resid "40 " and name "HA "))
ASSI
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
(( segid " " and resid "71 " and name "HA "))
2.300 0.700 0.700 peak 150 volume 0.207E+07 ppm1 1.648 ppm2 3.834
OR
(( segid " " and resid "14 " and name "HB "))
(( segid " " and resid "72 " and name "HA "))
ASSI
(( segid " " and resid "47 " and name "HG1 "))
(( segid " " and resid "47 " and name "HB1 ")
OR
( segid " " and resid "47 " and name "HB2 "))
2.100 0.600 0.600 peak 154 volume 0.203E+07 ppm1 2.002 ppm2 2.331
OR
(( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "73 " and name "HG1 ")
OR
( segid " " and resid "73 " and name "HG2 "))
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "66 " and name "HN "))
2.200 0.600 0.600 peak 167 volume 0.193E+07 ppm1 3.728 ppm2 7.456
OR
(( segid " " and resid "25 " and name "HA "))
(( segid " " and resid "25 " and name "HN "))
OR
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "66 " and name "HN "))
ASSI
(( segid " " and resid "25 " and name "HB "))
(( segid " " and resid "29 " and name "HN "))
2.100 0.600 0.600 peak 174 volume 0.188E+07 ppm1 1.806 ppm2 7.790
OR
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "24 " and name "HN "))
ASSI
(( segid " " and resid "68 " and name "HB1 "))
(( segid " " and resid "69 " and name "HN "))
2.100 0.600 0.600 peak 177 volume 0.186E+07 ppm1 1.753 ppm2 7.114
OR
(( segid " " and resid "69 " and name "HB2 "))
(( segid " " and resid "69 " and name "HN "))
ASSI
(( segid " " and resid "69 " and name "HA "))
(( segid " " and resid "69 " and name "HN "))
2.200 0.600 0.600 peak 180 volume 0.184E+07 ppm1 3.761 ppm2 7.108
OR
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "69 " and name "HN "))
OR
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "69 " and name "HN "))
ASSI
(( segid " " and resid "62 " and name "HB1 ")
OR
( segid " " and resid "62 " and name "HB2 "))
(( segid " " and resid "62 " and name "HA "))
2.300 0.700 0.700 peak 182 volume 0.183E+07 ppm1 2.015 ppm2 4.070
OR
(( segid " " and resid "65 " and name "HG2 "))
(( segid " " and resid "62 " and name "HA "))
ASSI
(( segid " " and resid "72 " and name "HD21")
OR
( segid " " and resid "72 " and name "HD23")
OR
( segid " " and resid "72 " and name "HD22"))
(( segid " " and resid "72 " and name "HG "))
2.100 0.600 0.600 peak 183 volume 0.182E+07 ppm1 0.624 ppm2 1.281
OR
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
ASSI
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "39 " and name "HB1 "))
2.200 0.600 0.600 peak 188 volume 0.181E+07 ppm1 1.064 ppm2 3.217
OR
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "64 " and name "HA "))
ASSI
(( segid " " and resid "16 " and name "HD11")
OR
( segid " " and resid "16 " and name "HD13")
OR
( segid " " and resid "16 " and name "HD12"))
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
2.200 0.600 0.600 peak 193 volume 0.177E+07 ppm1 0.552 ppm2 0.829
OR
(( segid " " and resid "16 " and name "HD11")
OR
( segid " " and resid "16 " and name "HD13")
OR
( segid " " and resid "16 " and name "HD12"))
(( segid " " and resid "55 " and name "HG12"))
OR
(( segid " " and resid "57 " and name "HG12"))
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
ASSI
(( segid " " and resid "19 " and name "HG1 "))
(( segid " " and resid "19 " and name "HA "))
2.300 0.700 0.700 peak 194 volume 0.177E+07 ppm1 0.782 ppm2 3.827
OR
(( segid " " and resid "71 " and name "HD11")
OR
( segid " " and resid "71 " and name "HD13")
OR
( segid " " and resid "71 " and name "HD12"))
(( segid " " and resid "71 " and name "HA "))
ASSI
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
2.200 0.600 0.600 peak 200 volume 0.171E+07 ppm1 1.064 ppm2 7.055
OR
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
OR
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
ASSI
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "57 " and name "HB "))
2.200 0.600 0.600 peak 210 volume 0.163E+07 ppm1 0.638 ppm2 1.577
OR
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "68 " and name "HG1 "))
ASSI
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "36 " and name "HA "))
2.300 0.700 0.700 peak 220 volume 0.155E+07 ppm1 0.775 ppm2 3.998
OR
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "22 " and name "HA "))
ASSI
(( segid " " and resid "72 " and name "HB1 ")
OR
( segid " " and resid "72 " and name "HB2 "))
(( segid " " and resid "72 " and name "HA "))
2.400 0.700 0.700 peak 221 volume 0.154E+07 ppm1 1.773 ppm2 3.847
OR
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "24 " and name "HA "))
ASSI
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "71 " and name "HN "))
2.300 0.700 0.700 peak 222 volume 0.154E+07 ppm1 3.826 ppm2 8.302
OR
(( segid " " and resid "70 " and name "HA "))
(( segid " " and resid "71 " and name "HN "))
ASSI
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "45 " and name "HN "))
2.100 0.600 0.600 peak 227 volume 0.151E+07 ppm1 0.749 ppm2 8.486
OR
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
(( segid " " and resid "58 " and name "HN "))
ASSI
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "72 " and name "HN "))
2.300 0.700 0.700 peak 228 volume 0.150E+07 ppm1 3.840 ppm2 7.843
OR
(( segid " " and resid "72 " and name "HA "))
(( segid " " and resid "72 " and name "HN "))
ASSI
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "55 " and name "HG11"))
2.200 0.600 0.600 peak 234 volume 0.145E+07 ppm1 0.231 ppm2 1.301
OR
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
ASSI
(( segid " " and resid "34 " and name "HB1 ")
OR
( segid " " and resid "34 " and name "HB2 "))
(( segid " " and resid "35 " and name "HA "))
2.400 0.700 0.700 peak 237 volume 0.144E+07 ppm1 2.029 ppm2 3.460
OR
(( segid " " and resid "70 " and name "HB1 "))
(( segid " " and resid "67 " and name "HA "))
ASSI
(( segid " " and resid "40 " and name "HG2 "))
(( segid " " and resid "40 " and name "HB1 ")
OR
( segid " " and resid "40 " and name "HB2 "))
2.300 0.700 0.700 peak 238 volume 0.143E+07 ppm1 1.294 ppm2 2.206
OR
(( segid " " and resid "66 " and name "HB1 ")
OR
( segid " " and resid "66 " and name "HB2 "))
(( segid " " and resid "66 " and name "HG1 "))
ASSI
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
(( segid " " and resid "32 " and name "HB "))
2.200 0.600 0.600 peak 251 volume 0.135E+07 ppm1 0.638 ppm2 1.964
OR
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
(( segid " " and resid "65 " and name "HB1 "))
OR
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
(( segid " " and resid "32 " and name "HB "))
ASSI
(( segid " " and resid "68 " and name "HB2 "))
(( segid " " and resid "68 " and name "HN "))
2.200 0.600 0.600 peak 255 volume 0.133E+07 ppm1 1.064 ppm2 7.994
OR
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "68 " and name "HN "))
ASSI
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
(( segid " " and resid "25 " and name "HA "))
2.400 0.700 0.700 peak 256 volume 0.133E+07 ppm1 1.077 ppm2 3.729
OR
(( segid " " and resid "68 " and name "HB2 "))
(( segid " " and resid "65 " and name "HA "))
OR
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "38 " and name "HA "))
ASSI
(( segid " " and resid "61 " and name "HD1 "))
(( segid " " and resid "60 " and name "HN "))
2.300 0.700 0.700 peak 257 volume 0.133E+07 ppm1 3.918 ppm2 8.158
OR
(( segid " " and resid "59 " and name "HA2 "))
(( segid " " and resid "60 " and name "HN "))
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "76 " and name "HN "))
2.400 0.700 0.700 peak 265 volume 0.130E+07 ppm1 3.977 ppm2 7.167
OR
(( segid " " and resid "76 " and name "HA "))
(( segid " " and resid "76 " and name "HN "))
ASSI
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "55 " and name "HG11"))
2.300 0.700 0.700 peak 269 volume 0.129E+07 ppm1 0.447 ppm2 1.308
OR
(( segid " " and resid "19 " and name "HG2 "))
(( segid " " and resid "19 " and name "HD1 ")
OR
( segid " " and resid "19 " and name "HD2 "))
OR
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
ASSI
(( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "44 " and name "HN "))
2.300 0.700 0.700 peak 274 volume 0.128E+07 ppm1 1.641 ppm2 9.116
OR
(( segid " " and resid "56 " and name "HB1 ")
OR
( segid " " and resid "56 " and name "HB2 "))
(( segid " " and resid "44 " and name "HN "))
ASSI
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "26 " and name "HN "))
2.200 0.600 0.600 peak 275 volume 0.127E+07 ppm1 0.782 ppm2 7.587
OR
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
(( segid " " and resid "74 " and name "HN "))
OR
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "39 " and name "HN "))
OR
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "56 " and name "HN "))
OR
(( segid " " and resid "74 " and name "HD21")
OR
( segid " " and resid "74 " and name "HD23")
OR
( segid " " and resid "74 " and name "HD22"))
(( segid " " and resid "74 " and name "HN "))
ASSI
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
(( segid " " and resid "20 " and name "HB2 "))
2.300 0.700 0.700 peak 279 volume 0.126E+07 ppm1 0.979 ppm2 2.922
OR
(( segid " " and resid "16 " and name "HG21")
OR
( segid " " and resid "16 " and name "HG23")
OR
( segid " " and resid "16 " and name "HG22"))
(( segid " " and resid "53 " and name "HB1 "))
ASSI
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "31 " and name "HD21"))
2.400 0.700 0.700 peak 282 volume 0.124E+07 ppm1 3.899 ppm2 7.587
OR
(( segid " " and resid "46 " and name "HD1 "))
(( segid " " and resid "56 " and name "HN "))
OR
(( segid " " and resid "26 " and name "HA1 ")
OR
( segid " " and resid "26 " and name "HA2 "))
(( segid " " and resid "26 " and name "HN "))
ASSI
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
(( segid " " and resid "26 " and name "HN "))
2.300 0.700 0.700 peak 291 volume 0.116E+07 ppm1 1.084 ppm2 7.593
OR
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "39 " and name "HN "))
OR
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "39 " and name "HN "))
OR
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
(( segid " " and resid "74 " and name "HN "))
ASSI
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
(( segid " " and resid "68 " and name "HE2 "))
2.300 0.700 0.700 peak 295 volume 0.114E+07 ppm1 0.723 ppm2 2.731
OR
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
(( segid " " and resid "68 " and name "HE2 "))
ASSI
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "60 " and name "HN "))
2.400 0.700 0.700 peak 299 volume 0.114E+07 ppm1 4.056 ppm2 8.164
OR
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "62 " and name "HN "))
ASSI
(( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "74 " and name "HN "))
2.300 0.700 0.700 peak 301 volume 0.113E+07 ppm1 1.989 ppm2 7.593
OR
(( segid " " and resid "51 " and name "HG1 ")
OR
( segid " " and resid "51 " and name "HG2 "))
(( segid " " and resid "51 " and name "HN "))
ASSI
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
(( segid " " and resid "68 " and name "HA "))
2.500 0.800 0.800 peak 309 volume 0.108E+07 ppm1 0.618 ppm2 3.414
OR
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "68 " and name "HA "))
OR
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "68 " and name "HA "))
OR
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "68 " and name "HA "))
ASSI
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "61 " and name "HD1 "))
2.400 0.700 0.700 peak 310 volume 0.108E+07 ppm1 1.851 ppm2 3.912
OR
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "59 " and name "HA2 "))
OR
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB2 "))
(( segid " " and resid "61 " and name "HD1 "))
ASSI
(( segid " " and resid "37 " and name "HB1 "))
(( segid " " and resid "34 " and name "HA "))
2.500 0.800 0.800 peak 316 volume 0.106E+07 ppm1 2.632 ppm2 4.050
OR
(( segid " " and resid "53 " and name "HB2 "))
(( segid " " and resid "17 " and name "HA "))
ASSI
(( segid " " and resid "55 " and name "HG11"))
(( segid " " and resid "55 " and name "HN "))
2.300 0.700 0.700 peak 320 volume 0.105E+07 ppm1 1.313 ppm2 8.840
OR
(( segid " " and resid "54 " and name "HG "))
(( segid " " and resid "55 " and name "HN "))
OR
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
(( segid " " and resid "55 " and name "HN "))
ASSI
(( segid " " and resid "58 " and name "HB1 "))
(( segid " " and resid "58 " and name "HN "))
2.400 0.700 0.700 peak 335 volume 0.987E+06 ppm1 1.963 ppm2 8.486
OR
(( segid " " and resid "51 " and name "HG1 ")
OR
( segid " " and resid "51 " and name "HG2 "))
(( segid " " and resid "52 " and name "HN "))
OR
(( segid " " and resid "41 " and name "HB "))
(( segid " " and resid "58 " and name "HN "))
ASSI
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "34 " and name "HN "))
2.500 0.800 0.800 peak 337 volume 0.974E+06 ppm1 4.050 ppm2 7.541
OR
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "18 " and name "HN "))
ASSI
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "64 " and name "HN "))
2.500 0.800 0.800 peak 343 volume 0.956E+06 ppm1 4.043 ppm2 8.597
OR
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "64 " and name "HN "))
ASSI
(( segid " " and resid "50 " and name "HA "))
(( segid " " and resid "51 " and name "HN "))
2.500 0.800 0.800 peak 350 volume 0.937E+06 ppm1 3.971 ppm2 7.600
OR
(( segid " " and resid "50 " and name "HA "))
(( segid " " and resid "50 " and name "HN "))
OR
(( segid " " and resid "51 " and name "HA "))
(( segid " " and resid "51 " and name "HN "))
OR
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "26 " and name "HN "))
ASSI
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "38 " and name "HG1 "))
2.400 0.700 0.700 peak 353 volume 0.930E+06 ppm1 1.084 ppm2 1.832
OR
(( segid " " and resid "61 " and name "HG1 ")
OR
( segid " " and resid "61 " and name "HG2 "))
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB2 "))
ASSI
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
(( segid " " and resid "14 " and name "HN "))
2.300 0.700 0.700 peak 356 volume 0.925E+06 ppm1 0.716 ppm2 8.860
OR
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
(( segid " " and resid "14 " and name "HN "))
ASSI
(( segid " " and resid "26 " and name "HA1 ")
OR
( segid " " and resid "26 " and name "HA2 "))
(( segid " " and resid "28 " and name "HN "))
2.500 0.800 0.800 peak 360 volume 0.895E+06 ppm1 3.866 ppm2 7.790
OR
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "24 " and name "HN "))
ASSI
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
2.500 0.800 0.800 peak 373 volume 0.856E+06 ppm1 1.051 ppm2 6.590
OR
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
OR
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "61 " and name "HD2 "))
2.500 0.800 0.800 peak 378 volume 0.846E+06 ppm1 0.533 ppm2 3.716
OR
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "25 " and name "HA "))
OR
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "63 " and name "HA2 "))
OR
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "47 " and name "HD1 "))
ASSI
(( segid " " and resid "70 " and name "HB2 "))
(( segid " " and resid "71 " and name "HN "))
2.500 0.800 0.800 peak 413 volume 0.751E+06 ppm1 1.911 ppm2 8.309
OR
(( segid " " and resid "9 " and name "HG1 ")
OR
( segid " " and resid "9 " and name "HG2 "))
(( segid " " and resid "9 " and name "HN "))
OR
(( segid " " and resid "8 " and name "HG1 ")
OR
( segid " " and resid "8 " and name "HG2 "))
(( segid " " and resid "9 " and name "HN "))
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "68 " and name "HN "))
2.600 0.800 0.800 peak 419 volume 0.739E+06 ppm1 3.735 ppm2 7.994
OR
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "68 " and name "HN "))
ASSI
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "39 " and name "HB1 "))
2.500 0.800 0.800 peak 428 volume 0.715E+06 ppm1 0.441 ppm2 3.224
OR
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "64 " and name "HA "))
ASSI
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "33 " and name "HN "))
2.500 0.800 0.800 peak 444 volume 0.661E+06 ppm1 1.950 ppm2 8.210
OR
(( segid " " and resid "8 " and name "HG1 ")
OR
( segid " " and resid "8 " and name "HG2 "))
(( segid " " and resid "8 " and name "HN "))
ASSI
(( segid " " and resid "33 " and name "HB1 "))
(( segid " " and resid "33 " and name "HN "))
2.500 0.800 0.800 peak 447 volume 0.645E+06 ppm1 2.777 ppm2 8.210
OR
(( segid " " and resid "7 " and name "HB1 "))
(( segid " " and resid "8 " and name "HN "))
ASSI
(( segid " " and resid "52 " and name "HB1 "))
(( segid " " and resid "52 " and name "HN "))
2.500 0.800 0.800 peak 453 volume 0.636E+06 ppm1 3.676 ppm2 8.492
OR
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
(( segid " " and resid "58 " and name "HN "))
ASSI
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "57 " and name "HN "))
2.500 0.800 0.800 peak 456 volume 0.627E+06 ppm1 0.638 ppm2 8.932
OR
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
(( segid " " and resid "42 " and name "HN "))
OR
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
(( segid " " and resid "57 " and name "HN "))
ASSI
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
2.600 0.800 0.800 peak 458 volume 0.625E+06 ppm1 0.697 ppm2 7.193
OR
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "67 " and name "HN "))
2.700 0.900 0.900 peak 461 volume 0.623E+06 ppm1 3.735 ppm2 8.243
OR
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "67 " and name "HN "))
OR
(( segid " " and resid "63 " and name "HA2 "))
(( segid " " and resid "67 " and name "HN "))
ASSI
(( segid " " and resid "65 " and name "HG2 "))
(( segid " " and resid "65 " and name "HN "))
2.500 0.800 0.800 peak 468 volume 0.614E+06 ppm1 2.035 ppm2 7.082
OR
(( segid " " and resid "62 " and name "HB1 ")
OR
( segid " " and resid "62 " and name "HB2 "))
(( segid " " and resid "65 " and name "HN "))
ASSI
(( segid " " and resid "21 " and name "HB2 "))
(( segid " " and resid "21 " and name "HN "))
2.500 0.800 0.800 peak 470 volume 0.608E+06 ppm1 2.947 ppm2 7.981
OR
(( segid " " and resid "20 " and name "HB2 "))
(( segid " " and resid "21 " and name "HN "))
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "10 " and name "HN "))
2.700 0.900 0.900 peak 475 volume 0.600E+06 ppm1 4.804 ppm2 8.624
OR
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "10 " and name "HN "))
ASSI
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
(( segid " " and resid "25 " and name "HA "))
2.700 0.900 0.900 peak 484 volume 0.591E+06 ppm1 0.631 ppm2 3.709
OR
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
(( segid " " and resid "32 " and name "HA "))
OR
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
(( segid " " and resid "32 " and name "HA "))
ASSI
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "24 " and name "HN "))
2.500 0.800 0.800 peak 485 volume 0.589E+06 ppm1 0.690 ppm2 7.790
OR
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
(( segid " " and resid "24 " and name "HN "))
ASSI
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "57 " and name "HN "))
2.500 0.800 0.800 peak 493 volume 0.570E+06 ppm1 0.447 ppm2 8.938
OR
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "42 " and name "HN "))
ASSI
(( segid " " and resid "61 " and name "HD2 "))
(( segid " " and resid "60 " and name "HN "))
2.600 0.800 0.800 peak 494 volume 0.569E+06 ppm1 3.721 ppm2 8.164
OR
(( segid " " and resid "32 " and name "HA "))
(( segid " " and resid "36 " and name "HN "))
ASSI
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "59 " and name "HA2 "))
2.700 0.900 0.900 peak 495 volume 0.569E+06 ppm1 0.539 ppm2 3.919
OR
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "61 " and name "HD1 "))
OR
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "46 " and name "HD1 "))
ASSI
(( segid " " and resid "25 " and name "HA "))
(( segid " " and resid "26 " and name "HN "))
2.700 0.900 0.900 peak 500 volume 0.565E+06 ppm1 3.715 ppm2 7.593
OR
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "39 " and name "HN "))
ASSI
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
(( segid " " and resid "42 " and name "HN "))
2.500 0.800 0.800 peak 501 volume 0.565E+06 ppm1 0.743 ppm2 8.932
OR
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
(( segid " " and resid "57 " and name "HN "))
OR
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
(( segid " " and resid "57 " and name "HN "))
ASSI
(( segid " " and resid "39 " and name "HB1 "))
(( segid " " and resid "67 " and name "HN "))
2.700 0.900 0.900 peak 502 volume 0.561E+06 ppm1 3.216 ppm2 8.243
OR
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "67 " and name "HN "))
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "35 " and name "HA "))
2.800 1.000 1.000 peak 505 volume 0.559E+06 ppm1 1.668 ppm2 3.460
OR
(( segid " " and resid "34 " and name "HG2 "))
(( segid " " and resid "35 " and name "HA "))
ASSI
(( segid " " and resid "42 " and name "HA "))
(( segid " " and resid "42 " and name "HN "))
2.700 0.900 0.900 peak 511 volume 0.541E+06 ppm1 4.588 ppm2 8.932
OR
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "42 " and name "HN "))
ASSI
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "22 " and name "HN "))
2.600 0.800 0.800 peak 522 volume 0.524E+06 ppm1 0.546 ppm2 8.486
OR
(( segid " " and resid "43 " and name "HG21")
OR
( segid " " and resid "43 " and name "HG23")
OR
( segid " " and resid "43 " and name "HG22"))
(( segid " " and resid "45 " and name "HN "))
OR
(( segid " " and resid "43 " and name "HG21")
OR
( segid " " and resid "43 " and name "HG23")
OR
( segid " " and resid "43 " and name "HG22"))
(( segid " " and resid "58 " and name "HN "))
OR
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "45 " and name "HN "))
OR
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "58 " and name "HN "))
ASSI
(( segid " " and resid "9 " and name "HB2 "))
(( segid " " and resid "10 " and name "HN "))
2.600 0.800 0.800 peak 528 volume 0.514E+06 ppm1 2.416 ppm2 8.624
OR
(( segid " " and resid "10 " and name "HB2 "))
(( segid " " and resid "10 " and name "HN "))
ASSI
(( segid " " and resid "36 " and name "HA "))
(( segid " " and resid "37 " and name "HN "))
2.800 1.000 1.000 peak 542 volume 0.499E+06 ppm1 4.030 ppm2 7.751
OR
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "37 " and name "HN "))
ASSI
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "11 " and name "HA "))
2.800 1.000 1.000 peak 550 volume 0.488E+06 ppm1 0.618 ppm2 5.507
OR
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "11 " and name "HA "))
ASSI
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
(( segid " " and resid "16 " and name "HN "))
2.700 0.900 0.900 peak 556 volume 0.476E+06 ppm1 1.300 ppm2 8.722
OR
(( segid " " and resid "54 " and name "HG "))
(( segid " " and resid "16 " and name "HN "))
ASSI
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
(( segid " " and resid "68 " and name "HA "))
2.800 1.000 1.000 peak 564 volume 0.461E+06 ppm1 0.716 ppm2 3.414
OR
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
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(( segid " " and resid "68 " and name "HA "))
ASSI
(( segid " " and resid "21 " and name "HB2 "))
(( segid " " and resid "21 " and name "HD2 "))
2.800 1.000 1.000 peak 566 volume 0.458E+06 ppm1 2.934 ppm2 6.373
OR
(( segid " " and resid "20 " and name "HB2 "))
(( segid " " and resid "21 " and name "HD2 "))
ASSI
(( segid " " and resid "49 " and name "HB1 "))
(( segid " " and resid "53 " and name "HD21"))
2.800 1.000 1.000 peak 571 volume 0.451E+06 ppm1 3.990 ppm2 7.449
OR
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "25 " and name "HN "))
OR
(( segid " " and resid "18 " and name "HA "))
(( segid " " and resid "53 " and name "HD21"))
ASSI
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(( segid " " and resid "28 " and name "HN "))
2.800 1.000 1.000 peak 583 volume 0.436E+06 ppm1 4.148 ppm2 7.790
OR
(( segid " " and resid "28 " and name "HA "))
(( segid " " and resid "29 " and name "HN "))
OR
(( segid " " and resid "21 " and name "HA "))
(( segid " " and resid "24 " and name "HN "))
ASSI
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(( segid " " and resid "39 " and name "HE1 ")
OR
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2.800 1.000 1.000 peak 601 volume 0.413E+06 ppm1 1.950 ppm2 6.603
OR
(( segid " " and resid "13 " and name "HG2 "))
(( segid " " and resid "11 " and name "HE1 ")
OR
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ASSI
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
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(( segid " " and resid "72 " and name "HN "))
2.700 0.900 0.900 peak 609 volume 0.406E+06 ppm1 0.611 ppm2 7.849
OR
(( segid " " and resid "72 " and name "HD21")
OR
( segid " " and resid "72 " and name "HD23")
OR
( segid " " and resid "72 " and name "HD22"))
(( segid " " and resid "72 " and name "HN "))
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "58 " and name "HA "))
3.000 1.100 1.100 peak 610 volume 0.406E+06 ppm1 2.816 ppm2 5.343
OR
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "58 " and name "HA "))
ASSI
(( segid " " and resid "9 " and name "HN "))
(( segid " " and resid "10 " and name "HN "))
2.700 0.900 0.900 peak 615 volume 0.398E+06 ppm1 8.334 ppm2 8.617
OR
(( segid " " and resid "59 " and name "HN "))
(( segid " " and resid "10 " and name "HN "))
ASSI
(( segid " " and resid "45 " and name "HG11")
OR
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(( segid " " and resid "21 " and name "HA "))
3.000 1.100 1.100 peak 631 volume 0.374E+06 ppm1 1.340 ppm2 4.129
OR
(( segid " " and resid "24 " and name "HG "))
(( segid " " and resid "21 " and name "HA "))
ASSI
(( segid " " and resid "51 " and name "HA "))
(( segid " " and resid "52 " and name "HN "))
2.900 1.100 1.100 peak 637 volume 0.367E+06 ppm1 3.984 ppm2 8.492
OR
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "22 " and name "HN "))
ASSI
(( segid " " and resid "25 " and name "HD11")
OR
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OR
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(( segid " " and resid "25 " and name "HN "))
2.700 0.900 0.900 peak 638 volume 0.366E+06 ppm1 0.775 ppm2 7.442
OR
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "25 " and name "HN "))
ASSI
(( segid " " and resid "51 " and name "HB2 "))
(( segid " " and resid "51 " and name "HN "))
2.800 1.000 1.000 peak 660 volume 0.351E+06 ppm1 2.173 ppm2 7.607
OR
(( segid " " and resid "51 " and name "HB1 "))
(( segid " " and resid "51 " and name "HN "))
OR
(( segid " " and resid "50 " and name "HG1 ")
OR
( segid " " and resid "50 " and name "HG2 "))
(( segid " " and resid "50 " and name "HN "))
OR
(( segid " " and resid "50 " and name "HG1 ")
OR
( segid " " and resid "50 " and name "HG2 "))
(( segid " " and resid "51 " and name "HN "))
ASSI
(( segid " " and resid "53 " and name "HB2 "))
(( segid " " and resid "16 " and name "HN "))
2.800 1.000 1.000 peak 672 volume 0.338E+06 ppm1 2.626 ppm2 8.722
OR
(( segid " " and resid "15 " and name "HB1 "))
(( segid " " and resid "16 " and name "HN "))
ASSI
(( segid " " and resid "61 " and name "HD2 "))
(( segid " " and resid "64 " and name "HN "))
2.900 1.100 1.100 peak 673 volume 0.334E+06 ppm1 3.741 ppm2 8.597
OR
(( segid " " and resid "63 " and name "HA2 "))
(( segid " " and resid "64 " and name "HN "))
ASSI
(( segid " " and resid "68 " and name "HB1 "))
(( segid " " and resid "68 " and name "HE1 "))
2.900 1.100 1.100 peak 676 volume 0.333E+06 ppm1 1.779 ppm2 2.810
OR
(( segid " " and resid "12 " and name "HB "))
(( segid " " and resid "68 " and name "HE1 "))
OR
(( segid " " and resid "24 " and name "HB1 ")
OR
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(( segid " " and resid "31 " and name "HB1 "))
OR
(( segid " " and resid "25 " and name "HB "))
(( segid " " and resid "31 " and name "HB1 "))
OR
(( segid " " and resid "72 " and name "HB1 ")
OR
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(( segid " " and resid "68 " and name "HE1 "))
ASSI
(( segid " " and resid "24 " and name "HG "))
(( segid " " and resid "25 " and name "HA "))
3.000 1.100 1.100 peak 692 volume 0.319E+06 ppm1 1.366 ppm2 3.702
OR
(( segid " " and resid "74 " and name "HG "))
(( segid " " and resid "76 " and name "HB1 ")
OR
( segid " " and resid "76 " and name "HB2 "))
OR
(( segid " " and resid "24 " and name "HG "))
(( segid " " and resid "76 " and name "HB1 ")
OR
( segid " " and resid "76 " and name "HB2 "))
OR
(( segid " " and resid "30 " and name "HB1 ")
OR
( segid " " and resid "30 " and name "HB3 ")
OR
( segid " " and resid "30 " and name "HB2 "))
(( segid " " and resid "25 " and name "HA "))
OR
(( segid " " and resid "30 " and name "HB1 ")
OR
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OR
( segid " " and resid "30 " and name "HB2 "))
(( segid " " and resid "32 " and name "HA "))
ASSI
(( segid " " and resid "24 " and name "HA "))
(( segid " " and resid "25 " and name "HN "))
3.000 1.100 1.100 peak 696 volume 0.313E+06 ppm1 3.859 ppm2 7.449
OR
(( segid " " and resid "49 " and name "HB2 "))
(( segid " " and resid "53 " and name "HD21"))
ASSI
(( segid " " and resid "65 " and name "HN "))
(( segid " " and resid "67 " and name "HN "))
2.800 1.000 1.000 peak 699 volume 0.312E+06 ppm1 7.074 ppm2 8.243
OR
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "67 " and name "HN "))
ASSI
(( segid " " and resid "14 " and name "HD11")
OR
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OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "14 " and name "HN "))
2.800 1.000 1.000 peak 703 volume 0.309E+06 ppm1 0.644 ppm2 8.847
OR
(( segid " " and resid "54 " and name "HD21")
OR
( segid " " and resid "54 " and name "HD23")
OR
( segid " " and resid "54 " and name "HD22"))
(( segid " " and resid "55 " and name "HN "))
OR
(( segid " " and resid "72 " and name "HD21")
OR
( segid " " and resid "72 " and name "HD23")
OR
( segid " " and resid "72 " and name "HD22"))
(( segid " " and resid "14 " and name "HN "))
OR
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "14 " and name "HN "))
OR
(( segid " " and resid "54 " and name "HD21")
OR
( segid " " and resid "54 " and name "HD23")
OR
( segid " " and resid "54 " and name "HD22"))
(( segid " " and resid "14 " and name "HN "))
OR
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "55 " and name "HN "))
OR
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
(( segid " " and resid "14 " and name "HN "))
ASSI
(( segid " " and resid "37 " and name "HB1 "))
(( segid " " and resid "33 " and name "HD22"))
2.900 1.100 1.100 peak 714 volume 0.302E+06 ppm1 2.619 ppm2 6.773
OR
(( segid " " and resid "10 " and name "HB1 "))
(( segid " " and resid "11 " and name "HD1 ")
OR
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OR
(( segid " " and resid "15 " and name "HB1 "))
(( segid " " and resid "15 " and name "HD22"))
ASSI
(( segid " " and resid "56 " and name "HB1 ")
OR
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(( segid " " and resid "57 " and name "HA "))
3.100 1.200 1.200 peak 715 volume 0.300E+06 ppm1 1.589 ppm2 4.910
OR
(( segid " " and resid "57 " and name "HB "))
(( segid " " and resid "57 " and name "HA "))
ASSI
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
(( segid " " and resid "31 " and name "HB1 "))
2.900 1.100 1.100 peak 717 volume 0.298E+06 ppm1 0.624 ppm2 2.790
OR
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
(( segid " " and resid "33 " and name "HB1 "))
OR
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
(( segid " " and resid "31 " and name "HB1 "))
OR
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "11 " and name "HB2 "))
OR
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
(( segid " " and resid "11 " and name "HB2 "))
OR
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "11 " and name "HB2 "))
ASSI
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "21 " and name "HE1 "))
2.900 1.100 1.100 peak 720 volume 0.295E+06 ppm1 0.775 ppm2 7.948
OR
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "43 " and name "HN "))
OR
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
(( segid " " and resid "43 " and name "HN "))
ASSI
(( segid " " and resid "24 " and name "HD21")
OR
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OR
( segid " " and resid "24 " and name "HD22"))
(( segid " " and resid "23 " and name "HB1 "))
2.900 1.100 1.100 peak 723 volume 0.293E+06 ppm1 0.684 ppm2 3.125
OR
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "23 " and name "HB1 "))
ASSI
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "25 " and name "HN "))
2.800 1.000 1.000 peak 729 volume 0.287E+06 ppm1 0.539 ppm2 7.449
OR
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
(( segid " " and resid "66 " and name "HN "))
OR
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
(( segid " " and resid "53 " and name "HD21"))
ASSI
(( segid " " and resid "36 " and name "HG2 "))
(( segid " " and resid "42 " and name "HN "))
2.900 1.100 1.100 peak 733 volume 0.282E+06 ppm1 1.458 ppm2 8.925
OR
(( segid " " and resid "44 " and name "HG1 "))
(( segid " " and resid "42 " and name "HN "))
OR
(( segid " " and resid "56 " and name "HG1 "))
(( segid " " and resid "57 " and name "HN "))
ASSI
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "66 " and name "HN "))
3.000 1.100 1.100 peak 734 volume 0.282E+06 ppm1 4.063 ppm2 7.462
OR
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "66 " and name "HN "))
OR
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "53 " and name "HD21"))
ASSI
(( segid " " and resid "71 " and name "HD11")
OR
( segid " " and resid "71 " and name "HD13")
OR
( segid " " and resid "71 " and name "HD12"))
(( segid " " and resid "71 " and name "HN "))
2.800 1.000 1.000 peak 735 volume 0.282E+06 ppm1 0.789 ppm2 8.295
OR
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "20 " and name "HN "))
OR
(( segid " " and resid "19 " and name "HG1 "))
(( segid " " and resid "20 " and name "HN "))
OR
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OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
(( segid " " and resid "71 " and name "HN "))
OR
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "71 " and name "HN "))
ASSI
(( segid " " and resid "24 " and name "HD21")
OR
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OR
( segid " " and resid "24 " and name "HD22"))
(( segid " " and resid "21 " and name "HN "))
2.800 1.000 1.000 peak 739 volume 0.279E+06 ppm1 0.684 ppm2 7.981
OR
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "21 " and name "HN "))
ASSI
(( segid " " and resid "56 " and name "HG1 "))
(( segid " " and resid "56 " and name "HN "))
2.900 1.100 1.100 peak 745 volume 0.274E+06 ppm1 1.471 ppm2 7.587
OR
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(( segid " " and resid "39 " and name "HN "))
ASSI
(( segid " " and resid "36 " and name "HB1 ")
OR
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(( segid " " and resid "37 " and name "HB1 "))
3.000 1.100 1.100 peak 755 volume 0.267E+06 ppm1 1.858 ppm2 2.620
OR
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "10 " and name "HB1 "))
OR
(( segid " " and resid "38 " and name "HG1 "))
(( segid " " and resid "37 " and name "HB1 "))
OR
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(( segid " " and resid "60 " and name "HB2 "))
OR
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(( segid " " and resid "37 " and name "HB1 "))
OR
(( segid " " and resid "61 " and name "HB1 ")
OR
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(( segid " " and resid "60 " and name "HB2 "))
ASSI
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "23 " and name "HN "))
3.100 1.200 1.200 peak 757 volume 0.265E+06 ppm1 3.997 ppm2 7.705
OR
(( segid " " and resid "36 " and name "HA "))
(( segid " " and resid "40 " and name "HN "))
ASSI
(( segid " " and resid "9 " and name "HB2 "))
(( segid " " and resid "9 " and name "HN "))
2.900 1.100 1.100 peak 760 volume 0.263E+06 ppm1 2.416 ppm2 8.328
OR
(( segid " " and resid "10 " and name "HB2 "))
(( segid " " and resid "59 " and name "HN "))
ASSI
(( segid " " and resid "41 " and name "HG21")
OR
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OR
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(( segid " " and resid "35 " and name "HA "))
3.100 1.200 1.200 peak 762 volume 0.261E+06 ppm1 0.441 ppm2 3.460
OR
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "67 " and name "HA "))
ASSI
(( segid " " and resid "58 " and name "HB1 "))
(( segid " " and resid "58 " and name "HG1 ")
OR
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3.000 1.100 1.100 peak 763 volume 0.261E+06 ppm1 1.976 ppm2 2.147
OR
(( segid " " and resid "51 " and name "HG1 ")
OR
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(( segid " " and resid "51 " and name "HB2 "))
ASSI
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OR
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(( segid " " and resid "20 " and name "HZ "))
3.000 1.100 1.100 peak 764 volume 0.260E+06 ppm1 1.300 ppm2 7.187
OR
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
(( segid " " and resid "20 " and name "HD1 ")
OR
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OR
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OR
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(( segid " " and resid "20 " and name "HD1 ")
OR
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OR
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(( segid " " and resid "20 " and name "HD1 ")
OR
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OR
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OR
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(( segid " " and resid "20 " and name "HD1 ")
OR
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OR
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OR
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(( segid " " and resid "20 " and name "HE1 ")
OR
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ASSI
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OR
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OR
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(( segid " " and resid "68 " and name "HN "))
2.900 1.100 1.100 peak 765 volume 0.260E+06 ppm1 0.618 ppm2 8.000
OR
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OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "68 " and name "HN "))
OR
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OR
( segid " " and resid "64 " and name "HG13")
OR
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(( segid " " and resid "68 " and name "HN "))
OR
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OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
(( segid " " and resid "68 " and name "HN "))
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "35 " and name "HN "))
3.100 1.200 1.200 peak 778 volume 0.254E+06 ppm1 4.509 ppm2 7.666
OR
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "32 " and name "HN "))
ASSI
(( segid " " and resid "13 " and name "HB1 "))
(( segid " " and resid "15 " and name "HD22"))
3.000 1.100 1.100 peak 782 volume 0.250E+06 ppm1 1.851 ppm2 6.767
OR
(( segid " " and resid "58 " and name "HB2 "))
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
OR
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OR
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OR
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OR
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(( segid " " and resid "33 " and name "HD22"))
ASSI
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OR
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ASSI
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ASSI
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ASSI
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OR
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ASSI
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OR
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ASSI
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ASSI
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OR
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OR
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ASSI
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ASSI
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OR
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ASSI
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OR
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OR
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OR
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ASSI
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OR
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OR
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OR
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OR
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OR
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ASSI
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OR
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OR
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2.900 1.100 1.100 peak 826 volume 0.233E+06 ppm1 0.677 ppm2 0.979
OR
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OR
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ASSI
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OR
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OR
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OR
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OR
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OR
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ASSI
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OR
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3.000 1.100 1.100 peak 838 volume 0.227E+06 ppm1 1.386 ppm2 7.252
OR
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(( segid " " and resid "75 " and name "HN "))
ASSI
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(( segid " " and resid "22 " and name "HN "))
3.000 1.100 1.100 peak 851 volume 0.222E+06 ppm1 1.602 ppm2 8.486
OR
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ASSI
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OR
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OR
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2.000 0.500 0.500 peak 860 volume 0.214E+07 ppm1 0.539 ppm2 1.065
OR
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OR
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ASSI
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2.200 0.600 0.600 peak 864 volume 0.167E+07 ppm1 1.707 ppm2 8.499
OR
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(( segid " " and resid "45 " and name "HN "))
ASSI
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3.000 1.100 1.100 peak 909 volume 0.236E+06 ppm1 2.928 ppm2 6.872
OR
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ASSI
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3.200 1.300 1.300 peak 910 volume 0.229E+06 ppm1 0.670 ppm2 4.017
OR
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ASSI
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OR
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ASSI
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OR
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ASSI
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OR
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ASSI
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OR
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ASSI
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3.000 1.100 1.100 peak 950 volume 0.257E+06 ppm1 1.064 ppm2 1.964
OR
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ASSI
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OR
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OR
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( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "42 " and name "HB1 ")
OR
( segid " " and resid "42 " and name "HB2 "))
OR
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
(( segid " " and resid "76 " and name "HB1 ")
OR
( segid " " and resid "76 " and name "HB2 "))
OR
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "25 " and name "HA "))
OR
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "25 " and name "HA "))
ASSI
(( segid " " and resid "36 " and name "HG2 "))
(( segid " " and resid "35 " and name "HA "))
3.200 1.300 1.300 peak 987 volume 0.255E+06 ppm1 1.458 ppm2 3.460
OR
(( segid " " and resid "38 " and name "HG2 "))
(( segid " " and resid "35 " and name "HA "))
OR
(( segid " " and resid "54 " and name "HB1 ")
OR
( segid " " and resid "54 " and name "HB2 "))
(( segid " " and resid "52 " and name "HB2 "))
ASSI
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "43 " and name "HB "))
3.000 1.100 1.100 peak 991 volume 0.234E+06 ppm1 0.454 ppm2 1.714
OR
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "45 " and name "HB "))
OR
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "43 " and name "HB "))
ASSI
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
(( segid " " and resid "43 " and name "HB "))
3.000 1.100 1.100 peak 993 volume 0.225E+06 ppm1 0.454 ppm2 1.728
OR
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
(( segid " " and resid "43 " and name "HB "))
ASSI
(( segid " " and resid "54 " and name "HB1 ")
OR
( segid " " and resid "54 " and name "HB2 "))
(( segid " " and resid "54 " and name "HG "))
1.600 0.300 0.300 peak 996 volume 0.118E+08 ppm1 1.438 ppm2 1.340
OR
(( segid " " and resid "56 " and name "HG1 "))
(( segid " " and resid "56 " and name "HG2 "))
ASSI
(( segid " " and resid "10 " and name "HB1 "))
(( segid " " and resid "10 " and name "HB2 "))
1.700 0.400 0.400 peak 999 volume 0.885E+07 ppm1 2.619 ppm2 2.410
OR
(( segid " " and resid "15 " and name "HB1 "))
(( segid " " and resid "15 " and name "HB2 "))
ASSI
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
1.600 0.300 0.300 peak 1003 volume 0.848E+07 ppm1 0.762 ppm2 0.540
OR
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
OR
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
(( segid " " and resid "57 " and name "HG12"))
ASSI
(( segid " " and resid "34 " and name "HB1 ")
OR
( segid " " and resid "34 " and name "HB2 "))
(( segid " " and resid "34 " and name "HG1 "))
1.700 0.400 0.400 peak 1008 volume 0.730E+07 ppm1 2.055 ppm2 1.839
OR
(( segid " " and resid "62 " and name "HB1 ")
OR
( segid " " and resid "62 " and name "HB2 "))
(( segid " " and resid "62 " and name "HG2 "))
ASSI
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
1.700 0.400 0.400 peak 1009 volume 0.727E+07 ppm1 1.635 ppm2 0.724
OR
(( segid " " and resid "14 " and name "HB "))
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
ASSI
(( segid " " and resid "54 " and name "HG "))
(( segid " " and resid "54 " and name "HD21")
OR
( segid " " and resid "54 " and name "HD23")
OR
( segid " " and resid "54 " and name "HD22"))
1.700 0.400 0.400 peak 1014 volume 0.655E+07 ppm1 1.372 ppm2 0.638
OR
(( segid " " and resid "57 " and name "HG11"))
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
ASSI
(( segid " " and resid "35 " and name "HB "))
(( segid " " and resid "35 " and name "HD11")
OR
( segid " " and resid "35 " and name "HD13")
OR
( segid " " and resid "35 " and name "HD12"))
1.700 0.400 0.400 peak 1015 volume 0.617E+07 ppm1 1.779 ppm2 0.697
OR
(( segid " " and resid "12 " and name "HB "))
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
OR
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
OR
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
ASSI
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
1.800 0.400 0.400 peak 1017 volume 0.600E+07 ppm1 1.799 ppm2 0.776
OR
(( segid " " and resid "35 " and name "HB "))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
OR
(( segid " " and resid "25 " and name "HB "))
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
OR
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
(( segid " " and resid "74 " and name "HD21")
OR
( segid " " and resid "74 " and name "HD23")
OR
( segid " " and resid "74 " and name "HD22"))
ASSI
(( segid " " and resid "19 " and name "HG1 "))
(( segid " " and resid "19 " and name "HG2 "))
1.800 0.400 0.400 peak 1020 volume 0.587E+07 ppm1 0.795 ppm2 0.448
OR
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
OR
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
ASSI
(( segid " " and resid "72 " and name "HG "))
(( segid " " and resid "72 " and name "HD11")
OR
( segid " " and resid "72 " and name "HD13")
OR
( segid " " and resid "72 " and name "HD12"))
1.800 0.400 0.400 peak 1030 volume 0.516E+07 ppm1 1.307 ppm2 0.724
OR
(( segid " " and resid "54 " and name "HG "))
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
ASSI
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
2.000 0.500 0.500 peak 1044 volume 0.434E+07 ppm1 3.459 ppm2 1.065
OR
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
ASSI
(( segid " " and resid "72 " and name "HG "))
(( segid " " and resid "72 " and name "HD21")
OR
( segid " " and resid "72 " and name "HD23")
OR
( segid " " and resid "72 " and name "HD22"))
1.900 0.500 0.500 peak 1057 volume 0.385E+07 ppm1 1.281 ppm2 0.625
OR
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
OR
(( segid " " and resid "72 " and name "HG "))
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
ASSI
(( segid " " and resid "12 " and name "HB "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
2.000 0.500 0.500 peak 1081 volume 0.309E+07 ppm1 1.779 ppm2 0.638
OR
(( segid " " and resid "13 " and name "HB2 "))
(( segid " " and resid "54 " and name "HD21")
OR
( segid " " and resid "54 " and name "HD23")
OR
( segid " " and resid "54 " and name "HD22"))
OR
(( segid " " and resid "68 " and name "HB1 "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
ASSI
(( segid " " and resid "69 " and name "HB1 "))
(( segid " " and resid "69 " and name "HG1 "))
2.000 0.500 0.500 peak 1083 volume 0.306E+07 ppm1 1.806 ppm2 1.577
OR
(( segid " " and resid "68 " and name "HB1 "))
(( segid " " and resid "68 " and name "HG1 "))
ASSI
(( segid " " and resid "74 " and name "HG "))
(( segid " " and resid "74 " and name "HD21")
OR
( segid " " and resid "74 " and name "HD23")
OR
( segid " " and resid "74 " and name "HD22"))
2.000 0.500 0.500 peak 1084 volume 0.304E+07 ppm1 1.392 ppm2 0.776
OR
(( segid " " and resid "74 " and name "HG "))
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
ASSI
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
1.900 0.500 0.500 peak 1085 volume 0.300E+07 ppm1 1.064 ppm2 0.533
OR
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
ASSI
(( segid " " and resid "67 " and name "HA "))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
2.100 0.600 0.600 peak 1091 volume 0.269E+07 ppm1 3.466 ppm2 0.789
OR
(( segid " " and resid "35 " and name "HA "))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
ASSI
(( segid " " and resid "68 " and name "HG2 "))
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
2.000 0.500 0.500 peak 1096 volume 0.253E+07 ppm1 1.123 ppm2 0.724
OR
(( segid " " and resid "68 " and name "HG2 "))
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
ASSI
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
2.000 0.500 0.500 peak 1123 volume 0.224E+07 ppm1 0.697 ppm2 0.225
OR
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
ASSI
(( segid " " and resid "64 " and name "HN "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
2.000 0.500 0.500 peak 1127 volume 0.218E+07 ppm1 8.597 ppm2 0.612
OR
(( segid " " and resid "64 " and name "HN "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "71 " and name "HD11")
OR
( segid " " and resid "71 " and name "HD13")
OR
( segid " " and resid "71 " and name "HD12"))
2.200 0.600 0.600 peak 1129 volume 0.215E+07 ppm1 3.990 ppm2 0.783
OR
(( segid " " and resid "22 " and name "HA "))
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
OR
(( segid " " and resid "36 " and name "HA "))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
ASSI
(( segid " " and resid "69 " and name "HA "))
(( segid " " and resid "69 " and name "HB1 "))
2.200 0.600 0.600 peak 1132 volume 0.208E+07 ppm1 3.728 ppm2 1.826
OR
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "38 " and name "HG1 "))
ASSI
(( segid " " and resid "31 " and name "HD21"))
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
2.100 0.600 0.600 peak 1140 volume 0.202E+07 ppm1 7.586 ppm2 1.800
OR
(( segid " " and resid "74 " and name "HN "))
(( segid " " and resid "74 " and name "HB1 ")
OR
( segid " " and resid "74 " and name "HB2 "))
ASSI
(( segid " " and resid "56 " and name "HD1 "))
(( segid " " and resid "56 " and name "HB1 ")
OR
( segid " " and resid "56 " and name "HB2 "))
2.200 0.600 0.600 peak 1147 volume 0.194E+07 ppm1 2.954 ppm2 1.629
OR
(( segid " " and resid "44 " and name "HD1 ")
OR
( segid " " and resid "44 " and name "HD2 "))
(( segid " " and resid "44 " and name "HB2 "))
ASSI
(( segid " " and resid "65 " and name "HE21"))
(( segid " " and resid "62 " and name "HB1 ")
OR
( segid " " and resid "62 " and name "HB2 "))
2.100 0.600 0.600 peak 1157 volume 0.185E+07 ppm1 7.665 ppm2 2.016
OR
(( segid " " and resid "65 " and name "HE21"))
(( segid " " and resid "65 " and name "HG2 "))
ASSI
(( segid " " and resid "43 " and name "HG21")
OR
( segid " " and resid "43 " and name "HG23")
OR
( segid " " and resid "43 " and name "HG22"))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
2.100 0.600 0.600 peak 1158 volume 0.184E+07 ppm1 0.565 ppm2 0.231
OR
(( segid " " and resid "16 " and name "HD11")
OR
( segid " " and resid "16 " and name "HD13")
OR
( segid " " and resid "16 " and name "HD12"))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
ASSI
(( segid " " and resid "32 " and name "HN "))
(( segid " " and resid "32 " and name "HB "))
2.100 0.600 0.600 peak 1161 volume 0.181E+07 ppm1 7.658 ppm2 1.964
OR
(( segid " " and resid "70 " and name "HN "))
(( segid " " and resid "70 " and name "HB2 "))
ASSI
(( segid " " and resid "75 " and name "HA "))
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
2.300 0.700 0.700 peak 1162 volume 0.180E+07 ppm1 3.997 ppm2 1.668
OR
(( segid " " and resid "36 " and name "HA "))
(( segid " " and resid "36 " and name "HG1 "))
ASSI
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "65 " and name "HG2 "))
2.300 0.700 0.700 peak 1166 volume 0.176E+07 ppm1 4.056 ppm2 2.042
OR
(( segid " " and resid "62 " and name "HA "))
(( segid " " and resid "62 " and name "HB1 ")
OR
( segid " " and resid "62 " and name "HB2 "))
OR
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "34 " and name "HB1 ")
OR
( segid " " and resid "34 " and name "HB2 "))
ASSI
(( segid " " and resid "19 " and name "HD1 ")
OR
( segid " " and resid "19 " and name "HD2 "))
(( segid " " and resid "19 " and name "HG2 "))
2.200 0.600 0.600 peak 1172 volume 0.167E+07 ppm1 1.307 ppm2 0.448
OR
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
OR
(( segid " " and resid "55 " and name "HG11"))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
ASSI
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
2.300 0.700 0.700 peak 1178 volume 0.164E+07 ppm1 3.833 ppm2 1.642
OR
(( segid " " and resid "72 " and name "HA "))
(( segid " " and resid "14 " and name "HB "))
ASSI
(( segid " " and resid "65 " and name "HN "))
(( segid " " and resid "65 " and name "HA "))
2.300 0.700 0.700 peak 1179 volume 0.163E+07 ppm1 7.087 ppm2 3.742
OR
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "63 " and name "HA2 "))
OR
(( segid " " and resid "69 " and name "HN "))
(( segid " " and resid "69 " and name "HA "))
ASSI
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "10 " and name "HB1 "))
2.300 0.700 0.700 peak 1183 volume 0.160E+07 ppm1 4.778 ppm2 2.613
OR
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "60 " and name "HB2 "))
ASSI
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
2.200 0.600 0.600 peak 1187 volume 0.159E+07 ppm1 1.963 ppm2 0.645
OR
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
ASSI
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "71 " and name "HG "))
2.300 0.700 0.700 peak 1188 volume 0.159E+07 ppm1 3.833 ppm2 1.091
OR
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
ASSI
(( segid " " and resid "66 " and name "HN "))
(( segid " " and resid "66 " and name "HA "))
2.300 0.700 0.700 peak 1191 volume 0.158E+07 ppm1 7.455 ppm2 3.729
OR
(( segid " " and resid "25 " and name "HN "))
(( segid " " and resid "25 " and name "HA "))
OR
(( segid " " and resid "66 " and name "HN "))
(( segid " " and resid "65 " and name "HA "))
ASSI
(( segid " " and resid "19 " and name "HA "))
(( segid " " and resid "19 " and name "HG1 "))
2.300 0.700 0.700 peak 1194 volume 0.154E+07 ppm1 3.833 ppm2 0.783
OR
(( segid " " and resid "70 " and name "HA "))
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
OR
(( segid " " and resid "71 " and name "HA "))
(( segid " " and resid "71 " and name "HD11")
OR
( segid " " and resid "71 " and name "HD13")
OR
( segid " " and resid "71 " and name "HD12"))
ASSI
(( segid " " and resid "46 " and name "HA "))
(( segid " " and resid "46 " and name "HG1 ")
OR
( segid " " and resid "46 " and name "HG2 "))
2.400 0.700 0.700 peak 1198 volume 0.150E+07 ppm1 4.522 ppm2 2.036
OR
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "34 " and name "HB1 ")
OR
( segid " " and resid "34 " and name "HB2 "))
ASSI
(( segid " " and resid "68 " and name "HA "))
(( segid " " and resid "57 " and name "HB "))
2.400 0.700 0.700 peak 1206 volume 0.146E+07 ppm1 3.413 ppm2 1.577
OR
(( segid " " and resid "68 " and name "HA "))
(( segid " " and resid "68 " and name "HG1 "))
ASSI
(( segid " " and resid "56 " and name "HD1 "))
(( segid " " and resid "56 " and name "HG1 "))
2.300 0.700 0.700 peak 1207 volume 0.146E+07 ppm1 2.960 ppm2 1.452
OR
(( segid " " and resid "44 " and name "HD1 ")
OR
( segid " " and resid "44 " and name "HD2 "))
(( segid " " and resid "44 " and name "HG1 "))
ASSI
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "55 " and name "HB "))
2.200 0.600 0.600 peak 1213 volume 0.139E+07 ppm1 8.839 ppm2 1.524
OR
(( segid " " and resid "17 " and name "HN "))
(( segid " " and resid "16 " and name "HB "))
OR
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "55 " and name "HB "))
ASSI
(( segid " " and resid "68 " and name "HB1 "))
(( segid " " and resid "68 " and name "HG2 "))
2.300 0.700 0.700 peak 1214 volume 0.139E+07 ppm1 1.792 ppm2 1.117
OR
(( segid " " and resid "72 " and name "HB1 ")
OR
( segid " " and resid "72 " and name "HB2 "))
(( segid " " and resid "68 " and name "HG2 "))
ASSI
(( segid " " and resid "68 " and name "HE2 "))
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
2.200 0.600 0.600 peak 1215 volume 0.139E+07 ppm1 2.737 ppm2 0.724
OR
(( segid " " and resid "68 " and name "HE2 "))
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
ASSI
(( segid " " and resid "20 " and name "HN "))
(( segid " " and resid "21 " and name "HN "))
2.200 0.600 0.600 peak 1229 volume 0.132E+07 ppm1 8.255 ppm2 7.994
OR
(( segid " " and resid "67 " and name "HN "))
(( segid " " and resid "68 " and name "HN "))
ASSI
(( segid " " and resid "71 " and name "HN "))
(( segid " " and resid "71 " and name "HA "))
2.400 0.700 0.700 peak 1232 volume 0.130E+07 ppm1 8.301 ppm2 3.827
OR
(( segid " " and resid "20 " and name "HN "))
(( segid " " and resid "19 " and name "HA "))
ASSI
(( segid " " and resid "35 " and name "HN "))
(( segid " " and resid "35 " and name "HB "))
2.200 0.600 0.600 peak 1235 volume 0.129E+07 ppm1 7.678 ppm2 1.773
OR
(( segid " " and resid "73 " and name "HN "))
(( segid " " and resid "72 " and name "HB1 ")
OR
( segid " " and resid "72 " and name "HB2 "))
ASSI
(( segid " " and resid "56 " and name "HN "))
(( segid " " and resid "56 " and name "HB1 ")
OR
( segid " " and resid "56 " and name "HB2 "))
2.300 0.700 0.700 peak 1245 volume 0.125E+07 ppm1 7.573 ppm2 1.623
OR
(( segid " " and resid "56 " and name "HN "))
(( segid " " and resid "44 " and name "HB2 "))
ASSI
(( segid " " and resid "38 " and name "HN "))
(( segid " " and resid "39 " and name "HN "))
2.200 0.600 0.600 peak 1259 volume 0.118E+07 ppm1 8.531 ppm2 7.593
OR
(( segid " " and resid "52 " and name "HN "))
(( segid " " and resid "51 " and name "HN "))
ASSI
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
2.400 0.700 0.700 peak 1271 volume 0.115E+07 ppm1 4.673 ppm2 0.684
OR
(( segid " " and resid "20 " and name "HA "))
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
ASSI
(( segid " " and resid "6 " and name "HN "))
(( segid " " and resid "6 " and name "HB "))
2.300 0.700 0.700 peak 1277 volume 0.113E+07 ppm1 7.993 ppm2 1.800
OR
(( segid " " and resid "68 " and name "HN "))
(( segid " " and resid "68 " and name "HB1 "))
ASSI
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
2.300 0.700 0.700 peak 1284 volume 0.110E+07 ppm1 0.664 ppm2 0.448
OR
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
OR
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
ASSI
(( segid " " and resid "68 " and name "HN "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
2.300 0.700 0.700 peak 1286 volume 0.110E+07 ppm1 7.993 ppm2 1.065
OR
(( segid " " and resid "68 " and name "HN "))
(( segid " " and resid "68 " and name "HB2 "))
ASSI
(( segid " " and resid "35 " and name "HN "))
(( segid " " and resid "35 " and name "HA "))
2.400 0.700 0.700 peak 1290 volume 0.108E+07 ppm1 7.685 ppm2 3.466
OR
(( segid " " and resid "70 " and name "HN "))
(( segid " " and resid "67 " and name "HA "))
ASSI
(( segid " " and resid "37 " and name "HN "))
(( segid " " and resid "37 " and name "HB1 "))
2.300 0.700 0.700 peak 1291 volume 0.107E+07 ppm1 7.750 ppm2 2.640
OR
(( segid " " and resid "54 " and name "HN "))
(( segid " " and resid "53 " and name "HB2 "))
ASSI
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
2.400 0.700 0.700 peak 1302 volume 0.105E+07 ppm1 7.055 ppm2 1.065
OR
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
ASSI
(( segid " " and resid "47 " and name "HA "))
(( segid " " and resid "47 " and name "HG2 "))
2.500 0.800 0.800 peak 1308 volume 0.103E+07 ppm1 4.515 ppm2 1.898
OR
(( segid " " and resid "9 " and name "HA "))
(( segid " " and resid "9 " and name "HG1 ")
OR
( segid " " and resid "9 " and name "HG2 "))
ASSI
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "37 " and name "HB1 "))
2.500 0.800 0.800 peak 1317 volume 0.101E+07 ppm1 4.050 ppm2 2.633
OR
(( segid " " and resid "49 " and name "HB1 "))
(( segid " " and resid "53 " and name "HB2 "))
OR
(( segid " " and resid "17 " and name "HA "))
(( segid " " and resid "53 " and name "HB2 "))
ASSI
(( segid " " and resid "56 " and name "HN "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
2.300 0.700 0.700 peak 1326 volume 0.974E+06 ppm1 7.586 ppm2 0.776
OR
(( segid " " and resid "74 " and name "HN "))
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
OR
(( segid " " and resid "26 " and name "HN "))
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
OR
(( segid " " and resid "74 " and name "HN "))
(( segid " " and resid "74 " and name "HD21")
OR
( segid " " and resid "74 " and name "HD23")
OR
( segid " " and resid "74 " and name "HD22"))
OR
(( segid " " and resid "39 " and name "HN "))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
ASSI
(( segid " " and resid "61 " and name "HD1 "))
(( segid " " and resid "64 " and name "HB "))
2.500 0.800 0.800 peak 1328 volume 0.969E+06 ppm1 3.912 ppm2 1.846
OR
(( segid " " and resid "61 " and name "HD1 "))
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB2 "))
OR
(( segid " " and resid "59 " and name "HA2 "))
(( segid " " and resid "64 " and name "HB "))
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "10 " and name "HB2 "))
2.600 0.800 0.800 peak 1334 volume 0.946E+06 ppm1 4.798 ppm2 2.403
OR
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "10 " and name "HB2 "))
ASSI
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
(( segid " " and resid "35 " and name "HA "))
2.600 0.800 0.800 peak 1347 volume 0.908E+06 ppm1 6.595 ppm2 3.466
OR
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
(( segid " " and resid "67 " and name "HA "))
ASSI
(( segid " " and resid "23 " and name "HA "))
(( segid " " and resid "22 " and name "HB1 "))
2.600 0.800 0.800 peak 1352 volume 0.896E+06 ppm1 4.358 ppm2 1.708
OR
(( segid " " and resid "45 " and name "HA "))
(( segid " " and resid "45 " and name "HB "))
ASSI
(( segid " " and resid "31 " and name "HA "))
(( segid " " and resid "31 " and name "HB1 "))
2.600 0.800 0.800 peak 1366 volume 0.846E+06 ppm1 4.515 ppm2 2.810
OR
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "68 " and name "HE1 "))
ASSI
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "68 " and name "HB2 "))
2.500 0.800 0.800 peak 1368 volume 0.840E+06 ppm1 3.721 ppm2 1.065
OR
(( segid " " and resid "25 " and name "HA "))
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
OR
(( segid " " and resid "61 " and name "HD2 "))
(( segid " " and resid "61 " and name "HG1 ")
OR
( segid " " and resid "61 " and name "HG2 "))
ASSI
(( segid " " and resid "59 " and name "HA2 "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
2.500 0.800 0.800 peak 1371 volume 0.836E+06 ppm1 3.918 ppm2 0.533
OR
(( segid " " and resid "46 " and name "HD1 "))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
OR
(( segid " " and resid "61 " and name "HD1 "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
ASSI
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
2.500 0.800 0.800 peak 1387 volume 0.799E+06 ppm1 7.173 ppm2 1.084
OR
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
ASSI
(( segid " " and resid "72 " and name "HN "))
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
2.400 0.700 0.700 peak 1397 volume 0.769E+06 ppm1 7.842 ppm2 0.730
OR
(( segid " " and resid "72 " and name "HN "))
(( segid " " and resid "72 " and name "HD11")
OR
( segid " " and resid "72 " and name "HD13")
OR
( segid " " and resid "72 " and name "HD12"))
ASSI
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "55 " and name "HG11"))
2.500 0.800 0.800 peak 1403 volume 0.761E+06 ppm1 8.839 ppm2 1.327
OR
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "54 " and name "HG "))
ASSI
(( segid " " and resid "59 " and name "HN "))
(( segid " " and resid "64 " and name "HB "))
2.500 0.800 0.800 peak 1409 volume 0.741E+06 ppm1 8.360 ppm2 1.839
OR
(( segid " " and resid "13 " and name "HN "))
(( segid " " and resid "13 " and name "HB1 "))
ASSI
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
2.400 0.700 0.700 peak 1411 volume 0.739E+06 ppm1 8.859 ppm2 0.724
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
ASSI
(( segid " " and resid "10 " and name "HB2 "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
2.500 0.800 0.800 peak 1413 volume 0.725E+06 ppm1 2.396 ppm2 0.612
OR
(( segid " " and resid "65 " and name "HG1 "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
ASSI
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
2.500 0.800 0.800 peak 1424 volume 0.692E+06 ppm1 3.216 ppm2 0.441
OR
(( segid " " and resid "39 " and name "HB1 "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
ASSI
(( segid " " and resid "50 " and name "HN "))
(( segid " " and resid "50 " and name "HA "))
2.700 0.900 0.900 peak 1443 volume 0.648E+06 ppm1 7.593 ppm2 3.965
OR
(( segid " " and resid "26 " and name "HN "))
(( segid " " and resid "22 " and name "HA "))
OR
(( segid " " and resid "51 " and name "HN "))
(( segid " " and resid "50 " and name "HA "))
ASSI
(( segid " " and resid "74 " and name "HN "))
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
2.500 0.800 0.800 peak 1448 volume 0.641E+06 ppm1 7.593 ppm2 1.091
OR
(( segid " " and resid "39 " and name "HN "))
(( segid " " and resid "38 " and name "HB2 "))
ASSI
(( segid " " and resid "47 " and name "HG1 "))
(( segid " " and resid "25 " and name "HD11")
OR
( segid " " and resid "25 " and name "HD13")
OR
( segid " " and resid "25 " and name "HD12"))
2.600 0.800 0.800 peak 1451 volume 0.627E+06 ppm1 2.029 ppm2 0.776
OR
(( segid " " and resid "34 " and name "HB1 ")
OR
( segid " " and resid "34 " and name "HB2 "))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
OR
(( segid " " and resid "70 " and name "HB1 "))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
OR
(( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "74 " and name "HD21")
OR
( segid " " and resid "74 " and name "HD23")
OR
( segid " " and resid "74 " and name "HD22"))
OR
(( segid " " and resid "70 " and name "HB1 "))
(( segid " " and resid "71 " and name "HD11")
OR
( segid " " and resid "71 " and name "HD13")
OR
( segid " " and resid "71 " and name "HD12"))
OR
(( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
OR
(( segid " " and resid "70 " and name "HB1 "))
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
OR
(( segid " " and resid "46 " and name "HG1 ")
OR
( segid " " and resid "46 " and name "HG2 "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
ASSI
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "55 " and name "HG12"))
2.500 0.800 0.800 peak 1452 volume 0.616E+06 ppm1 8.859 ppm2 0.835
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
OR
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "14 " and name "HG11")
OR
( segid " " and resid "14 " and name "HG12"))
ASSI
(( segid " " and resid "30 " and name "HA "))
(( segid " " and resid "33 " and name "HB1 "))
2.800 1.000 1.000 peak 1455 volume 0.613E+06 ppm1 4.050 ppm2 2.790
OR
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "33 " and name "HB1 "))
ASSI
(( segid " " and resid "66 " and name "HA "))
(( segid " " and resid "65 " and name "HG1 "))
2.800 1.000 1.000 peak 1460 volume 0.604E+06 ppm1 3.728 ppm2 2.377
OR
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "65 " and name "HG1 "))
OR
(( segid " " and resid "63 " and name "HA2 "))
(( segid " " and resid "65 " and name "HG1 "))
ASSI
(( segid " " and resid "73 " and name "HN "))
(( segid " " and resid "73 " and name "HB1 "))
2.600 0.800 0.800 peak 1461 volume 0.602E+06 ppm1 7.658 ppm2 2.128
OR
(( segid " " and resid "65 " and name "HE21"))
(( segid " " and resid "66 " and name "HG2 "))
ASSI
(( segid " " and resid "19 " and name "HN "))
(( segid " " and resid "18 " and name "HN "))
2.500 0.800 0.800 peak 1464 volume 0.600E+06 ppm1 8.209 ppm2 7.541
OR
(( segid " " and resid "33 " and name "HN "))
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ASSI
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(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
ASSI
(( segid " " and resid "57 " and name "HN "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
2.700 0.900 0.900 peak 1672 volume 0.339E+06 ppm1 8.925 ppm2 0.619
OR
(( segid " " and resid "57 " and name "HN "))
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
ASSI
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "14 " and name "HB "))
2.800 1.000 1.000 peak 1675 volume 0.337E+06 ppm1 8.859 ppm2 1.655
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "14 " and name "HB "))
ASSI
(( segid " " and resid "65 " and name "HN "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
2.800 1.000 1.000 peak 1683 volume 0.334E+06 ppm1 7.074 ppm2 0.533
OR
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "41 " and name "HG11")
OR
( segid " " and resid "41 " and name "HG13")
OR
( segid " " and resid "41 " and name "HG12"))
ASSI
(( segid " " and resid "10 " and name "HN "))
(( segid " " and resid "60 " and name "HB2 "))
2.800 1.000 1.000 peak 1695 volume 0.329E+06 ppm1 8.623 ppm2 2.613
OR
(( segid " " and resid "10 " and name "HN "))
(( segid " " and resid "10 " and name "HB1 "))
ASSI
(( segid " " and resid "19 " and name "HN "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
2.800 1.000 1.000 peak 1696 volume 0.328E+06 ppm1 8.282 ppm2 7.180
OR
(( segid " " and resid "20 " and name "HN "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
ASSI
(( segid " " and resid "39 " and name "HB1 "))
(( segid " " and resid "41 " and name "HB "))
3.100 1.200 1.200 peak 1711 volume 0.319E+06 ppm1 3.223 ppm2 1.964
OR
(( segid " " and resid "64 " and name "HA "))
(( segid " " and resid "41 " and name "HB "))
ASSI
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "72 " and name "HG "))
3.100 1.200 1.200 peak 1721 volume 0.310E+06 ppm1 4.515 ppm2 1.294
OR
(( segid " " and resid "44 " and name "HA "))
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
OR
(( segid " " and resid "46 " and name "HA "))
(( segid " " and resid "55 " and name "HG11"))
OR
(( segid " " and resid "47 " and name "HA "))
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
OR
(( segid " " and resid "14 " and name "HA "))
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
OR
(( segid " " and resid "46 " and name "HA "))
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
ASSI
(( segid " " and resid "20 " and name "HN "))
(( segid " " and resid "19 " and name "HB1 ")
OR
( segid " " and resid "19 " and name "HB2 "))
2.900 1.100 1.100 peak 1733 volume 0.303E+06 ppm1 8.255 ppm2 1.445
OR
(( segid " " and resid "19 " and name "HN "))
(( segid " " and resid "19 " and name "HB1 ")
OR
( segid " " and resid "19 " and name "HB2 "))
ASSI
(( segid " " and resid "71 " and name "HN "))
(( segid " " and resid "71 " and name "HD11")
OR
( segid " " and resid "71 " and name "HD13")
OR
( segid " " and resid "71 " and name "HD12"))
2.800 1.000 1.000 peak 1734 volume 0.303E+06 ppm1 8.295 ppm2 0.796
OR
(( segid " " and resid "20 " and name "HN "))
(( segid " " and resid "19 " and name "HG1 "))
OR
(( segid " " and resid "71 " and name "HN "))
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
OR
(( segid " " and resid "71 " and name "HN "))
(( segid " " and resid "35 " and name "HG21")
OR
( segid " " and resid "35 " and name "HG23")
OR
( segid " " and resid "35 " and name "HG22"))
ASSI
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
2.900 1.100 1.100 peak 1739 volume 0.301E+06 ppm1 1.661 ppm2 0.218
OR
(( segid " " and resid "14 " and name "HB "))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
ASSI
(( segid " " and resid "63 " and name "HA1 "))
(( segid " " and resid "67 " and name "HA "))
3.300 1.400 1.400 peak 1750 volume 0.294E+06 ppm1 4.030 ppm2 3.473
OR
(( segid " " and resid "36 " and name "HA "))
(( segid " " and resid "35 " and name "HA "))
OR
(( segid " " and resid "34 " and name "HA "))
(( segid " " and resid "35 " and name "HA "))
ASSI
(( segid " " and resid "13 " and name "HB1 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
2.900 1.100 1.100 peak 1760 volume 0.290E+06 ppm1 1.858 ppm2 0.441
OR
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
OR
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
OR
(( segid " " and resid "40 " and name "HG1 "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
ASSI
(( segid " " and resid "13 " and name "HG1 "))
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
2.900 1.100 1.100 peak 1762 volume 0.289E+06 ppm1 2.186 ppm2 0.717
OR
(( segid " " and resid "13 " and name "HG1 "))
(( segid " " and resid "12 " and name "HG11")
OR
( segid " " and resid "12 " and name "HG13")
OR
( segid " " and resid "12 " and name "HG12"))
OR
(( segid " " and resid "13 " and name "HG1 "))
(( segid " " and resid "54 " and name "HD11")
OR
( segid " " and resid "54 " and name "HD13")
OR
( segid " " and resid "54 " and name "HD12"))
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB2 "))
3.100 1.200 1.200 peak 1763 volume 0.289E+06 ppm1 4.784 ppm2 1.846
OR
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "64 " and name "HB "))
OR
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "64 " and name "HB "))
ASSI
(( segid " " and resid "70 " and name "HN "))
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
2.900 1.100 1.100 peak 1765 volume 0.289E+06 ppm1 7.704 ppm2 1.668
OR
(( segid " " and resid "35 " and name "HN "))
(( segid " " and resid "38 " and name "HB1 "))
OR
(( segid " " and resid "40 " and name "HN "))
(( segid " " and resid "38 " and name "HB1 "))
OR
(( segid " " and resid "40 " and name "HN "))
(( segid " " and resid "36 " and name "HG1 "))
OR
(( segid " " and resid "35 " and name "HN "))
(( segid " " and resid "36 " and name "HG1 "))
ASSI
(( segid " " and resid "60 " and name "HN "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
2.800 1.000 1.000 peak 1772 volume 0.285E+06 ppm1 8.157 ppm2 0.612
OR
(( segid " " and resid "60 " and name "HN "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
ASSI
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "41 " and name "HB "))
3.100 1.200 1.200 peak 1778 volume 0.282E+06 ppm1 4.870 ppm2 1.944
OR
(( segid " " and resid "57 " and name "HA "))
(( segid " " and resid "58 " and name "HB1 "))
ASSI
(( segid " " and resid "18 " and name "HN "))
(( segid " " and resid "19 " and name "HB1 ")
OR
( segid " " and resid "19 " and name "HB2 "))
2.900 1.100 1.100 peak 1783 volume 0.280E+06 ppm1 7.573 ppm2 1.445
OR
(( segid " " and resid "39 " and name "HN "))
(( segid " " and resid "38 " and name "HG2 "))
OR
(( segid " " and resid "56 " and name "HN "))
(( segid " " and resid "44 " and name "HG1 "))
ASSI
(( segid " " and resid "21 " and name "HB2 "))
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
2.900 1.100 1.100 peak 1789 volume 0.277E+06 ppm1 2.934 ppm2 1.078
OR
(( segid " " and resid "20 " and name "HB2 "))
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
ASSI
(( segid " " and resid "21 " and name "HE1 "))
(( segid " " and resid "55 " and name "HG11"))
3.000 1.100 1.100 peak 1809 volume 0.268E+06 ppm1 7.947 ppm2 1.308
OR
(( segid " " and resid "21 " and name "HE1 "))
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
OR
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "45 " and name "HG11")
OR
( segid " " and resid "45 " and name "HG12"))
OR
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "55 " and name "HG11"))
OR
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
ASSI
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
2.900 1.100 1.100 peak 1820 volume 0.263E+06 ppm1 7.986 ppm2 0.763
OR
(( segid " " and resid "21 " and name "HE1 "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
ASSI
(( segid " " and resid "23 " and name "HB2 "))
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
3.000 1.100 1.100 peak 1829 volume 0.260E+06 ppm1 3.059 ppm2 0.671
OR
(( segid " " and resid "23 " and name "HB2 "))
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
ASSI
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
2.900 1.100 1.100 peak 1835 volume 0.259E+06 ppm1 8.826 ppm2 0.231
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "55 " and name "HD11")
OR
( segid " " and resid "55 " and name "HD13")
OR
( segid " " and resid "55 " and name "HD12"))
ASSI
(( segid " " and resid "59 " and name "HA1 "))
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
3.200 1.300 1.300 peak 1838 volume 0.258E+06 ppm1 4.456 ppm2 2.141
OR
(( segid " " and resid "52 " and name "HA "))
(( segid " " and resid "51 " and name "HB2 "))
ASSI
(( segid " " and resid "72 " and name "HN "))
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
2.900 1.100 1.100 peak 1839 volume 0.258E+06 ppm1 7.835 ppm2 0.625
OR
(( segid " " and resid "11 " and name "HN "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
OR
(( segid " " and resid "11 " and name "HN "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
OR
(( segid " " and resid "72 " and name "HN "))
(( segid " " and resid "72 " and name "HD21")
OR
( segid " " and resid "72 " and name "HD23")
OR
( segid " " and resid "72 " and name "HD22"))
ASSI
(( segid " " and resid "64 " and name "HN "))
(( segid " " and resid "59 " and name "HN "))
2.900 1.100 1.100 peak 1862 volume 0.247E+06 ppm1 8.629 ppm2 8.341
OR
(( segid " " and resid "10 " and name "HN "))
(( segid " " and resid "59 " and name "HN "))
ASSI
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "9 " and name "HG1 ")
OR
( segid " " and resid "9 " and name "HG2 "))
3.200 1.300 1.300 peak 1869 volume 0.245E+06 ppm1 4.771 ppm2 1.905
OR
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "9 " and name "HG1 ")
OR
( segid " " and resid "9 " and name "HG2 "))
ASSI
(( segid " " and resid "13 " and name "HG2 "))
(( segid " " and resid "56 " and name "HG1 "))
3.100 1.200 1.200 peak 1873 volume 0.243E+06 ppm1 1.963 ppm2 1.458
OR
(( segid " " and resid "58 " and name "HB1 "))
(( segid " " and resid "44 " and name "HG1 "))
OR
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "44 " and name "HG1 "))
OR
(( segid " " and resid "58 " and name "HB1 "))
(( segid " " and resid "56 " and name "HG1 "))
ASSI
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "13 " and name "HB2 "))
3.000 1.100 1.100 peak 1875 volume 0.243E+06 ppm1 8.839 ppm2 1.734
OR
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "13 " and name "HB2 "))
ASSI
(( segid " " and resid "31 " and name "HD22"))
(( segid " " and resid "35 " and name "HD11")
OR
( segid " " and resid "35 " and name "HD13")
OR
( segid " " and resid "35 " and name "HD12"))
3.000 1.100 1.100 peak 1882 volume 0.241E+06 ppm1 7.055 ppm2 0.665
OR
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "43 " and name "HG11")
OR
( segid " " and resid "43 " and name "HG13")
OR
( segid " " and resid "43 " and name "HG12"))
OR
(( segid " " and resid "39 " and name "HD1 ")
OR
( segid " " and resid "39 " and name "HD2 "))
(( segid " " and resid "35 " and name "HD11")
OR
( segid " " and resid "35 " and name "HD13")
OR
( segid " " and resid "35 " and name "HD12"))
ASSI
(( segid " " and resid "61 " and name "HA "))
(( segid " " and resid "60 " and name "HB2 "))
3.200 1.300 1.300 peak 1887 volume 0.240E+06 ppm1 4.443 ppm2 2.607
OR
(( segid " " and resid "48 " and name "HA "))
(( segid " " and resid "48 " and name "HB1 "))
ASSI
(( segid " " and resid "31 " and name "HB1 "))
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
3.100 1.200 1.200 peak 1899 volume 0.235E+06 ppm1 2.836 ppm2 1.813
OR
(( segid " " and resid "31 " and name "HB1 "))
(( segid " " and resid "25 " and name "HB "))
ASSI
(( segid " " and resid "66 " and name "HE22"))
(( segid " " and resid "62 " and name "HG2 "))
3.000 1.100 1.100 peak 1902 volume 0.234E+06 ppm1 6.753 ppm2 1.859
OR
(( segid " " and resid "15 " and name "HD22"))
(( segid " " and resid "13 " and name "HB1 "))
OR
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
(( segid " " and resid "13 " and name "HB1 "))
OR
(( segid " " and resid "11 " and name "HD1 ")
OR
( segid " " and resid "11 " and name "HD2 "))
(( segid " " and resid "58 " and name "HB2 "))
OR
(( segid " " and resid "33 " and name "HD22"))
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
ASSI
(( segid " " and resid "23 " and name "HB1 "))
(( segid " " and resid "22 " and name "HB1 "))
3.100 1.200 1.200 peak 1903 volume 0.234E+06 ppm1 3.131 ppm2 1.714
OR
(( segid " " and resid "21 " and name "HB1 "))
(( segid " " and resid "22 " and name "HB1 "))
OR
(( segid " " and resid "21 " and name "HB1 "))
(( segid " " and resid "45 " and name "HB "))
ASSI
(( segid " " and resid "43 " and name "HA "))
(( segid " " and resid "44 " and name "HD1 ")
OR
( segid " " and resid "44 " and name "HD2 "))
3.200 1.300 1.300 peak 1917 volume 0.230E+06 ppm1 4.561 ppm2 2.981
OR
(( segid " " and resid "42 " and name "HA "))
(( segid " " and resid "44 " and name "HD1 ")
OR
( segid " " and resid "44 " and name "HD2 "))
ASSI
(( segid " " and resid "15 " and name "HN "))
(( segid " " and resid "54 " and name "HD21")
OR
( segid " " and resid "54 " and name "HD23")
OR
( segid " " and resid "54 " and name "HD22"))
2.900 1.100 1.100 peak 1921 volume 0.229E+06 ppm1 8.485 ppm2 0.638
OR
(( segid " " and resid "15 " and name "HN "))
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
OR
(( segid " " and resid "58 " and name "HN "))
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
OR
(( segid " " and resid "45 " and name "HN "))
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
OR
(( segid " " and resid "58 " and name "HN "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
ASSI
(( segid " " and resid "37 " and name "HN "))
(( segid " " and resid "33 " and name "HA "))
3.200 1.300 1.300 peak 1928 volume 0.226E+06 ppm1 7.744 ppm2 4.339
OR
(( segid " " and resid "40 " and name "HN "))
(( segid " " and resid "37 " and name "HA "))
OR
(( segid " " and resid "37 " and name "HN "))
(( segid " " and resid "37 " and name "HA "))
ASSI
(( segid " " and resid "58 " and name "HN "))
(( segid " " and resid "43 " and name "HA "))
3.200 1.300 1.300 peak 1932 volume 0.226E+06 ppm1 8.452 ppm2 4.582
OR
(( segid " " and resid "58 " and name "HN "))
(( segid " " and resid "42 " and name "HA "))
ASSI
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
2.900 1.100 1.100 peak 1937 volume 0.225E+06 ppm1 8.833 ppm2 0.455
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
ASSI
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB2 "))
3.100 1.200 1.200 peak 1943 volume 0.225E+06 ppm1 7.173 ppm2 3.027
OR
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
(( segid " " and resid "18 " and name "HB1 ")
OR
( segid " " and resid "18 " and name "HB2 "))
OR
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
(( segid " " and resid "23 " and name "HB2 "))
ASSI
(( segid " " and resid "20 " and name "HB1 "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
3.000 1.100 1.100 peak 1945 volume 0.224E+06 ppm1 3.328 ppm2 0.789
OR
(( segid " " and resid "20 " and name "HB1 "))
(( segid " " and resid "71 " and name "HD11")
OR
( segid " " and resid "71 " and name "HD13")
OR
( segid " " and resid "71 " and name "HD12"))
ASSI
(( segid " " and resid "31 " and name "HD21"))
(( segid " " and resid "24 " and name "HA "))
2.600 0.800 0.800 peak 1979 volume 0.757E+06 ppm1 7.586 ppm2 3.873
OR
(( segid " " and resid "26 " and name "HN "))
(( segid " " and resid "24 " and name "HA "))
ASSI
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
2.600 0.800 0.800 peak 1988 volume 0.577E+06 ppm1 2.153 ppm2 0.612
OR
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
OR
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
ASSI
(( segid " " and resid "45 " and name "HB "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
2.600 0.800 0.800 peak 1990 volume 0.566E+06 ppm1 1.668 ppm2 0.448
OR
(( segid " " and resid "44 " and name "HB1 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
OR
(( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
OR
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
OR
(( segid " " and resid "14 " and name "HB "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
OR
(( segid " " and resid "36 " and name "HG1 "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
ASSI
(( segid " " and resid "71 " and name "HB1 ")
OR
( segid " " and resid "71 " and name "HB2 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
2.700 0.900 0.900 peak 2000 volume 0.412E+06 ppm1 1.628 ppm2 0.448
OR
(( segid " " and resid "14 " and name "HB "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
OR
(( segid " " and resid "56 " and name "HB1 ")
OR
( segid " " and resid "56 " and name "HB2 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
OR
(( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
ASSI
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
2.800 1.000 1.000 peak 2004 volume 0.379E+06 ppm1 6.589 ppm2 1.052
OR
(( segid " " and resid "39 " and name "HE1 ")
OR
( segid " " and resid "39 " and name "HE2 "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
ASSI
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
2.800 1.000 1.000 peak 2006 volume 0.361E+06 ppm1 1.956 ppm2 1.058
OR
(( segid " " and resid "70 " and name "HB2 "))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
OR
(( segid " " and resid "70 " and name "HB2 "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
OR
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
OR
(( segid " " and resid "65 " and name "HB1 "))
(( segid " " and resid "68 " and name "HB2 "))
OR
(( segid " " and resid "41 " and name "HB "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
ASSI
(( segid " " and resid "29 " and name "HA1 "))
(( segid " " and resid "32 " and name "HD11")
OR
( segid " " and resid "32 " and name "HD13")
OR
( segid " " and resid "32 " and name "HD12"))
3.000 1.100 1.100 peak 2010 volume 0.311E+06 ppm1 3.938 ppm2 0.619
OR
(( segid " " and resid "59 " and name "HA2 "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
OR
(( segid " " and resid "61 " and name "HD1 "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
ASSI
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
3.000 1.100 1.100 peak 2017 volume 0.249E+06 ppm1 1.917 ppm2 1.058
OR
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
OR
(( segid " " and resid "70 " and name "HB2 "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
OR
(( segid " " and resid "70 " and name "HB2 "))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
OR
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
OR
(( segid " " and resid "41 " and name "HB "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
OR
(( segid " " and resid "65 " and name "HB1 "))
(( segid " " and resid "68 " and name "HB2 "))
OR
(( segid " " and resid "32 " and name "HB "))
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
ASSI
(( segid " " and resid "32 " and name "HN "))
(( segid " " and resid "25 " and name "HG21")
OR
( segid " " and resid "25 " and name "HG23")
OR
( segid " " and resid "25 " and name "HG22"))
3.000 1.100 1.100 peak 2020 volume 0.238E+06 ppm1 7.665 ppm2 1.071
OR
(( segid " " and resid "73 " and name "HN "))
(( segid " " and resid "75 " and name "HB1 ")
OR
( segid " " and resid "75 " and name "HB3 ")
OR
( segid " " and resid "75 " and name "HB2 "))
OR
(( segid " " and resid "35 " and name "HN "))
(( segid " " and resid "35 " and name "HG11")
OR
( segid " " and resid "35 " and name "HG12"))
OR
(( segid " " and resid "70 " and name "HN "))
(( segid " " and resid "67 " and name "HB1 ")
OR
( segid " " and resid "67 " and name "HB3 ")
OR
( segid " " and resid "67 " and name "HB2 "))
ASSI
(( segid " " and resid "31 " and name "HD21"))
(( segid " " and resid "24 " and name "HG "))
3.000 1.100 1.100 peak 2022 volume 0.221E+06 ppm1 7.566 ppm2 1.347
OR
(( segid " " and resid "26 " and name "HN "))
(( segid " " and resid "24 " and name "HG "))
OR
(( segid " " and resid "56 " and name "HN "))
(( segid " " and resid "56 " and name "HG2 "))
ASSI
(( segid " " and resid "43 " and name "HB "))
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
2.300 0.700 0.700 peak 2026 volume 0.129E+07 ppm1 1.714 ppm2 0.868
OR
(( segid " " and resid "45 " and name "HB "))
(( segid " " and resid "32 " and name "HG21")
OR
( segid " " and resid "32 " and name "HG23")
OR
( segid " " and resid "32 " and name "HG22"))
ASSI
(( segid " " and resid "68 " and name "HE2 "))
(( segid " " and resid "68 " and name "HG2 "))
2.600 0.800 0.800 peak 2031 volume 0.592E+06 ppm1 2.783 ppm2 1.130
OR
(( segid " " and resid "68 " and name "HE1 "))
(( segid " " and resid "68 " and name "HG2 "))
ASSI
(( segid " " and resid "38 " and name "HN "))
(( segid " " and resid "38 " and name "HB1 "))
2.400 0.700 0.700 peak 2049 volume 0.969E+06 ppm1 8.524 ppm2 1.675
OR
(( segid " " and resid "45 " and name "HN "))
(( segid " " and resid "44 " and name "HB1 "))
ASSI
(( segid " " and resid "55 " and name "HN "))
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
2.700 0.900 0.900 peak 2053 volume 0.344E+06 ppm1 8.859 ppm2 0.625
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "57 " and name "HD11")
OR
( segid " " and resid "57 " and name "HD13")
OR
( segid " " and resid "57 " and name "HD12"))
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "72 " and name "HD21")
OR
( segid " " and resid "72 " and name "HD23")
OR
( segid " " and resid "72 " and name "HD22"))
OR
(( segid " " and resid "14 " and name "HN "))
(( segid " " and resid "14 " and name "HD11")
OR
( segid " " and resid "14 " and name "HD13")
OR
( segid " " and resid "14 " and name "HD12"))
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
3.100 1.200 1.200 peak 2066 volume 0.244E+06 ppm1 4.798 ppm2 0.612
OR
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
OR
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
OR
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
ASSI
(( segid " " and resid "69 " and name "HA "))
(( segid " " and resid "69 " and name "HG2 "))
3.000 1.100 1.100 peak 2073 volume 0.386E+06 ppm1 3.748 ppm2 1.439
OR
(( segid " " and resid "38 " and name "HA "))
(( segid " " and resid "38 " and name "HG2 "))
ASSI
(( segid " " and resid "63 " and name "HA2 "))
(( segid " " and resid "64 " and name "HA "))
2.600 0.800 0.800 peak 2083 volume 0.875E+06 ppm1 3.741 ppm2 3.230
OR
(( segid " " and resid "63 " and name "HA2 "))
(( segid " " and resid "39 " and name "HB1 "))
ASSI
(( segid " " and resid "69 " and name "HA "))
(( segid " " and resid "14 " and name "HG21")
OR
( segid " " and resid "14 " and name "HG23")
OR
( segid " " and resid "14 " and name "HG22"))
2.800 1.000 1.000 peak 2085 volume 0.479E+06 ppm1 3.774 ppm2 0.737
OR
(( segid " " and resid "69 " and name "HA "))
(( segid " " and resid "72 " and name "HD11")
OR
( segid " " and resid "72 " and name "HD13")
OR
( segid " " and resid "72 " and name "HD12"))
OR
(( segid " " and resid "65 " and name "HA "))
(( segid " " and resid "57 " and name "HG21")
OR
( segid " " and resid "57 " and name "HG23")
OR
( segid " " and resid "57 " and name "HG22"))
ASSI
(( segid " " and resid "13 " and name "HB2 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
3.000 1.100 1.100 peak 2095 volume 0.251E+06 ppm1 1.760 ppm2 0.455
OR
(( segid " " and resid "35 " and name "HB "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
ASSI
(( segid " " and resid "13 " and name "HB2 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
3.000 1.100 1.100 peak 2096 volume 0.245E+06 ppm1 1.773 ppm2 0.455
OR
(( segid " " and resid "35 " and name "HB "))
(( segid " " and resid "41 " and name "HG21")
OR
( segid " " and resid "41 " and name "HG23")
OR
( segid " " and resid "41 " and name "HG22"))
OR
(( segid " " and resid "24 " and name "HB1 ")
OR
( segid " " and resid "24 " and name "HB2 "))
(( segid " " and resid "55 " and name "HG21")
OR
( segid " " and resid "55 " and name "HG23")
OR
( segid " " and resid "55 " and name "HG22"))
ASSI
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "11 " and name "HE1 ")
OR
( segid " " and resid "11 " and name "HE2 "))
4.500 2.700 1.500 peak 28 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "11 " and name "HE1 ")
OR
( segid " " and resid "11 " and name "HE2 "))
ASSI
(( segid " " and resid "19 " and name "HG1 "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
5.000 3.200 1.000 peak 30 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "19 " and name "HG2 "))
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
OR
(( segid " " and resid "19 " and name "HG1 "))
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
OR
(( segid " " and resid "19 " and name "HG2 "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
ASSI
(( segid " " and resid "16 " and name "HB "))
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
5.200 3.400 0.800 peak 31 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "16 " and name "HB "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
ASSI
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
4.200 2.400 1.800 peak 33 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "16 " and name "HG11")
OR
( segid " " and resid "16 " and name "HG12"))
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
ASSI
(( segid " " and resid "17 " and name "HN "))
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
4.700 2.900 1.300 peak 37 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "17 " and name "HN "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
ASSI
(( segid " " and resid "17 " and name "HB1 ")
OR
( segid " " and resid "17 " and name "HB2 "))
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
4.200 2.400 1.800 peak 38 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "17 " and name "HB1 ")
OR
( segid " " and resid "17 " and name "HB2 "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "11 " and name "HN "))
3.400 1.600 1.400 peak 190 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "11 " and name "HN "))
ASSI
(( segid " " and resid "38 " and name "HB1 "))
(( segid " " and resid "38 " and name "HN "))
3.100 1.300 1.200 peak 220 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "38 " and name "HB2 "))
(( segid " " and resid "38 " and name "HN "))
ASSI
(( segid " " and resid "44 " and name "HB1 "))
(( segid " " and resid "44 " and name "HN "))
3.000 1.200 1.100 peak 227 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "44 " and name "HB2 "))
(( segid " " and resid "44 " and name "HN "))
ASSI
(( segid " " and resid "22 " and name "HB2 "))
(( segid " " and resid "23 " and name "HN "))
4.000 2.200 2.000 peak 252 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "22 " and name "HB1 "))
(( segid " " and resid "23 " and name "HN "))
ASSI
(( segid " " and resid "36 " and name "HG2 "))
(( segid " " and resid "36 " and name "HN "))
3.400 1.600 1.400 peak 293 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "36 " and name "HG1 "))
(( segid " " and resid "36 " and name "HN "))
ASSI
(( segid " " and resid "55 " and name "HG11"))
(( segid " " and resid "55 " and name "HN "))
3.000 1.200 1.100 peak 306 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "55 " and name "HG12"))
(( segid " " and resid "55 " and name "HN "))
ASSI
(( segid " " and resid "56 " and name "HG2 "))
(( segid " " and resid "56 " and name "HN "))
3.800 2.000 1.800 peak 309 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "56 " and name "HG1 "))
(( segid " " and resid "56 " and name "HN "))
ASSI
(( segid " " and resid "40 " and name "HG1 "))
(( segid " " and resid "40 " and name "HA "))
3.500 1.700 1.500 peak 369 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "40 " and name "HG2 "))
(( segid " " and resid "40 " and name "HA "))
ASSI
(( segid " " and resid "61 " and name "HD1 "))
(( segid " " and resid "60 " and name "HN "))
4.400 2.600 1.600 peak 439 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "61 " and name "HD2 "))
(( segid " " and resid "60 " and name "HN "))
ASSI
(( segid " " and resid "65 " and name "HG1 "))
(( segid " " and resid "66 " and name "HN "))
4.100 2.300 1.900 peak 443 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "65 " and name "HG2 "))
(( segid " " and resid "66 " and name "HN "))
ASSI
(( segid " " and resid "74 " and name "HD11")
OR
( segid " " and resid "74 " and name "HD13")
OR
( segid " " and resid "74 " and name "HD12"))
(( segid " " and resid "75 " and name "HN "))
5.000 3.200 1.000 peak 444 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "74 " and name "HD21")
OR
( segid " " and resid "74 " and name "HD23")
OR
( segid " " and resid "74 " and name "HD22"))
(( segid " " and resid "75 " and name "HN "))
ASSI
(( segid " " and resid "73 " and name "HB2 "))
(( segid " " and resid "73 " and name "HN "))
4.200 2.400 1.800 peak 504 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "73 " and name "HB1 "))
(( segid " " and resid "73 " and name "HN "))
ASSI
(( segid " " and resid "65 " and name "HB2 "))
(( segid " " and resid "66 " and name "HN "))
4.200 2.400 1.800 peak 510 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "65 " and name "HB1 "))
(( segid " " and resid "66 " and name "HN "))
ASSI
(( segid " " and resid "62 " and name "HG1 "))
(( segid " " and resid "62 " and name "HN "))
3.700 1.900 1.700 peak 518 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "62 " and name "HG2 "))
(( segid " " and resid "62 " and name "HN "))
ASSI
(( segid " " and resid "19 " and name "HG2 "))
(( segid " " and resid "20 " and name "HN "))
6.000 6.000 0.300 peak 1 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "19 " and name "HG1 "))
(( segid " " and resid "20 " and name "HN "))
OR
(( segid " " and resid "19 " and name "HB1 ")
OR
( segid " " and resid "19 " and name "HB2 "))
(( segid " " and resid "20 " and name "HN "))
ASSI
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
(( segid " " and resid "23 " and name "HD2 "))
6.000 6.000 0.300 peak 21 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
(( segid " " and resid "23 " and name "HD2 "))
ASSI
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
4.400 4.400 0.300 peak 24 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
ASSI
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
4.400 4.400 0.300 peak 25 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
ASSI
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
(( segid " " and resid "75 " and name "HA "))
5.000 5.000 0.300 peak 26 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
(( segid " " and resid "75 " and name "HA "))
ASSI
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
7.000 7.000 0.300 peak 29 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "21 " and name "HD2 "))
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
ASSI
(( segid " " and resid "23 " and name "HB2 "))
(( segid " " and resid "20 " and name "HE1 ")
OR
( segid " " and resid "20 " and name "HE2 "))
5.000 5.000 0.300 peak 34 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "23 " and name "HB2 "))
(( segid " " and resid "20 " and name "HD1 ")
OR
( segid " " and resid "20 " and name "HD2 "))
ASSI
(( segid " " and resid "11 " and name "HB2 "))
(( segid " " and resid "59 " and name "HN "))
5.000 5.000 0.300 peak 48 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "11 " and name "HB1 "))
(( segid " " and resid "59 " and name "HN "))
ASSI
(( segid " " and resid "69 " and name "HN "))
(( segid " " and resid "71 " and name "HD21")
OR
( segid " " and resid "71 " and name "HD23")
OR
( segid " " and resid "71 " and name "HD22"))
5.000 5.000 0.300 peak 51 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "69 " and name "HN "))
(( segid " " and resid "71 " and name "HD11")
OR
( segid " " and resid "71 " and name "HD13")
OR
( segid " " and resid "71 " and name "HD12"))
ASSI
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "68 " and name "HB1 "))
3.000 3.000 0.300 peak 52 volume 0.000E+00 ppm1 -9999.000 ppm2 -9999.000
OR
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
(( segid " " and resid "68 " and name "HB2 "))
ASSI
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
2.700 0.900 0.900 peak 1565 volume 0.439E+06 ppm1 7.993 ppm2 0.527
OR
(( segid " " and resid "21 " and name "HE1 "))
(( segid " " and resid "45 " and name "HG21")
OR
( segid " " and resid "45 " and name "HG23")
OR
( segid " " and resid "45 " and name "HG22"))
ASSI
(( segid " " and resid "21 " and name "HN "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
3.000 1.100 1.100 peak 1820 volume 0.263E+06 ppm1 7.986 ppm2 0.763
OR
(( segid " " and resid "21 " and name "HE1 "))
(( segid " " and resid "45 " and name "HD11")
OR
( segid " " and resid "45 " and name "HD13")
OR
( segid " " and resid "45 " and name "HD12"))
ASSI
(( segid " " and resid "36 " and name "HB1 ")
OR
( segid " " and resid "36 " and name "HB2 "))
(( segid " " and resid "37 " and name "HB1 "))
3.000 1.100 1.100 peak 755 volume 0.267E+06 ppm1 1.858 ppm2 2.620
OR
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB2 "))
(( segid " " and resid "60 " and name "HB2 "))
OR
(( segid " " and resid "64 " and name "HB "))
(( segid " " and resid "10 " and name "HB1 "))
ASSI
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "12 " and name "HG21")
OR
( segid " " and resid "12 " and name "HG23")
OR
( segid " " and resid "12 " and name "HG22"))
2.500 0.800 0.800 peak 1440 volume 0.653E+06 ppm1 5.336 ppm2 0.619
OR
(( segid " " and resid "58 " and name "HA "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
ASSI
(( segid " " and resid "10 " and name "HB1 "))
(( segid " " and resid "64 " and name "HB "))
2.800 1.000 1.000 peak 1660 volume 0.348E+06 ppm1 2.613 ppm2 1.852
OR
(( segid " " and resid "60 " and name "HB2 "))
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB2 "))
OR
(( segid " " and resid "60 " and name "HB2 "))
(( segid " " and resid "64 " and name "HB "))
ASSI
(( segid " " and resid "59 " and name "HA1 "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
2.900 1.100 1.100 peak 1759 volume 0.291E+06 ppm1 4.463 ppm2 0.612
OR
(( segid " " and resid "59 " and name "HA1 "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "61 " and name "HB1 ")
OR
( segid " " and resid "61 " and name "HB2 "))
3.000 1.100 1.100 peak 1763 volume 0.289E+06 ppm1 4.784 ppm2 1.846
OR
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "64 " and name "HB "))
ASSI
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
2.600 0.800 0.800 peak 1988 volume 0.577E+06 ppm1 2.153 ppm2 0.612
OR
(( segid " " and resid "58 " and name "HG1 ")
OR
( segid " " and resid "58 " and name "HG2 "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
ASSI
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
3.000 1.100 1.100 peak 2066 volume 0.244E+06 ppm1 4.798 ppm2 0.612
OR
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
OR
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "64 " and name "HG21")
OR
( segid " " and resid "64 " and name "HG23")
OR
( segid " " and resid "64 " and name "HG22"))
ASSI
(( segid " " and resid "10 " and name "HA "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
3.000 1.100 1.100 peak 2067 volume 0.234E+06 ppm1 4.771 ppm2 0.599
OR
(( segid " " and resid "60 " and name "HA "))
(( segid " " and resid "64 " and name "HG11")
OR
( segid " " and resid "64 " and name "HG13")
OR
( segid " " and resid "64 " and name "HG12"))
ASSI
(( segid " " and resid "24 " and name "HD11")
OR
( segid " " and resid "24 " and name "HD13")
OR
( segid " " and resid "24 " and name "HD12"))
(( segid " " and resid "75 " and name "HA "))
2.800 1.000 1.000 peak 898 volume 0.374E+06 ppm1 0.684 ppm2 3.985
OR
(( segid " " and resid "24 " and name "HD21")
OR
( segid " " and resid "24 " and name "HD23")
OR
( segid " " and resid "24 " and name "HD22"))
(( segid " " and resid "75 " and name "HA "))
Contact the webmaster for help, if required. Sunday, May 12, 2024 1:57:38 AM GMT (wattos1)