Mercurial > repos > marcel > caddsuite_mac10_6
comparison CADDSuite-1.5/data/fragments/ASN.db @ 7:bfab27640f5e draft
CADDSuite version 1.5
| author | Marcel Schumann <schumann.marcel@gmail.com> |
|---|---|
| date | Tue, 24 Jul 2012 11:13:59 -0400 |
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| children |
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| 6:decca54699e3 | 7:bfab27640f5e |
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| 1 <node>ASN | |
| 2 <node>Names | |
| 3 <node>Asparagine</node> | |
| 4 <node>Asparagin</node> | |
| 5 <node>Asn</node> | |
| 6 <node>N</node> | |
| 7 </node> | |
| 8 <node>Atoms | |
| 9 <node>N<value>N -0.01239826 1.297873 -0.0455736</value></node> | |
| 10 <node>3H<value>H 0.8807231 1.768826 0.03701005</value></node> | |
| 11 <node>CA<value>C -0.7474616 1.91653 -1.164926</value></node> | |
| 12 <node>HA<value>H -0.1937652 1.691628 -2.077897</value></node> | |
| 13 <node>C<value>C -0.757567 3.441771 -1.010304</value></node> | |
| 14 <node>O<value>O 0.3769885 3.962902 -0.9276295</value></node> | |
| 15 <node>CB<value>C -2.149851 1.302218 -1.30196</value></node> | |
| 16 <node>1HB<value>H -2.042859 0.2235991 -1.423685</value></node> | |
| 17 <node>2HB<value>H -2.723301 1.490943 -0.3934487</value></node> | |
| 18 <node>CG<value>C -2.91901 1.84635 -2.50453</value></node> | |
| 19 <node>OD1<value>O -2.442698 2.721974 -3.218464</value></node> | |
| 20 <node>ND2<value>N -4.125435 1.339006 -2.736042</value></node> | |
| 21 <node>1HD2<value>H -4.50376 0.6180301 -2.140929</value></node> | |
| 22 <node>2HD2<value>H -4.647904 1.686222 -3.525954</value></node> | |
| 23 <node>1H<value>H -0.5352049 1.417775 0.8102037</value></node> | |
| 24 <node>2H<value>H 0.1272759 0.3139404 -0.2256562</value></node> | |
| 25 <node>OXT<value>O -1.806735 3.963976 -0.572751</value></node> | |
| 26 </node> | |
| 27 <node>Bonds | |
| 28 <node>5<value>3H N s</value></node> | |
| 29 <node>6<value>CA N s</value></node> | |
| 30 <node>10<value>HA CA s</value></node> | |
| 31 <node>11<value>C CA s</value></node> | |
| 32 <node>14<value>O C d</value></node> | |
| 33 <node>15<value>CB CA s</value></node> | |
| 34 <node>19<value>1HB CB s</value></node> | |
| 35 <node>20<value>2HB CB s</value></node> | |
| 36 <node>21<value>CG CB s</value></node> | |
| 37 <node>24<value>OD1 CG d</value></node> | |
| 38 <node>25<value>ND2 CG s</value></node> | |
| 39 <node>28<value>1HD2 ND2 s</value></node> | |
| 40 <node>29<value>2HD2 ND2 s</value></node> | |
| 41 <node>30<value>1H N s</value></node> | |
| 42 <node>31<value>2H N s</value></node> | |
| 43 <node>32<value>OXT C s</value></node> | |
| 44 </node> | |
| 45 <node>Connections | |
| 46 <node>N-term<value>N C-term s 1.33 0.5</value></node> | |
| 47 <node>C-term<value>C N-term s 1.33 0.5</value></node> | |
| 48 </node> | |
| 49 <node>Properties | |
| 50 <node>AMINO_ACID</node> | |
| 51 </node> | |
| 52 <node>Variants | |
| 53 <node>Default | |
| 54 <node>Delete | |
| 55 <node>OXT</node> | |
| 56 <node>1H</node> | |
| 57 <node>2H</node> | |
| 58 </node> | |
| 59 <node>Rename | |
| 60 <node>3H<value>H</value></node> | |
| 61 </node> | |
| 62 </node> | |
| 63 <node>ASN-M | |
| 64 <node>Properties | |
| 65 <node>C_TERMINAL</node> | |
| 66 <node>N_TERMINAL</node> | |
| 67 </node> | |
| 68 </node> | |
| 69 <node>ASN-C | |
| 70 <node>Delete | |
| 71 <node>1H</node> | |
| 72 <node>2H</node> | |
| 73 </node> | |
| 74 <node>Rename | |
| 75 <node>3H<value>H</value></node> | |
| 76 </node> | |
| 77 <node>Properties | |
| 78 <node>C_TERMINAL</node> | |
| 79 </node> | |
| 80 </node> | |
| 81 <node>ASN-N | |
| 82 <node>Delete | |
| 83 <node>OXT</node> | |
| 84 </node> | |
| 85 <node>Properties | |
| 86 <node>N_TERMINAL</node> | |
| 87 </node> | |
| 88 </node> | |
| 89 </node> | |
| 90 </node> |