NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
16490 |
2a7y   |
7000 | cing | 1-original | 3 | XPLOR/CNS | distance | NOE | simple |
!remarks Ni-Ni+1 ! strong 1.2 (3.0 A), medium, 1.7 (3.5 A), weak 3.2 (5.0 A) ! typically 2.8 Ang. in helix, 4.3 Ang. in beta strand assign (resid 2 and name HN )(resid 3 and name HN ) 1.8 0.0 3.2 assign (resid 3 and name HN )(resid 4 and name HN ) 1.8 0.0 3.2 assign (resid 4 and name HN )(resid 5 and name HN ) 1.8 0.0 3.7 assign (resid 4 and name HN )(resid 7 and name HN ) 1.8 0.0 3.7 assign (resid 5 and name HN )(resid 6 and name HN ) 1.8 0.0 3.2 assign (resid 6 and name HN )(resid 7 and name HN ) 1.8 0.0 3.2 assign (resid 7 and name HN )(resid 8 and name HN ) 1.8 0.0 3.2 assign (resid 7 and name HN )(resid 25 and name HN ) 1.8 0.0 3.2 !B assign (resid 8 and name HN )(resid 59 and name HN ) 1.8 0.0 3.2 !B assign (resid 9 and name HN )(resid 10 and name HN ) 1.8 0.0 3.7 assign (resid 9 and name HN )(resid 23 and name HN ) 1.8 0.0 3.2 !B assign (resid 11 and name HN )(resid 21 and name HN ) 1.8 0.0 3.2 !B assign (resid 10 and name HN )(resid 57 and name HN ) 1.8 0.0 3.2 !B assign (resid 24 and name HN )(resid 40 and name HN ) 1.8 0.0 3.2 !B assign (resid 26 and name HN )(resid 27 and name HN ) 1.8 0.0 3.2 assign (resid 28 and name HN )(resid 29 and name HN ) 1.8 0.0 3.7 assign (resid 27 and name HN )(resid 38 and name HN ) 1.8 0.0 3.2 !B assign (resid 28 and name HN )(resid 29 and name HN ) 1.8 0.0 3.7 assign (resid 29 and name HN )(resid 30 and name HN ) 1.8 0.0 2.7 assign (resid 32 and name HN )(resid 33 and name HN ) 1.8 0.0 2.7 assign (resid 33 and name HN )(resid 34 and name HN ) 1.8 0.0 3.2 assign (resid 37 and name HN )(resid 38 and name HN ) 1.8 0.0 3.7 assign (resid 37 and name HN )(resid 50 and name HN ) 1.8 0.0 3.2 !9 assign (resid 38 and name HN )(resid 39 and name HN ) 1.8 0.0 3.7 assign (resid 39 and name HN )(resid 48 and name HN ) 1.8 0.0 2.7 !B assign (resid 39 and name HN )(resid 40 and name HN ) 1.8 0.0 3.7 assign (resid 43 and name HN )(resid 44 and name HN ) 1.8 0.0 2.7 !4 assign (resid 44 and name HN )(resid 45 and name HN ) 1.8 0.0 2.7 !4 assign (resid 44 and name HN )(resid 44 and name HD21 ) 1.8 0.0 4.2 assign (resid 44 and name HN )(resid 44 and name HD22 ) 1.8 0.0 4.2 assign (resid 45 and name HN )(resid 46 and name HN ) 1.8 0.0 2.7 assign (resid 45 and name HN )(resid 41 and name HN ) 1.8 0.0 3.7 !B assign (resid 46 and name HN )(resid 47 and name HN ) 1.8 0.0 3.2 assign (resid 46 and name HN )(resid 41 and name HN ) 1.8 0.0 3.2 !B assign (resid 47 and name HN )(resid 48 and name HN ) 1.8 0.0 3.2 assign (resid 48 and name HN )(resid 49 and name HN ) 1.8 0.0 3.2 assign (resid 54 and name HN )(resid 55 and name HN ) 1.8 0.0 3.2 assign (resid 55 and name HN )(resid 56 and name HN ) 1.8 0.0 1.7 assign (resid 56 and name HN )(resid 57 and name HN ) 1.8 0.0 3.2 assign (resid 57 and name HN )(resid 58 and name HN ) 1.8 0.0 3.7 assign (resid 58 and name HN )(resid 59 and name HN ) 1.8 0.0 3.2 assign (resid 59 and name HN )(resid 60 and name HN ) 1.8 0.0 3.2 assign (resid 60 and name HN )(resid 61 and name HN ) 1.8 0.0 3.2 assign (resid 61 and name HN )(resid 62 and name HN ) 1.8 0.0 3.2 assign (resid 62 and name HN )(resid 63 and name HN ) 1.8 0.0 1.2 !A assign (resid 63 and name HN )(resid 64 and name HN ) 1.8 0.0 1.2 !A assign (resid 63 and name HN )(resid 65 and name HN ) 1.8 0.0 3.2 assign (resid 64 and name HN )(resid 65 and name HN ) 1.8 0.0 1.2 !A assign (resid 65 and name HN )(resid 66 and name HN ) 1.8 0.0 1.2 !A assign (resid 66 and name HN )(resid 67 and name HN ) 1.8 0.0 1.2 !A assign (resid 67 and name HN )(resid 68 and name HN ) 1.8 0.0 1.2 !A assign (resid 67 and name HN )(resid 69 and name HN ) 1.8 0.0 3.2 assign (resid 68 and name HN )(resid 69 and name HN ) 1.8 0.0 1.7 !A weaker assign (resid 69 and name HN )(resid 70 and name HN ) 1.8 0.0 1.7 !A weaker assign (resid 70 and name HN )(resid 71 and name HN ) 1.8 0.0 1.7 !A weaker assign (resid 70 and name HN )(resid 72 and name HN ) 1.8 0.0 3.2 assign (resid 71 and name HN )(resid 72 and name HN ) 1.8 0.0 1.2 !A assign (resid 72 and name HN )(resid 73 and name HN ) 1.8 0.0 1.2 !A assign (resid 73 and name HN )(resid 74 and name HN ) 1.8 0.0 1.2 !A assign (resid 73 and name HN )(resid 75 and name HN ) 1.8 0.0 2.7 assign (resid 74 and name HN )(resid 75 and name HN ) 1.8 0.0 1.2 !A assign (resid 74 and name HN )(resid 76 and name HN ) 1.8 0.0 2.7 assign (resid 76 and name HN )(resid 75 and name HN ) 1.8 0.0 1.2 !A assign (resid 76 and name HN )(resid 77 and name HN ) 1.8 0.0 1.7 !A weaker assign (resid 77 and name HN )(resid 78 and name HN ) 1.8 0.0 3.7 assign (resid 79 and name HN )(resid 78 and name HN ) 1.8 0.0 3.2 ! amide to side chain !NH to a-1 3.0 in B-sheet or helix if strong; otherwise, 3.5 (med) and 5.0 (weak) assign (resid 2 and name HN )(resid 1 and name HA ) 1.8 0.0 1.2 assign (resid 2 and name HN )(resid 1 and name HB* ) 1.8 0.0 4.2 assign (resid 2 and name HN )(resid 1 and name HG1 ) 1.8 0.0 4.2 assign (resid 2 and name HN )(resid 1 and name HG2 ) 1.8 0.0 4.2 assign (resid 2 and name HN )(resid 2 and name HB1 ) 1.8 0.0 2.7 assign (resid 2 and name HN )(resid 2 and name HB2 ) 1.8 0.0 2.7 assign (resid 3 and name HN )(resid 2 and name HB1 ) 1.8 0.0 4.2 assign (resid 3 and name HN )(resid 2 and name HB2 ) 1.8 0.0 4.2 assign (resid 3 and name HN )(resid 2 and name HA ) 1.8 0.0 2.7 assign (resid 3 and name HN )(resid 3 and name HB* ) 1.8 0.0 4.2 assign (resid 3 and name HN )(resid 33 and name HA1 ) 1.8 0.0 3.2 !9 assign (resid 3 and name HN )(resid 33 and name HA2 ) 1.8 0.0 3.2 !9 assign (resid 3 and name HN )(resid 28 and name HG1* ) 1.8 0.0 4.7 !9 assign (resid 4 and name HN )(resid 4 and name HB* ) 1.8 0.0 2.7 assign (resid 4 and name HN )(resid 4 and name HG1 ) 1.8 0.0 3.2 assign (resid 4 and name HN )(resid 4 and name HG2 ) 1.8 0.0 3.2 assign (resid 4 and name HN )(resid 25 and name HD* ) 1.8 0.0 4.7 assign (resid 4 and name HN )(resid 7 and name HB* ) 1.8 0.0 4.2 assign (resid 5 and name HN )(resid 4 and name HG1 ) 1.8 0.0 4.2 assign (resid 5 and name HN )(resid 4 and name HG2 ) 1.8 0.0 4.2 assign (resid 5 and name HN )(resid 4 and name HA ) 1.8 0.0 0.7 !b-strand assign (resid 5 and name HN )(resid 5 and name HA ) 1.8 0.0 1.2 assign (resid 5 and name HN )(resid 5 and name HB ) 1.8 0.0 1.2 assign (resid 5 and name HN )(resid 5 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 5 and name HN )(resid 28 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 6 and name HN )(resid 5 and name HA ) 1.8 0.0 0.7 !b-strand assign (resid 6 and name HN )(resid 5 and name HB ) 1.8 0.0 3.7 assign (resid 6 and name HN )(resid 5 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 6 and name HN )(resid 6 and name HA1 ) 1.8 0.0 2.2 assign (resid 6 and name HN )(resid 6 and name HA2 ) 1.8 0.0 2.2 assign (resid 6 and name HN )(resid 25 and name HG2* ) 1.8 0.0 4.7 !3d c13ny assign (resid 7 and name HN )(resid 7 and name HA ) 1.8 0.0 3.2 !9 assign (resid 7 and name HN )(resid 7 and name HB* ) 1.8 0.0 2.2 assign (resid 7 and name HN )(resid 5 and name HA ) 1.8 0.0 1.2 assign (resid 7 and name HN )(resid 6 and name HA1 ) 1.8 0.0 2.0 assign (resid 7 and name HN )(resid 6 and name HA2 ) 1.8 0.0 2.0 assign (resid 7 and name HN )(resid 25 and name HD* ) 1.8 0.0 4.7 assign (resid 7 and name HN )(resid 25 and name HG2* ) 1.8 0.0 4.7 !3d c13ny assign (resid 8 and name HN )(resid 58 and name HG* ) 1.8 0.0 5.6 !15 assign (resid 8 and name HN )(resid 8 and name HA ) 1.8 0.0 3.2 assign (resid 8 and name HN )(resid 8 and name HB1 ) 1.8 0.0 2.7 assign (resid 8 and name HN )(resid 8 and name HB2 ) 1.8 0.0 2.7 assign (resid 8 and name HN )(resid 7 and name HA ) 1.8 0.0 0.7 !10 b assign (resid 8 and name HN )(resid 7 and name HB* ) 1.8 0.0 2.2 assign (resid 9 and name HN )(resid 9 and name HA ) 1.8 0.0 3.2 !10 assign (resid 9 and name HN )(resid 9 and name HB1 ) 1.8 0.0 2.7 assign (resid 9 and name HN )(resid 9 and name HB2 ) 1.8 0.0 2.7 assign (resid 9 and name HN )(resid 9 and name HD1* ) 1.8 0.0 4.6 assign (resid 9 and name HN )(resid 9 and name HD2* ) 1.8 0.0 4.6 assign (resid 9 and name HN )(resid 8 and name HB1 ) 1.8 0.0 4.2 assign (resid 9 and name HN )(resid 8 and name HB2 ) 1.8 0.0 4.2 assign (resid 9 and name HN )(resid 8 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 9 and name HN )(resid 24 and name HA ) 1.8 0.0 3.2 assign (resid 9 and name HN )(resid 23 and name HB* ) 1.8 0.0 5.7 assign (resid 9 and name HN )(resid 25 and name HD* ) 1.8 0.0 5.7 assign (resid 10 and name HN )(resid 10 and name HA ) 1.8 0.0 3.2 assign (resid 10 and name HN )(resid 10 and name HB ) 1.8 0.0 3.2 assign (resid 10 and name HN )(resid 10 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 10 and name HN )(resid 10 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 10 and name HN )(resid 9 and name HA ) 1.8 0.0 0.7 !B-sheet assign (resid 10 and name HN )(resid 9 and name HD1* ) 1.8 0.0 4.1 assign (resid 10 and name HN )(resid 9 and name HD2* ) 1.8 0.0 4.1 assign (resid 10 and name HN )(resid 58 and name HA ) 1.8 0.0 3.2 !3d 13Cny assign (resid 11 and name HN )(resid 11 and name HA ) 1.8 0.0 3.2 assign (resid 11 and name HN )(resid 11 and name HB ) 1.8 0.0 2.2 assign (resid 11 and name HN )(resid 11 and name HG* ) 1.8 0.0 5.0 assign (resid 11 and name HN )(resid 10 and name HA ) 1.8 0.0 0.7 !10 assign (resid 11 and name HN )(resid 10 and name HB ) 1.8 0.0 3.2 assign (resid 11 and name HN )(resid 10 and name HG1* ) 1.8 0.0 4.7 !0% assign (resid 11 and name HN )(resid 10 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 11 and name HN )(resid 22 and name HA ) 1.8 0.0 3.2 assign (resid 12 and name HN )(resid 11 and name HB ) 1.8 0.0 3.2 assign (resid 12 and name HN )(resid 11 and name HA ) 1.8 0.0 0.7 !b-shhet assign (resid 12 and name HN )(resid 56 and name HA ) 1.8 0.0 3.2 !WEAK 8 assign (resid 20 and name HN )(resid 19 and name HA ) 1.8 0.0 0.7 assign (resid 20 and name HN )(resid 20 and name HB* ) 1.8 0.0 2.7 assign (resid 20 and name HN )(resid 19 and name HB1 ) 1.8 0.0 4.2 assign (resid 20 and name HN )(resid 19 and name HB2 ) 1.8 0.0 4.2 assign (resid 20 and name HN )(resid 10 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 21 and name HN )(resid 21 and name HA ) 1.8 0.0 3.2 assign (resid 21 and name HN )(resid 20 and name HB* ) 1.8 0.0 3.7 assign (resid 21 and name HN )(resid 10 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 22 and name HN )(resid 21 and name HA ) 1.8 0.0 3.2 assign (resid 23 and name HN )(resid 10 and name HG2* ) 1.8 0.0 4.7 !9 assign (resid 23 and name HN )(resid 23 and name HB* ) 1.8 0.0 3.7 assign (resid 23 and name HN )(resid 22 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 23 and name HN )(resid 22 and name HB1 ) 1.8 0.0 4.2 assign (resid 23 and name HN )(resid 22 and name HB2 ) 1.8 0.0 4.2 assign (resid 24 and name HN )(resid 24 and name HA ) 1.8 0.0 3.2 assign (resid 24 and name HN )(resid 23 and name HA ) 1.8 0.0 0.7 !10 assign (resid 24 and name HN )(resid 23 and name HB* ) 1.8 0.0 3.2 assign (resid 24 and name HN )(resid 39 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 24 and name HN )(resid 41 and name HA ) 1.8 0.0 3.2 assign (resid 25 and name HN )(resid 25 and name HA ) 1.8 0.0 3.2 !looks weak. assign (resid 25 and name HN )(resid 25 and name HG2* ) 1.8 0.0 4.7 assign (resid 25 and name HN )(resid 25 and name HD* ) 1.8 0.0 4.7 assign (resid 25 and name HN )(resid 24 and name HA ) 1.8 0.0 0.7 !10 assign (resid 25 and name HN )(resid 8 and name HA ) 1.8 0.0 3.2 assign (resid 26 and name HN )(resid 26 and name HA ) 1.8 0.0 3.2 assign (resid 26 and name HN )(resid 26 and name HB ) 1.8 0.0 3.2 assign (resid 26 and name HN )(resid 26 and name HD* ) 1.8 0.0 4.7 assign (resid 26 and name HN )(resid 26 and name HG2* ) 1.8 0.0 4.7 assign (resid 26 and name HN )(resid 25 and name HA ) 1.8 0.0 1.2 assign (resid 26 and name HN )(resid 39 and name HA ) 1.8 0.0 3.2 assign (resid 26 and name HN )(resid 39 and name HG1* ) 1.8 0.0 5.6 assign (resid 27 and name HN )(resid 27 and name HA ) 1.8 0.0 3.2 assign (resid 27 and name HN )(resid 26 and name HA ) 1.8 0.0 2.7 assign (resid 27 and name HN )(resid 25 and name HG2* ) 1.8 0.0 3.7 assign (resid 27 and name HN )(resid 25 and name HA ) 1.8 0.0 1.7 assign (resid 27 and name HN )(resid 26 and name HB ) 1.8 0.0 2.7 assign (resid 27 and name HN )(resid 26 and name HD* ) 1.8 0.0 4.2 assign (resid 27 and name HN )(resid 26 and name HG2* ) 1.8 0.0 4.7 assign (resid 27 and name HN )(resid 39 and name HA ) 1.8 0.0 3.2 assign (resid 27 and name HN )(resid 39 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 28 and name HN )(resid 28 and name HA ) 1.8 0.0 3.2 assign (resid 28 and name HN )(resid 28 and name HB ) 1.8 0.0 1.7 assign (resid 28 and name HN )(resid 28 and name HG1* ) 1.8 0.0 4.2 !10% assign (resid 28 and name HN )(resid 28 and name HG2* ) 1.8 0.0 3.7 !10% stronger assign (resid 28 and name HN )(resid 27 and name HA ) 1.8 0.0 2.7 !10 assign (resid 28 and name HN )(resid 5 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 29 and name HN )(resid 29 and name HA ) 1.8 0.0 3.2 assign (resid 29 and name HN )(resid 29 and name HB1 ) 1.8 0.0 2.7 assign (resid 29 and name HN )(resid 29 and name HB2 ) 1.8 0.0 2.7 assign (resid 29 and name HN )(resid 29 and name HG* ) 1.8 0.0 4.2 assign (resid 29 and name HN )(resid 28 and name HA ) 1.8 0.0 1.7 assign (resid 29 and name HN )(resid 28 and name HB ) 1.8 0.0 3.2 assign (resid 29 and name HN )(resid 28 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 29 and name HN )(resid 28 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 29 and name HN )(resid 37 and name HA ) 1.8 0.0 3.2 assign (resid 29 and name HN )(resid 37 and name HD* ) 1.8 0.0 5.6 !B aromatic assign (resid 30 and name HN )(resid 30 and name HA ) 1.8 0.0 1.7 assign (resid 30 and name HN )(resid 30 and name HB1 ) 1.8 0.0 2.7 assign (resid 30 and name HN )(resid 30 and name HB2 ) 1.8 0.0 2.7 assign (resid 30 and name HN )(resid 29 and name HA ) 1.8 0.0 1.7 assign (resid 30 and name HN )(resid 29 and name HB1 ) 1.8 0.0 3.2 assign (resid 30 and name HN )(resid 29 and name HB2 ) 1.8 0.0 3.2 assign (resid 30 and name HN )(resid 29 and name HG* ) 1.8 0.0 4.2 assign (resid 30 and name HN )(resid 28 and name HB ) 1.8 0.0 3.2 assign (resid 30 and name HN )(resid 28 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 30 and name HN )(resid 28 and name HG1* ) 1.8 0.0 3.7 !10% assign (resid 32 and name HN )(resid 32 and name HB1 ) 1.8 0.0 2.7 assign (resid 32 and name HN )(resid 32 and name HB2 ) 1.8 0.0 2.7 assign (resid 32 and name HN )(resid 31 and name HB* ) 1.8 0.0 3.2 assign (resid 33 and name HN )(resid 33 and name HA1 ) 1.8 0.0 2.7 assign (resid 33 and name HN )(resid 33 and name HA2 ) 1.8 0.0 2.7 assign (resid 33 and name HN )(resid 30 and name HB1 ) 1.8 0.0 4.2 assign (resid 33 and name HN )(resid 28 and name HG1* ) 1.8 0.0 4.7 !9 assign (resid 33 and name HN )(resid 33 and name HA2 ) 1.8 0.0 2.7 assign (resid 34 and name HN )(resid 33 and name HA1 ) 1.8 0.0 4.2 assign (resid 34 and name HN )(resid 33 and name HA2 ) 1.8 0.0 4.2 assign (resid 34 and name HN )(resid 28 and name HG1* ) 1.8 0.0 5.7 !9 assign (resid 37 and name HN )(resid 37 and name HA ) 1.8 0.0 3.2 assign (resid 37 and name HN )(resid 37 and name HB1 ) 1.8 0.0 2.7 assign (resid 37 and name HN )(resid 37 and name HB2 ) 1.8 0.0 2.7 assign (resid 37 and name HN )(resid 36 and name HA ) 1.8 0.0 0.7 assign (resid 37 and name HN )(resid 36 and name HB* ) 1.8 0.0 3.2 !9 assign (resid 37 and name HN )(resid 35 and name HA ) 1.8 0.0 2.7 !4 assign (resid 38 and name HN )(resid 38 and name HA ) 1.8 0.0 2.7 assign (resid 38 and name HN )(resid 38 and name HB ) 1.8 0.0 1.7 assign (resid 38 and name HN )(resid 37 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 38 and name HN )(resid 37 and name HB1 ) 1.8 0.0 2.7 assign (resid 38 and name HN )(resid 37 and name HB2 ) 1.8 0.0 2.7 assign (resid 38 and name HN )(resid 25 and name HG2* ) 1.8 0.0 5.6 !3d c13ny assign (resid 39 and name HN )(resid 39 and name HA ) 1.8 0.0 2.7 assign (resid 39 and name HN )(resid 39 and name HG1* ) 1.8 0.0 3.7 !10% stronger assign (resid 39 and name HN )(resid 39 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 39 and name HN )(resid 38 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 39 and name HN )(resid 38 and name HG* ) 1.8 0.0 4.1 assign (resid 39 and name HN )(resid 49 and name HA ) 1.8 0.0 3.2 !3d C13ny seeit assign (resid 40 and name HN )(resid 40 and name HA ) 1.8 0.0 2.7 assign (resid 40 and name HN )(resid 40 and name HB1 ) 1.8 0.0 2.7 assign (resid 40 and name HN )(resid 40 and name HB2 ) 1.8 0.0 2.7 assign (resid 40 and name HN )(resid 39 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 40 and name HN )(resid 39 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 40 and name HN )(resid 39 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 40 and name HN )(resid 23 and name HB* ) 1.8 0.0 4.7 assign (resid 40 and name HN )(resid 25 and name HA ) 1.8 0.0 3.2 assign (resid 40 and name HN )(resid 26 and name HD* ) 1.8 0.0 4.7 !9 assign (resid 40 and name HE )(resid 40 and name HB1 ) 1.8 0.0 4.2 !9 assign (resid 40 and name HE )(resid 40 and name HB2 ) 1.8 0.0 4.2 !9 assign (resid 40 and name HE )(resid 40 and name HD* ) 1.8 0.0 2.7 !9 assign (resid 40 and name HE )(resid 40 and name HG* ) 1.8 0.0 3.7 !9 assign (resid 40 and name HE )(resid 47 and name HG1 ) 1.8 0.0 4.2 !9 assign (resid 40 and name HE )(resid 47 and name HG2 ) 1.8 0.0 4.2 !9 assign (resid 40 and name HE )(resid 26 and name HD* ) 1.8 0.0 4.7 !9 assign (resid 41 and name HN )(resid 41 and name HA ) 1.8 0.0 2.7 assign (resid 41 and name HN )(resid 41 and name HB1 ) 1.8 0.0 4.2 assign (resid 41 and name HN )(resid 41 and name HB2 ) 1.8 0.0 3.2 assign (resid 41 and name HN )(resid 41 and name HD1 ) 1.8 0.0 3.2 !9 assign (resid 41 and name HN )(resid 40 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 41 and name HN )(resid 40 and name HB2 ) 1.8 0.0 4.2 assign (resid 41 and name HN )(resid 47 and name HA ) 1.8 0.0 3.2 assign (resid 41 and name HE1 )(resid 72 and name HB* ) 1.8 0.0 4.7 assign (resid 41 and name HE1 )(resid 39 and name HG1* ) 1.8 0.0 4.2 !10% assign (resid 41 and name HE1 )(resid 48 and name HG* ) 1.8 0.0 5.7 assign (resid 42 and name HN )(resid 42 and name HA ) 1.8 0.0 2.7 assign (resid 42 and name HN )(resid 42 and name HB1 ) 1.8 0.0 4.2 assign (resid 42 and name HN )(resid 42 and name HB2 ) 1.8 0.0 4.2 assign (resid 42 and name HN )(resid 42 and name HD2* ) 1.8 0.0 4.7 !10% assign (resid 42 and name HN )(resid 42 and name HD1* ) 1.8 0.0 4.7 !10% assign (resid 42 and name HN )(resid 23 and name HA ) 1.8 0.0 2.2 assign (resid 42 and name HN )(resid 41 and name HA ) 1.8 0.0 1.2 !b-sheet assign (resid 42 and name HN )(resid 23 and name HB* ) 1.8 0.0 4.7 assign (resid 43 and name HN )(resid 43 and name HA ) 1.8 0.0 2.7 assign (resid 43 and name HN )(resid 43 and name HB ) 1.8 0.0 1.7 assign (resid 43 and name HN )(resid 43 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 43 and name HN )(resid 43 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 44 and name HN )(resid 44 and name HA ) 1.8 0.0 1.7 assign (resid 44 and name HN )(resid 44 and name HB1 ) 1.8 0.0 3.2 assign (resid 44 and name HN )(resid 44 and name HB2 ) 1.8 0.0 3.2 assign (resid 44 and name HN )(resid 43 and name HB ) 1.8 0.0 2.2 assign (resid 44 and name HN )(resid 43 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 44 and name HD21 )(resid 43 and name HA ) 1.8 0.0 4.2 !9 assign (resid 44 and name HD22 )(resid 43 and name HA ) 1.8 0.0 4.7 !9 assign (resid 45 and name HN )(resid 45 and name HA* ) 1.8 0.0 2.2 assign (resid 45 and name HN )(resid 44 and name HA ) 1.8 0.0 3.2 assign (resid 45 and name HN )(resid 44 and name HB1 ) 1.8 0.0 4.2 assign (resid 45 and name HN )(resid 44 and name HB2 ) 1.8 0.0 4.2 assign (resid 46 and name HN )(resid 46 and name HA ) 1.8 0.0 2.7 assign (resid 46 and name HN )(resid 46 and name HB1 ) 1.8 0.0 3.2 assign (resid 46 and name HN )(resid 46 and name HB2 ) 1.8 0.0 3.2 assign (resid 46 and name HN )(resid 45 and name HA* ) 1.8 0.0 2.7 assign (resid 46 and name HN )(resid 44 and name HB1 ) 1.8 0.0 4.2 assign (resid 46 and name HN )(resid 44 and name HB2 ) 1.8 0.0 4.2 assign (resid 47 and name HN )(resid 47 and name HA ) 1.8 0.0 2.7 assign (resid 47 and name HN )(resid 47 and name HB1 ) 1.8 0.0 2.7 assign (resid 47 and name HN )(resid 47 and name HB2 ) 1.8 0.0 2.7 assign (resid 47 and name HN )(resid 47 and name HG1 ) 1.8 0.0 3.7 assign (resid 47 and name HN )(resid 47 and name HG2 ) 1.8 0.0 3.7 assign (resid 47 and name HN )(resid 46 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 47 and name HN )(resid 46 and name HB1 ) 1.8 0.0 2.2 assign (resid 47 and name HN )(resid 46 and name HB2 ) 1.8 0.0 2.2 assign (resid 48 and name HN )(resid 48 and name HA ) 1.8 0.0 2.7 assign (resid 48 and name HN )(resid 48 and name HG2* ) 1.8 0.0 3.2 assign (resid 48 and name HN )(resid 47 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 48 and name HN )(resid 47 and name HB1 ) 1.8 0.0 4.2 assign (resid 48 and name HN )(resid 47 and name HB2 ) 1.8 0.0 4.2 assign (resid 48 and name HN )(resid 47 and name HG1 ) 1.8 0.0 4.2 assign (resid 48 and name HN )(resid 47 and name HG2 ) 1.8 0.0 4.2 assign (resid 48 and name HN )(resid 39 and name HG1* ) 1.8 0.0 4.2 !10% assign (resid 49 and name HN )(resid 49 and name HA ) 1.8 0.0 2.7 assign (resid 49 and name HN )(resid 49 and name HB ) 1.8 0.0 1.7 assign (resid 49 and name HN )(resid 49 and name HG2* ) 1.8 0.0 4.7 assign (resid 49 and name HN )(resid 48 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 49 and name HN )(resid 48 and name HG2* ) 1.8 0.0 3.7 assign (resid 49 and name HN )(resid 48 and name HB ) 1.8 0.0 1.7 assign (resid 50 and name HN )(resid 50 and name HA ) 1.8 0.0 2.7 assign (resid 50 and name HN )(resid 50 and name HB ) 1.8 0.0 3.2 assign (resid 50 and name HN )(resid 49 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 50 and name HN )(resid 49 and name HG2* ) 1.8 0.0 3.7 assign (resid 51 and name HN )(resid 51 and name HA ) 1.8 0.0 2.7 assign (resid 51 and name HN )(resid 51 and name HB1 ) 1.8 0.0 2.7 assign (resid 51 and name HN )(resid 51 and name HB2 ) 1.8 0.0 2.7 assign (resid 51 and name HN )(resid 50 and name HA ) 1.8 0.0 1.0 !b-sheet assign (resid 51 and name HN )(resid 50 and name HB ) 1.8 0.0 2.2 assign (resid 51 and name HN )(resid 50 and name HG* ) 1.8 0.0 5.0 assign (resid 53 and name HN )(resid 53 and name HA1 ) 1.8 0.0 3.7 assign (resid 53 and name HN )(resid 53 and name HA2 ) 1.8 0.0 3.7 assign (resid 53 and name HN )(resid 52 and name HB1 ) 1.8 0.0 4.2 assign (resid 53 and name HN )(resid 52 and name HB2 ) 1.8 0.0 4.2 assign (resid 54 and name HN )(resid 53 and name HA1 ) 1.8 0.0 3.7 assign (resid 54 and name HN )(resid 53 and name HA2 ) 1.8 0.0 3.7 assign (resid 55 and name HN )(resid 55 and name HB1 ) 1.8 0.0 2.7 assign (resid 55 and name HN )(resid 55 and name HB2 ) 1.8 0.0 2.7 assign (resid 55 and name HN )(resid 54 and name HA ) 1.8 0.0 1.2 assign (resid 55 and name HN )(resid 54 and name HB1 ) 1.8 0.0 4.2 assign (resid 55 and name HN )(resid 54 and name HB2 ) 1.8 0.0 4.2 assign (resid 55 and name HN )(resid 56 and name HB* ) 1.8 0.0 4.7 assign (resid 56 and name HN )(resid 56 and name HA ) 1.8 0.0 1.7 assign (resid 56 and name HN )(resid 56 and name HB* ) 1.8 0.0 3.2 assign (resid 56 and name HN )(resid 54 and name HA ) 1.8 0.0 2.2 assign (resid 56 and name HN )(resid 55 and name HB1 ) 1.8 0.0 4.2 assign (resid 56 and name HN )(resid 55 and name HB2 ) 1.8 0.0 4.2 assign (resid 57 and name HN )(resid 56 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 57 and name HN )(resid 11 and name HA ) 1.8 0.0 3.2 assign (resid 57 and name HN )(resid 57 and name HA ) 1.8 0.0 2.7 assign (resid 57 and name HN )(resid 57 and name HB ) 1.8 0.0 3.2 assign (resid 57 and name HN )(resid 57 and name HG* ) 1.8 0.0 5.0 assign (resid 57 and name HN )(resid 56 and name HB* ) 1.8 0.0 3.2 assign (resid 57 and name HN )(resid 10 and name HG2* ) 1.8 0.0 4.7 !9 assign (resid 58 and name HN )(resid 57 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 58 and name HN )(resid 58 and name HA ) 1.8 0.0 2.7 assign (resid 58 and name HN )(resid 58 and name HB ) 1.8 0.0 1.7 assign (resid 58 and name HN )(resid 58 and name HG* ) 1.8 0.0 5.0 assign (resid 58 and name HN )(resid 57 and name HB ) 1.8 0.0 1.7 assign (resid 58 and name HN )(resid 57 and name HG* ) 1.8 0.0 4.0 assign (resid 59 and name HN )(resid 59 and name HG2* ) 1.8 0.0 4.7 !10% assign (resid 59 and name HN )(resid 59 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 59 and name HN )(resid 58 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 59 and name HN )(resid 58 and name HB ) 1.8 0.0 3.2 assign (resid 59 and name HN )(resid 58 and name HG* ) 1.8 0.0 5.0 assign (resid 59 and name HN )(resid 9 and name HA ) 1.8 0.0 3.2 !3d C13ny assign (resid 59 and name HN )(resid 59 and name HA ) 1.8 0.0 2.7 assign (resid 59 and name HN )(resid 59 and name HB ) 1.8 0.0 1.7 assign (resid 60 and name HN )(resid 60 and name HA ) 1.8 0.0 2.0 assign (resid 60 and name HN )(resid 60 and name HB ) 1.8 0.0 2.2 assign (resid 60 and name HN )(resid 60 and name HG2* ) 1.8 0.0 2.2 assign (resid 60 and name HN )(resid 59 and name HA ) 1.8 0.0 0.7 !b-sheet assign (resid 60 and name HN )(resid 59 and name HB ) 1.8 0.0 2.2 assign (resid 60 and name HN )(resid 59 and name HG2* ) 1.8 0.0 3.7 !10% stronger assign (resid 60 and name HN )(resid 59 and name HG1* ) 1.8 0.0 4.7 !10% assign (resid 60 and name HN )(resid 63 and name HG1 ) 1.8 0.0 4.2 assign (resid 60 and name HN )(resid 63 and name HG2 ) 1.8 0.0 4.2 assign (resid 60 and name HN )(resid 63 and name HB* ) 1.8 0.0 4.2 assign (resid 61 and name HN )(resid 61 and name HB* ) 1.8 0.0 2.2 assign (resid 61 and name HN )(resid 60 and name HA ) 1.8 0.0 1.2 !strong but overlap assign (resid 61 and name HN )(resid 60 and name HB ) 1.8 0.0 1.7 assign (resid 61 and name HN )(resid 60 and name HG2* ) 1.8 0.0 4.7 assign (resid 62 and name HN )(resid 62 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 62 and name HN )(resid 62 and name HB ) 1.8 0.0 1.7 assign (resid 62 and name HN )(resid 62 and name HG2* ) 1.8 0.0 3.2 assign (resid 62 and name HN )(resid 61 and name HB* ) 1.8 0.0 2.2 assign (resid 62 and name HN )(resid 60 and name HA ) 1.8 0.0 3.2 assign (resid 62 and name HN )(resid 60 and name HB ) 1.8 0.0 3.2 assign (resid 62 and name HN )(resid 60 and name HG2* ) 1.8 0.0 4.7 assign (resid 63 and name HN )(resid 63 and name HA ) 1.8 0.0 2.2 assign (resid 63 and name HN )(resid 63 and name HB* ) 1.8 0.0 2.7 assign (resid 63 and name HN )(resid 63 and name HG1 ) 1.8 0.0 2.7 assign (resid 63 and name HN )(resid 63 and name HG2 ) 1.8 0.0 2.7 assign (resid 63 and name HN )(resid 61 and name HB* ) 1.8 0.0 4.7 assign (resid 63 and name HN )(resid 62 and name HA ) 1.8 0.0 2.2 assign (resid 63 and name HN )(resid 62 and name HB ) 1.8 0.0 2.2 assign (resid 63 and name HN )(resid 62 and name HG2* ) 1.8 0.0 4.7 assign (resid 63 and name HN )(resid 60 and name HA ) 1.8 0.0 4.2 !very weak assign (resid 63 and name HN )(resid 60 and name HB ) 1.8 0.0 3.2 assign (resid 63 and name HN )(resid 60 and name HG2* ) 1.8 0.0 4.7 assign (resid 64 and name HN )(resid 64 and name HA ) 1.8 0.0 1.7 assign (resid 64 and name HN )(resid 64 and name HB1 ) 1.8 0.0 2.2 assign (resid 64 and name HN )(resid 64 and name HB2 ) 1.8 0.0 2.2 assign (resid 64 and name HN )(resid 63 and name HB* ) 1.8 0.0 4.2 assign (resid 64 and name HN )(resid 63 and name HG1 ) 1.8 0.0 4.2 assign (resid 64 and name HN )(resid 63 and name HG2 ) 1.8 0.0 4.2 assign (resid 64 and name HN )(resid 62 and name HA ) 1.8 0.0 4.2 assign (resid 64 and name HN )(resid 59 and name HB ) 1.8 0.0 3.2 assign (resid 64 and name HN )(resid 59 and name HG1* ) 1.8 0.0 4.6 assign (resid 65 and name HN )(resid 65 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 65 and name HN )(resid 65 and name HB* ) 1.8 0.0 2.2 assign (resid 65 and name HN )(resid 64 and name HB1 ) 1.8 0.0 4.0 assign (resid 65 and name HN )(resid 64 and name HB2 ) 1.8 0.0 4.0 assign (resid 65 and name HN )(resid 62 and name HA ) 1.8 0.0 3.2 assign (resid 65 and name HN )(resid 43 and name HG2* ) 1.8 0.0 4.2 !9 assign (resid 66 and name HN )(resid 66 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 66 and name HN )(resid 66 and name HB1 ) 1.8 0.0 2.7 assign (resid 66 and name HN )(resid 66 and name HB2 ) 1.8 0.0 2.7 assign (resid 66 and name HN )(resid 66 and name HG* ) 1.8 0.0 3.7 assign (resid 66 and name HN )(resid 62 and name HA ) 1.8 0.0 4.2 assign (resid 66 and name HN )(resid 65 and name HB* ) 1.8 0.0 3.2 assign (resid 66 and name HN )(resid 65 and name HA ) 1.8 0.0 3.2 assign (resid 67 and name HN )(resid 67 and name HB* ) 1.8 0.0 3.2 assign (resid 67 and name HN )(resid 66 and name HA ) 1.8 0.0 3.2 assign (resid 67 and name HN )(resid 66 and name HB1 ) 1.8 0.0 3.7 assign (resid 67 and name HN )(resid 66 and name HB2 ) 1.8 0.0 3.7 assign (resid 67 and name HN )(resid 66 and name HG* ) 1.8 0.0 4.2 assign (resid 68 and name HN )(resid 68 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 68 and name HN )(resid 68 and name HB* ) 1.8 0.0 4.2 assign (resid 68 and name HN )(resid 68 and name HG1 ) 1.8 0.0 4.2 assign (resid 68 and name HN )(resid 68 and name HG2 ) 1.8 0.0 4.2 assign (resid 68 and name HN )(resid 65 and name HA ) 1.8 0.0 3.2 assign (resid 68 and name HN )(resid 67 and name HB* ) 1.8 0.0 4.7 assign (resid 68 and name HN )(resid 66 and name HA ) 1.8 0.0 3.2 assign (resid 68 and name HN )(resid 43 and name HG2* ) 1.8 0.0 5.2 !9 assign (resid 69 and name HN )(resid 69 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 69 and name HN )(resid 69 and name HB1 ) 1.8 0.0 2.7 assign (resid 69 and name HN )(resid 69 and name HB2 ) 1.8 0.0 2.7 assign (resid 69 and name HN )(resid 69 and name HG* ) 1.8 0.0 3.7 assign (resid 69 and name HN )(resid 66 and name HA ) 1.8 0.0 3.2 assign (resid 69 and name HN )(resid 68 and name HA ) 1.8 0.0 3.2 assign (resid 70 and name HN )(resid 70 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 70 and name HN )(resid 70 and name HB1 ) 1.8 0.0 2.7 assign (resid 70 and name HN )(resid 70 and name HB2 ) 1.8 0.0 2.7 assign (resid 70 and name HN )(resid 70 and name HG* ) 1.8 0.0 4.2 assign (resid 70 and name HN )(resid 70 and name HD1 ) 1.8 0.0 4.2 assign (resid 70 and name HN )(resid 70 and name HD2 ) 1.8 0.0 3.7 assign (resid 70 and name HN )(resid 69 and name HA ) 1.8 0.0 3.2 assign (resid 70 and name HN )(resid 66 and name HA ) 1.8 0.0 3.2 assign (resid 71 and name HN )(resid 71 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 71 and name HN )(resid 71 and name HB* ) 1.8 0.0 3.2 assign (resid 71 and name HN )(resid 70 and name HA ) 1.8 0.0 3.2 assign (resid 71 and name HN )(resid 70 and name HB1 ) 1.8 0.0 4.2 assign (resid 71 and name HN )(resid 70 and name HB2 ) 1.8 0.0 4.2 assign (resid 71 and name HN )(resid 70 and name HG* ) 1.8 0.0 4.2 assign (resid 71 and name HN )(resid 68 and name HA ) 1.8 0.0 3.2 assign (resid 72 and name HN )(resid 72 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 72 and name HN )(resid 72 and name HB* ) 1.8 0.0 2.2 assign (resid 72 and name HN )(resid 71 and name HA ) 1.8 0.0 3.2 assign (resid 72 and name HN )(resid 71 and name HB* ) 1.8 0.0 3.7 assign (resid 72 and name HN )(resid 69 and name HA ) 1.8 0.0 3.2 assign (resid 73 and name HN )(resid 73 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 73 and name HN )(resid 73 and name HB* ) 1.8 0.0 3.2 assign (resid 73 and name HN )(resid 72 and name HA ) 1.8 0.0 3.2 assign (resid 73 and name HN )(resid 71 and name HA ) 1.8 0.0 3.2 assign (resid 73 and name HN )(resid 72 and name HB* ) 1.8 0.0 2.2 assign (resid 74 and name HN )(resid 74 and name HA ) 1.8 0.0 1.2 !a-helix assign (resid 74 and name HN )(resid 74 and name HB* ) 1.8 0.0 2.7 assign (resid 74 and name HN )(resid 74 and name HG* ) 1.8 0.0 3.7 assign (resid 74 and name HN )(resid 73 and name HB* ) 1.8 0.0 4.2 assign (resid 74 and name HN )(resid 73 and name HA ) 1.8 0.0 3.2 assign (resid 74 and name HN )(resid 71 and name HA ) 1.8 0.0 2.2 assign (resid 75 and name HN )(resid 75 and name HA ) 1.8 0.0 1.7 assign (resid 75 and name HN )(resid 74 and name HG* ) 1.8 0.0 4.2 assign (resid 75 and name HN )(resid 75 and name HB* ) 1.8 0.0 3.2 assign (resid 75 and name HN )(resid 74 and name HA ) 1.8 0.0 2.7 assign (resid 75 and name HN )(resid 72 and name HA ) 1.8 0.0 4.7 !3d c13ny assign (resid 76 and name HN )(resid 76 and name HA1 ) 1.8 0.0 2.2 !a-helix assign (resid 76 and name HN )(resid 76 and name HA2 ) 1.8 0.0 2.2 !a-helix assign (resid 76 and name HN )(resid 75 and name HA ) 1.8 0.0 2.2 assign (resid 76 and name HN )(resid 75 and name HB* ) 1.8 0.0 4.2 assign (resid 77 and name HN )(resid 76 and name HA2 ) 1.8 0.0 2.7 assign (resid 77 and name HN )(resid 76 and name HA2 ) 1.8 0.0 2.7 assign (resid 78 and name HN )(resid 78 and name HA ) 1.8 0.0 3.2 assign (resid 78 and name HN )(resid 78 and name HB* ) 1.8 0.0 4.2 assign (resid 79 and name HN )(resid 79 and name HA ) 1.8 0.0 3.2 assign (resid 79 and name HN )(resid 79 and name HB* ) 1.8 0.0 4.2 assign (resid 79 and name HN )(resid 78 and name HA ) 1.8 0.0 3.2 assign (resid 79 and name HN )(resid 78 and name HB* ) 1.8 0.0 4.7 assign (resid 80 and name HN )(resid 79 and name HA ) 1.8 0.0 3.2 !Side to side chain assign (resid 1 and name HE* )(resid 9 and name HG ) 1.8 0.0 4.7 !4D assign (resid 1 and name HE* )(resid 56 and name HB* ) 1.8 0.0 6.2 !4D assign (resid 1 and name HE* )(resid 58 and name HG* ) 1.8 0.0 6.6 !8 assign (resid 1 and name HE* )(resid 57 and name HA ) 1.8 0.0 4.7 !8 assign (resid 1 and name HG* )(resid 37 and name HE* ) 1.8 0.0 5.7 !8 assign (resid 1 and name HG* )(resid 58 and name HG* ) 1.8 0.0 6.6 !8 assign (resid 3 and name HA )(resid 3 and name HB* ) 1.8 0.0 3.2 !4D assign (resid 3 and name HB* )(resid 25 and name HG2* ) 1.8 0.0 6.2 !3d 5 assign (resid 3 and name HB* )(resid 25 and name HD* ) 1.8 0.0 5.7 !3d 5 assign (resid 3 and name HB* )(resid 7 and name HB* ) 1.8 0.0 5.7 !3d 5 assign (resid 3 and name HB* )(resid 28 and name HG2* ) 1.8 0.0 6.2 !4D assign (resid 3 and name HB* )(resid 37 and name HE* ) 1.8 0.0 5.7 !4D assign (resid 5 and name HA )(resid 5 and name HB ) 1.8 0.0 1.7 !4D assign (resid 5 and name HA )(resid 5 and name HG1* ) 1.8 0.0 4.7 !4D assign (resid 5 and name HA )(resid 5 and name HG2* ) 1.8 0.0 4.7 !4D assign (resid 5 and name HA )(resid 26 and name HA ) 2.5 0.0 3.5 !4D assign (resid 5 and name HA )(resid 28 and name HA ) 2.5 0.0 3.5 !4D assign (resid 5 and name HA )(resid 28 and name HG2* ) 1.8 0.0 4.7 !3d 10% assign (resid 5 and name HA )(resid 25 and name HG2* ) 1.8 0.0 6.2 !3d assign (resid 5 and name HA )(resid 25 and name HD* ) 2.5 0.0 4.5 !4D assign (resid 5 and name HG2* )(resid 27 and name HA ) 1.8 0.0 3.7 !4D assign (resid 5 and name HG2* )(resid 26 and name HA ) 1.8 0.0 4.7 !4D assign (resid 5 and name HG1* )(resid 28 and name HG2* ) 1.8 0.0 6.2 !4D from 28G2* assign (resid 5 and name HG2* )(resid 28 and name HG2* ) 1.8 0.0 6.2 !4D assign (resid 5 and name HG2* )(resid 25 and name HG2* ) 1.8 0.0 6.2 !4D assign (resid 6 and name HA1 )(resid 5 and name HG1* ) 1.8 0.0 4.7 !4D assign (resid 6 and name HA1 )(resid 5 and name HG2* ) 1.8 0.0 4.7 !4D assign (resid 7 and name HA )(resid 60 and name HA ) 1.8 0.0 1.7 !10 medium AA assign (resid 7 and name HB* )(resid 25 and name HD* ) 1.8 0.0 5.7 !10 assign (resid 8 and name HA )(resid 24 and name HA ) 1.8 0.0 1.2 !3d shorten 10 aa assign (resid 8 and name HA )(resid 8 and name HB1 ) 1.8 0.0 2.7 !3d 2 assign (resid 8 and name HA )(resid 8 and name HB2 ) 1.8 0.0 2.7 !3d 2 assign (resid 8 and name HD* )(resid 42 and name HD1* ) 1.8 0.0 5.7 !4D assign (resid 8 and name HD* )(resid 61 and name HA ) 1.8 0.0 4.2 !4D assign (resid 8 and name HD* )(resid 61 and name HB* ) 1.8 0.0 5.7 !4D assign (resid 8 and name HE* )(resid 61 and name HA ) 1.8 0.0 4.2 !4D assign (resid 8 and name HE* )(resid 61 and name HB* ) 1.8 0.0 5.2 !4D assign (resid 8 and name HE* )(resid 42 and name HD1* ) 1.8 0.0 5.2 !4D assign (resid 8 and name HE* )(resid 42 and name HD2* ) 1.8 0.0 5.2 !4d assign (resid 8 and name HE* )(resid 43 and name HG1* ) 1.8 0.0 5.2 !4D assign (resid 8 and name HE* )(resid 43 and name HG2* ) 1.8 0.0 5.2 !4d assign (resid 9 and name HB1 )(resid 9 and name HA ) 1.8 0.0 4.2 !4D from B assign (resid 9 and name HB2 )(resid 9 and name HA ) 1.8 0.0 4.2 !4D from B assign (resid 9 and name HB1 )(resid 9 and name HG ) 1.8 0.0 3.2 !4D assign (resid 9 and name HB1 )(resid 9 and name HD1* ) 1.8 0.0 5.6 !4D assign (resid 9 and name HB1 )(resid 9 and name HD2* ) 1.8 0.0 5.6 !4D assign (resid 9 and name HG )(resid 52 and name HA ) 1.8 0.0 4.7 !4d assign (resid 9 and name HG )(resid 52 and name HB1 ) 1.8 0.0 4.7 !4d assign (resid 9 and name HG )(resid 52 and name HB2 ) 1.8 0.0 4.7 !4d assign (resid 9 and name HG )(resid 52 and name HG1 ) 1.8 0.0 4.7 !4d assign (resid 9 and name HG )(resid 52 and name HG2 ) 1.8 0.0 4.7 !4d assign (resid 9 and name HG )(resid 37 and name HE* ) 1.8 0.0 4.2 !4d assign (resid 9 and name HG )(resid 56 and name HA ) 1.8 0.0 4.2 !4D assign (resid 9 and name HD2* )(resid 23 and name HB* ) 1.8 0.0 5.2 !4D assign (resid 9 and name HB1 )(resid 23 and name HB* ) 1.8 0.0 5.7 !4D assign (resid 9 and name HD2* )(resid 52 and name HG1 ) 1.8 0.0 5.7 !4d assign (resid 9 and name HD2* )(resid 52 and name HG2 ) 1.8 0.0 5.7 !4d assign (resid 9 and name HD2* )(resid 52 and name HB1 ) 1.8 0.0 5.7 !4d assign (resid 9 and name HD2* )(resid 52 and name HB2 ) 1.8 0.0 5.7 !4d assign (resid 10 and name HA )(resid 22 and name HA ) 1.8 0.0 1.7 !4D from H22 inc to 3.5 AA assign (resid 10 and name HG1* )(resid 10 and name HB ) 1.8 0.0 3.7 !4D assign (resid 10 and name HG2* )(resid 10 and name HB ) 1.8 0.0 3.7 !4D assign (resid 10 and name HG1* )(resid 22 and name HA ) 1.8 0.0 4.7 !3d 10% assign (resid 10 and name HG2* )(resid 22 and name HA ) 1.8 0.0 4.7 !3d 10% assign (resid 10 and name HG2* )(resid 20 and name HA ) 1.8 0.0 4.7 !4d assign (resid 10 and name HG2* )(resid 19 and name HB1 ) 1.8 0.0 4.7 !4d assign (resid 10 and name HG2* )(resid 19 and name HB2 ) 1.8 0.0 4.7 !4d assign (resid 10 and name HG1* )(resid 20 and name HA ) 1.8 0.0 5.7 !3d 10% assign (resid 10 and name HG1* )(resid 59 and name HG1* ) 1.8 0.0 6.2 !4d assign (resid 10 and name HG2* )(resid 59 and name HG2* ) 1.8 0.0 6.2 !4d assign (resid 10 and name HG1* )(resid 57 and name HG1* ) 1.8 0.0 5.6 !4d assign (resid 10 and name HG2* )(resid 57 and name HB ) 1.8 0.0 6.2 !4d assign (resid 10 and name HG1* )(resid 57 and name HB ) 1.8 0.0 6.2 !4d assign (resid 10 and name HG2* )(resid 57 and name HG1* ) 1.8 0.0 6.2 !4d assign (resid 11 and name HA )(resid 11 and name HB ) 1.8 0.0 1.7 !4d assign (resid 20 and name HB* )(resid 10 and name HG1* ) 1.8 0.0 5.7 !4d assign (resid 22 and name HA )(resid 22 and name HB1 ) 1.8 0.0 4.7 !4D assign (resid 22 and name HA )(resid 22 and name HB2 ) 1.8 0.0 4.7 !4D assign (resid 22 and name HB1 )(resid 10 and name HG2* ) 1.8 0.0 5.7 !4D assign (resid 22 and name HB1 )(resid 10 and name HA ) 1.8 0.0 4.2 !4D assign (resid 23 and name HA )(resid 23 and name HB* ) 1.8 0.0 2.3 !3d 4D assign (resid 23 and name HA )(resid 41 and name HA ) 1.8 0.0 1.7 !3d C13ny aa assign (resid 23 and name HA )(resid 42 and name HG ) 1.8 0.0 3.2 !3d 4D assign (resid 23 and name HA )(resid 42 and name HD2* ) 1.8 0.0 4.7 !3d 10% assign (resid 23 and name HA )(resid 42 and name HD1* ) 1.8 0.0 4.7 !3d 10% assign (resid 23 and name HB* )(resid 39 and name HA ) 1.8 0.0 4.7 !4D assign (resid 23 and name HB* )(resid 39 and name HG1* ) 1.8 0.0 4.7 !3d 10% assign (resid 23 and name HB* )(resid 39 and name HG2* ) 1.8 0.0 6.2 !3d 10% assign (resid 23 and name HB* )(resid 41 and name HA ) 1.8 0.0 4.7 !4D assign (resid 23 and name HB* )(resid 41 and name HZ3 ) 1.8 0.0 4.7 !4d assign (resid 23 and name HB* )(resid 42 and name HD2* ) 1.8 0.0 5.2 !4D assign (resid 23 and name HB* )(resid 42 and name HG ) 1.8 0.0 4.7 !4D assign (resid 25 and name HA )(resid 25 and name HG2* ) 1.8 0.0 4.7 !4D assign (resid 25 and name HG11 )(resid 25 and name HD* ) 1.8 0.0 4.2 !4D assign (resid 25 and name HG12 )(resid 25 and name HG2* ) 1.8 0.0 4.2 !4D assign (resid 25 and name HG12 )(resid 25 and name HD* ) 1.8 0.0 4.2 !4D assign (resid 25 and name HG12 )(resid 25 and name HD* ) 1.8 0.0 4.2 !4D assign (resid 25 and name HG11 )(resid 25 and name HG2* ) 1.8 0.0 4.2 !4D assign (resid 25 and name HA )(resid 39 and name HA ) 1.8 0.0 1.2 !3d 10 shorten aa assign (resid 25 and name HG11 )(resid 39 and name HG2* ) 1.8 0.0 5.7 !4D assign (resid 25 and name HG12 )(resid 39 and name HG2* ) 1.8 0.0 5.7 !4D assign (resid 25 and name HG2* )(resid 39 and name HG2* ) 1.8 0.0 6.2 !4D assign (resid 25 and name HG2* )(resid 28 and name HG2* ) 1.8 0.0 6.2 !4D assign (resid 25 and name HG2* )(resid 8 and name HA ) 1.8 0.0 4.7 !4D assign (resid 25 and name HG2* )(resid 39 and name HA ) 1.8 0.0 4.7 !4D assign (resid 25 and name HG2* )(resid 37 and name HA ) 1.8 0.0 4.7 !4D assign (resid 25 and name HG2* )(resid 37 and name HB1 ) 1.8 0.0 4.7 !4D assign (resid 25 and name HG2* )(resid 37 and name HB2 ) 1.8 0.0 4.7 !4D assign (resid 25 and name HG2* )(resid 37 and name HD* ) 1.8 0.0 5.7 !4D assign (resid 25 and name HG2* )(resid 37 and name HE* ) 1.8 0.0 6.2 !4D assign (resid 25 and name HD* )(resid 28 and name HG2* ) 1.8 0.0 6.2 !4D assign (resid 25 and name HD* )(resid 58 and name HG* ) 1.8 0.0 7.1 !8 assign (resid 26 and name HB )(resid 26 and name HA ) 1.8 0.0 1.7 !4d assign (resid 26 and name HB )(resid 26 and name HG11 ) 1.8 0.0 2.7 !4d assign (resid 26 and name HB )(resid 26 and name HG12 ) 1.8 0.0 2.7 !4d assign (resid 26 and name HB )(resid 26 and name HG* ) 1.8 0.0 4.7 !4d assign (resid 26 and name HB )(resid 26 and name HD* ) 1.8 0.0 4.7 !4d assign (resid 26 and name HG2* )(resid 26 and name HA ) 1.8 0.0 4.7 !4D assign (resid 26 and name HG2* )(resid 39 and name HA ) 1.8 0.0 4.7 !3d C13ny assign (resid 26 and name HD* )(resid 39 and name HA ) 1.8 0.0 4.7 !3d C13ny assign (resid 26 and name HD* )(resid 39 and name HA ) 1.8 0.0 4.7 !4D assign (resid 26 and name HD* )(resid 47 and name HA ) 1.8 0.0 4.7 !4D assign (resid 26 and name HD* )(resid 47 and name HG1 ) 1.8 0.0 5.7 !4D assign (resid 26 and name HD* )(resid 47 and name HG2 ) 1.8 0.0 5.7 !4D assign (resid 26 and name HD* )(resid 47 and name HB* ) 1.8 0.0 5.7 !4D assign (resid 27 and name HA )(resid 27 and name HB* ) 1.8 0.0 2.7 !4D assign (resid 27 and name HA )(resid 27 and name HG1 ) 1.8 0.0 2.7 !4D assign (resid 27 and name HA )(resid 27 and name HG2 ) 1.8 0.0 2.7 !4D assign (resid 28 and name HG1* )(resid 28 and name HA ) 1.8 0.0 4.7 !4D assign (resid 28 and name HG2* )(resid 28 and name HA ) 1.8 0.0 4.7 !4D assign (resid 28 and name HG2* )(resid 28 and name HB ) 1.8 0.0 3.2 !4D assign (resid 28 and name HG1* )(resid 37 and name HD* ) 1.8 0.0 6.1 !3d 10% assign (resid 28 and name HG1* )(resid 37 and name HE* ) 1.8 0.0 5.1 !3d 10% assign (resid 28 and name HG2* )(resid 37 and name HD* ) 1.8 0.0 5.1 !3d 10% assign (resid 28 and name HG2* )(resid 37 and name HE* ) 1.8 0.0 6.1 !3d 10% assign (resid 28 and name HG2* )(resid 37 and name HA ) 1.8 0.0 4.7 !4D assign (resid 28 and name HG1* )(resid 5 and name HB ) 1.8 0.0 4.7 !4D assign (resid 28 and name HG2* )(resid 4 and name HA ) 1.8 0.0 4.7 !4D assign (resid 28 and name HG1* )(resid 4 and name HA ) 1.8 0.0 4.7 !4D assign (resid 28 and name HG1* )(resid 37 and name HA ) 1.8 0.0 4.7 !4D assign (resid 28 and name HG1* )(resid 33 and name HA1 ) 1.8 0.0 5.7 !4D assign (resid 28 and name HG1* )(resid 33 and name HA2 ) 1.8 0.0 5.7 !4D assign (resid 32 and name HA )(resid 32 and name HB1 ) 1.8 0.0 2.7 !4d from b assign (resid 32 and name HA )(resid 32 and name HB2 ) 1.8 0.0 2.7 !4d from b assign (resid 35 and name HA )(resid 35 and name HB1 ) 1.8 0.0 2.7 !4d assign (resid 35 and name HA )(resid 35 and name HB2 ) 1.8 0.0 2.7 !4d assign (resid 35 and name HA )(resid 36 and name HA ) 1.8 0.0 3.2 !4d assign (resid 35 and name HA )(resid 37 and name HD* ) 1.8 0.0 4.7 !3d c13ny assign (resid 35 and name HA )(resid 37 and name HE* ) 1.8 0.0 4.7 !3d c13ny ! assign (resid 35 and name HB1 )(resid 36 and name HA ) 1.8 0.0 4.2 !4D assign (resid 35 and name HB2 )(resid 36 and name HA ) 1.8 0.0 4.2 !4D assign (resid 36 and name HA )(resid 36 and name HB* ) 1.8 0.0 2.7 !4D assign (resid 36 and name HD* )(resid 49 and name HG2* ) 1.8 0.0 5.2 !4d assign (resid 37 and name HA )(resid 28 and name HA ) 1.8 0.0 3.2 !3d C13ny aa assign (resid 37 and name HA )(resid 37 and name HB1 ) 1.8 0.0 2.7 !3d c13ny assign (resid 37 and name HA )(resid 37 and name HB2 ) 1.8 0.0 2.7 !3d c13ny assign (resid 37 and name HD* )(resid 28 and name HA ) 1.8 0.0 4.7 !4D assign (resid 37 and name HE* )(resid 28 and name HA ) 1.8 0.0 5.2 !4D assign (resid 37 and name HE* )(resid 58 and name HG* ) 1.8 0.0 7.0 !8 assign (resid 39 and name HB )(resid 39 and name HA ) 1.8 0.0 1.7 !4D assign (resid 39 and name HB )(resid 39 and name HG1* ) 1.8 0.0 4.7 !4D assign (resid 39 and name HB )(resid 39 and name HG2* ) 1.8 0.0 4.7 !4D assign (resid 39 and name HB )(resid 23 and name HB* ) 1.8 0.0 4.7 !4D assign (resid 39 and name HB )(resid 26 and name HD* ) 1.8 0.0 4.7 !4D assign (resid 39 and name HA )(resid 39 and name HG1* ) 1.8 0.0 4.7 !4d assign (resid 39 and name HA )(resid 39 and name HG2* ) 1.8 0.0 4.7 !4d assign (resid 39 and name HG1* )(resid 9 and name HD2* ) 1.8 0.0 6.7 !4d assign (resid 39 and name HG1* )(resid 9 and name HD1* ) 1.8 0.0 7.7 !4d assign (resid 39 and name HG1* )(resid 40 and name HA ) 1.8 0.0 4.7 !4d assign (resid 39 and name HG1* )(resid 48 and name HG2* ) 1.8 0.0 6.2 !4d assign (resid 39 and name HG1* )(resid 48 and name HB ) 1.8 0.0 5.2 !4d assign (resid 39 and name HG1* )(resid 38 and name HA ) 1.8 0.0 5.2 !4d assign (resid 39 and name HG1* )(resid 75 and name HB* ) 1.8 0.0 6.2 !4D assign (resid 39 and name HG2* )(resid 25 and name HA ) 1.8 0.0 4.7 !3d 10% assign (resid 39 and name HG2* )(resid 38 and name HA ) 1.8 0.0 4.7 !4d assign (resid 39 and name HG2* )(resid 37 and name HA ) 1.8 0.0 4.7 !4d assign (resid 39 and name HG2* )(resid 37 and name HB1 ) 1.8 0.0 5.7 !3d 10% assign (resid 39 and name HG2* )(resid 37 and name HB2 ) 1.8 0.0 5.7 !3d 10% assign (resid 39 and name HG2* )(resid 37 and name HD* ) 1.8 0.0 5.7 !4d assign (resid 41 and name HA )(resid 41 and name HB1 ) 1.8 0.0 2.7 !4d assign (resid 41 and name HA )(resid 41 and name HB2 ) 1.8 0.0 2.7 !4d assign (resid 41 and name HE3 )(resid 41 and name HA ) 1.8 0.0 4.2 !4d assign (resid 41 and name HH2 )(resid 72 and name HA ) 1.8 0.0 4.7 !4d assign (resid 41 and name HH2 )(resid 75 and name HB* ) 1.8 0.0 4.2 !4d assign (resid 41 and name HZ2 )(resid 72 and name HA ) 1.8 0.0 4.2 !4d assign (resid 41 and name HZ2 )(resid 75 and name HB* ) 1.8 0.0 4.7 assign (resid 41 and name HZ2 )(resid 75 and name HB* ) 1.8 0.0 4.2 assign (resid 41 and name HZ2 )(resid 39 and name HG1* ) 1.8 0.0 4.7 assign (resid 41 and name HD1 )(resid 41 and name HB1 ) 1.8 0.0 4.2 !4D assign (resid 41 and name HD1 )(resid 41 and name HB2 ) 1.8 0.0 4.0 !4d assign (resid 41 and name HD1 )(resid 39 and name HG1* ) 1.8 0.0 4.7 !4D assign (resid 41 and name HD1 )(resid 48 and name HG2* ) 1.8 0.0 4.2 !4D assign (resid 41 and name HD1 )(resid 72 and name HB* ) 2.5 0.0 4.7 !4D assign (resid 42 and name HB1 )(resid 42 and name HD1* ) 1.8 0.0 4.2 !4D assign (resid 42 and name HB2 )(resid 42 and name HD1* ) 1.8 0.0 4.2 !4D assign (resid 42 and name HG )(resid 42 and name HD2* ) 1.8 0.0 4.7 !4D assign (resid 42 and name HG )(resid 42 and name HD1* ) 1.8 0.0 4.7 !4D assign (resid 42 and name HD1* )(resid 43 and name HG1* ) 2.0 0.0 6.2 !4D assign (resid 42 and name HD1* )(resid 43 and name HG2* ) 1.8 0.0 5.2 !4D assign (resid 42 and name HD2* )(resid 43 and name HG1* ) 2.5 0.0 6.2 !4D assign (resid 42 and name HD2* )(resid 43 and name HG2* ) 2.5 0.0 6.2 !4D assign (resid 42 and name HD1* )(resid 43 and name HA ) 1.8 0.0 6.2 !4D assign (resid 42 and name HD2* )(resid 43 and name HA ) 1.8 0.0 6.2 !4D assign (resid 43 and name HB )(resid 65 and name HA ) 1.8 0.0 5.2 !4D assign (resid 43 and name HB )(resid 43 and name HA ) 1.8 0.0 1.7 !4D assign (resid 43 and name HB )(resid 43 and name HG1* ) 1.8 0.0 3.9 !4D assign (resid 43 and name HB )(resid 43 and name HG2* ) 1.8 0.0 3.9 !4D assign (resid 43 and name HG1* )(resid 44 and name HA ) 1.8 0.0 4.7 !4D assign (resid 43 and name HG1* )(resid 65 and name HA ) 1.8 0.0 3.7 !4D assign (resid 43 and name HG1* )(resid 65 and name HB* ) 1.8 0.0 5.2 !3d 10% and 4d assign (resid 43 and name HG2* )(resid 65 and name HA ) 1.8 0.0 4.7 !4D assign (resid 43 and name HG2* )(resid 65 and name HB* ) 1.8 0.0 6.2 !4D assign (resid 44 and name HA )(resid 44 and name HB1 ) 1.8 0.0 2.7 !4d assign (resid 46 and name HA )(resid 46 and name HB2 ) 1.8 0.0 2.7 !4d assign (resid 46 and name HA )(resid 46 and name HB1 ) 1.8 0.0 2.7 !4d assign (resid 44 and name HA )(resid 44 and name HB2 ) 1.8 0.0 2.7 !4d assign (resid 47 and name HG1 )(resid 47 and name HA ) 1.8 0.0 2.7 !4D assign (resid 47 and name HG2 )(resid 47 and name HA ) 1.8 0.0 2.7 !4D assign (resid 47 and name HG1 )(resid 47 and name HB* ) 1.8 0.0 3.7 !4D assign (resid 47 and name HG2 )(resid 47 and name HB* ) 1.8 0.0 3.7 !4D assign (resid 47 and name HA )(resid 47 and name HB* ) 1.8 0.0 2.7 !4d assign (resid 47 and name HA )(resid 39 and name HG1* ) 1.8 0.0 4.7 !4d assign (resid 47 and name HA )(resid 48 and name HG2* ) 1.8 0.0 4.7 !4D assign (resid 47 and name HA )(resid 40 and name HA ) 1.8 0.0 1.2 !3d 10 shorten aa assign (resid 47 and name HA )(resid 40 and name HG* ) 1.8 0.0 4.2 !4D assign (resid 47 and name HG1 )(resid 40 and name HA ) 1.8 0.0 4.2 !4D assign (resid 47 and name HG2 )(resid 40 and name HA ) 1.8 0.0 4.2 !4D assign (resid 48 and name HB )(resid 48 and name HA ) 1.8 0.0 1.7 !4D assign (resid 48 and name HB )(resid 38 and name HG* ) 1.8 0.0 6.2 !4D assign (resid 48 and name HG2* )(resid 72 and name HB* ) 1.8 0.0 6.2 !4D assign (resid 49 and name HA )(resid 38 and name HA ) 1.8 0.0 1.2 !3d shorten aa assign (resid 49 and name HA )(resid 39 and name HG1 ) 1.8 0.0 4.7 !4D assign (resid 49 and name HB )(resid 49 and name HA ) 1.8 0.0 1.7 !4D assign (resid 49 and name HB )(resid 49 and name HG2* ) 1.8 0.0 3.2 !4D assign (resid 51 and name HA )(resid 51 and name HB1 ) 1.8 0.0 2.7 !4d assign (resid 51 and name HA )(resid 51 and name HB2 ) 1.8 0.0 2.7 !4d assign (resid 51 and name HE* )(resid 49 and name HB ) 1.8 0.0 4.7 !4D assign (resid 51 and name HE* )(resid 49 and name HG2* ) 1.8 0.0 5.7 !4D assign (resid 51 and name HE* )(resid 36 and name HD* ) 1.8 0.0 5.2 !4D assign (resid 51 and name HD* )(resid 36 and name HD* ) 1.8 0.0 6.2 !4D assign (resid 51 and name HE* )(resid 36 and name HG* ) 1.8 0.0 5.2 !4D assign (resid 51 and name HD* )(resid 36 and name HG* ) 1.8 0.0 6.2 !4D assign (resid 51 and name HD* )(resid 49 and name HG2* ) 1.8 0.0 5.7 !4D assign (resid 52 and name HA )(resid 50 and name HG* ) 1.8 0.0 5.0 !3d C13ny assign (resid 52 and name HA )(resid 52 and name HB1 ) 1.8 0.0 2.7 !3d c13ny assign (resid 52 and name HA )(resid 52 and name HB2 ) 1.8 0.0 2.7 !3d c13ny assign (resid 52 and name HA )(resid 52 and name HB1 ) 1.8 0.0 2.7 !4d assign (resid 52 and name HA )(resid 52 and name HB2 ) 1.8 0.0 2.7 !4d assign (resid 52 and name HA )(resid 56 and name HB* ) 1.8 0.0 4.7 !4D assign (resid 52 and name HG1 )(resid 1 and name HE* ) 1.8 0.0 5.7 !4d assign (resid 52 and name HD1 )(resid 52 and name HG1 ) 1.8 0.0 3.7 !4d assign (resid 52 and name HD1 )(resid 52 and name HG2 ) 1.8 0.0 3.7 assign (resid 52 and name HD2 )(resid 52 and name HG1 ) 1.8 0.0 3.7 assign (resid 52 and name HD2 )(resid 52 and name HG2 ) 1.8 0.0 3.7 assign (resid 54 and name HA )(resid 54 and name HB1 ) 1.8 0.0 2.7 !3d assign (resid 54 and name HA )(resid 54 and name HB2 ) 1.8 0.0 2.7 !3d assign (resid 55 and name HA )(resid 55 and name HB1 ) 1.8 0.0 2.7 !4d assign (resid 55 and name HA )(resid 55 and name HB2 ) 1.8 0.0 2.7 !4d assign (resid 56 and name HA )(resid 11 and name HA ) 1.8 0.0 1.2 !4D shorten 10 AA assign (resid 56 and name HA )(resid 56 and name HB* ) 1.8 0.0 3.5 !4D assign (resid 56 and name HB* )(resid 9 and name HG ) 1.8 0.0 4.7 !4D assign (resid 56 and name HB* )(resid 9 and name HD2* ) 1.8 0.0 5.6 !4D assign (resid 56 and name HB* )(resid 11 and name HA ) 1.8 0.0 4.7 !4d assign (resid 56 and name HB* )(resid 52 and name HB1 ) 1.8 0.0 5.2 !4d assign (resid 56 and name HB* )(resid 52 and name HB2 ) 1.8 0.0 5.2 !4d assign (resid 56 and name HB* )(resid 52 and name HG1 ) 1.8 0.0 6.7 !4d assign (resid 56 and name HB* )(resid 52 and name HG2 ) 1.8 0.0 6.7 !4d assign (resid 57 and name HB )(resid 57 and name HA ) 1.8 0.0 1.7 !4D assign (resid 57 and name HB )(resid 57 and name HG1* ) 1.8 0.0 4.1 !4D assign (resid 57 and name HB )(resid 57 and name HG2* ) 1.8 0.0 4.1 !4D assign (resid 57 and name HG2* )(resid 56 and name HA ) 1.8 0.0 5.6 !4D from 56HA assign (resid 57 and name HG1* )(resid 56 and name HA ) 1.8 0.0 5.6 !4D from 56HA assign (resid 58 and name HA )(resid 9 and name HA ) 1.8 0.0 1.7 !3d C13ny aa 4 (3.2) assign (resid 58 and name HA )(resid 58 and name HB ) 1.8 0.0 1.7 !4d assign (resid 58 and name HA )(resid 58 and name HG* ) 1.8 0.0 5.6 !4D assign (resid 58 and name HB )(resid 58 and name HG* ) 1.8 0.0 5.6 !4d assign (resid 59 and name HB )(resid 59 and name HA ) 1.8 0.0 1.7 !4D assign (resid 59 and name HB )(resid 59 and name HG1* ) 1.8 0.0 3.2 !4D assign (resid 59 and name HB )(resid 59 and name HG1* ) 1.8 0.0 3.2 !4D assign (resid 59 and name HA )(resid 60 and name HG2* ) 1.8 0.0 4.7 !4D assign (resid 59 and name HB )(resid 60 and name HG2* ) 1.8 0.0 4.7 !4D assign (resid 59 and name HB )(resid 64 and name HB1 ) 1.8 0.0 4.2 !3d c13ny assign (resid 59 and name HB )(resid 64 and name HB2 ) 1.8 0.0 4.2 !3d c13ny assign (resid 59 and name HB )(resid 63 and name HB* ) 1.8 0.0 4.7 !4D assign (resid 59 and name HG1* )(resid 10 and name HA ) 1.8 0.0 5.2 !4D assign (resid 59 and name HG1* )(resid 58 and name HA ) 1.8 0.0 4.7 !4D assign (resid 59 and name HG1* )(resid 64 and name HA ) 1.8 0.0 4.7 !4D assign (resid 59 and name HG1* )(resid 63 and name HB* ) 1.8 0.0 5.7 !4D assign (resid 59 and name HG1* )(resid 63 and name HG* ) 1.8 0.0 6.7 !4D assign (resid 59 and name HG1* )(resid 64 and name HB1 ) 1.8 0.0 5.7 !4D assign (resid 59 and name HG1* )(resid 64 and name HB2 ) 1.8 0.0 5.7 !4D assign (resid 59 and name HG2* )(resid 64 and name HB1 ) 1.8 0.0 5.1 !3d 10% assign (resid 59 and name HG2* )(resid 64 and name HB2 ) 1.8 0.0 5.1 !3d 10% assign (resid 59 and name HG2* )(resid 63 and name HB* ) 1.8 0.0 4.7 !4D assign (resid 59 and name HG2* )(resid 63 and name HG* ) 1.8 0.0 5.7 !4D assign (resid 59 and name HG2* )(resid 64 and name HA ) 1.8 0.0 4.2 !4D assign (resid 60 and name HB )(resid 60 and name HA ) 1.8 0.0 1.7 !4D assign (resid 60 and name HB )(resid 60 and name HG2* ) 1.8 0.0 4.7 !4D assign (resid 60 and name HA )(resid 61 and name HB* ) 1.8 0.0 4.7 !3d c13ny assign (resid 60 and name HB )(resid 61 and name HB* ) 1.8 0.0 4.7 !3d c13ny assign (resid 60 and name HB )(resid 63 and name HG* ) 1.8 0.0 4.2 !4D assign (resid 60 and name HG2* )(resid 63 and name HG* ) 1.8 0.0 5.5 assign (resid 60 and name HG2* )(resid 63 and name HB* ) 1.8 0.0 5.7 assign (resid 61 and name HB* )(resid 62 and name HA ) 1.8 0.0 3.7 assign (resid 61 and name HB* )(resid 62 and name HB ) 1.8 0.0 4.7 assign (resid 61 and name HB* )(resid 62 and name HG2* ) 1.8 0.0 6.2 assign (resid 62 and name HA )(resid 62 and name HB ) 1.8 0.0 1.7 !4D assign (resid 62 and name HA )(resid 62 and name HG2* ) 1.8 0.0 4.7 !4D assign (resid 62 and name HB )(resid 62 and name HG2* ) 1.8 0.0 3.7 assign (resid 62 and name HA )(resid 65 and name HB* ) 1.8 0.0 4.2 !3d c13ny assign (resid 62 and name HB )(resid 65 and name HB* ) 1.8 0.0 4.7 assign (resid 63 and name HA )(resid 63 and name HB* ) 1.8 0.0 3.7 !4D assign (resid 63 and name HA )(resid 63 and name HG* ) 1.8 0.0 4.7 assign (resid 65 and name HB* )(resid 65 and name HA ) 1.8 0.0 3.2 !4D assign (resid 65 and name HB* )(resid 66 and name HG2* ) 1.8 0.0 6.2 !4D assign (resid 65 and name HB* )(resid 43 and name HB ) 1.8 0.0 5.2 !4D assign (resid 66 and name HA )(resid 66 and name HB1 ) 1.8 0.0 2.7 !3d c13ny assign (resid 64 and name HB1 )(resid 64 and name HA ) 1.8 0.0 2.7 !4d assign (resid 64 and name HB2 )(resid 64 and name HA ) 1.8 0.0 2.7 !4d assign (resid 66 and name HA )(resid 66 and name HB2 ) 1.8 0.0 2.7 !3d c13ny assign (resid 66 and name HA )(resid 66 and name HG* ) 1.8 0.0 4.7 !3d c13ny assign (resid 66 and name HG* )(resid 66 and name HB* ) 1.8 0.0 3.7 assign (resid 66 and name HA )(resid 69 and name HB1 ) 1.8 0.0 4.2 assign (resid 66 and name HA )(resid 69 and name HB2 ) 1.8 0.0 4.2 assign (resid 66 and name HA )(resid 69 and name HG* ) 1.8 0.0 4.2 assign (resid 66 and name HA )(resid 69 and name HD1 ) 1.8 0.0 4.7 assign (resid 66 and name HA )(resid 69 and name HD2 ) 1.8 0.0 4.7 assign (resid 66 and name HA )(resid 69 and name HE* ) 1.8 0.0 5.7 assign (resid 66 and name HG* )(resid 62 and name HG2* ) 1.8 0.0 5.7 assign (resid 66 and name HG* )(resid 62 and name HB ) 1.8 0.0 4.2 assign (resid 66 and name HG* )(resid 62 and name HA ) 1.8 0.0 4.2 assign (resid 67 and name HB* )(resid 67 and name HA ) 1.8 0.0 3.2 assign (resid 67 and name HB* )(resid 64 and name HA ) 1.8 0.0 4.2 assign (resid 68 and name HA )(resid 68 and name HB1 ) 1.8 0.0 2.7 assign (resid 68 and name HA )(resid 68 and name HB2 ) 1.8 0.0 2.7 assign (resid 68 and name HA )(resid 68 and name HG1 ) 1.8 0.0 3.2 assign (resid 68 and name HA )(resid 68 and name HG2 ) 1.8 0.0 3.2 assign (resid 68 and name HA )(resid 71 and name HB* ) 1.8 0.0 4.7 !3d c13ny assign (resid 69 and name HA )(resid 69 and name HB1 ) 1.8 0.0 2.7 assign (resid 69 and name HA )(resid 69 and name HB2 ) 1.8 0.0 2.7 assign (resid 69 and name HA )(resid 69 and name HG* ) 1.8 0.0 4.2 assign (resid 69 and name HA )(resid 69 and name HD1 ) 1.8 0.0 3.2 assign (resid 69 and name HA )(resid 69 and name HD2 ) 1.8 0.0 3.2 assign (resid 69 and name HA )(resid 69 and name HB1 ) 1.8 0.0 2.7 !3d c13ny assign (resid 69 and name HA )(resid 69 and name HB2 ) 1.8 0.0 2.7 !3d c13ny assign (resid 69 and name HE1 )(resid 69 and name HD1 ) 1.8 0.0 2.7 !3d c13ny assign (resid 69 and name HE1 )(resid 69 and name HD2 ) 1.8 0.0 2.7 !3d c13ny assign (resid 69 and name HE2 )(resid 69 and name HD1 ) 1.8 0.0 2.7 !3d c13ny assign (resid 69 and name HE2 )(resid 69 and name HD2 ) 1.8 0.0 2.7 !3d c13ny assign (resid 69 and name HA )(resid 72 and name HB* ) 1.8 0.0 4.2 !3d c13ny assign (resid 70 and name HA )(resid 70 and name HB1 ) 1.8 0.0 2.7 !3d c13ny assign (resid 70 and name HA )(resid 70 and name HB2 ) 1.8 0.0 2.7 !3d c13ny assign (resid 70 and name HA )(resid 70 and name HG1 ) 1.8 0.0 3.7 !3d c13ny assign (resid 70 and name HA )(resid 70 and name HG2 ) 1.8 0.0 3.7 assign (resid 70 and name HA )(resid 70 and name HD1 ) 1.8 0.0 4.7 !3d c13ny assign (resid 70 and name HA )(resid 70 and name HD2 ) 1.8 0.0 4.7 !3d c13ny assign (resid 70 and name HA )(resid 73 and name HB* ) 1.8 0.0 4.7 assign (resid 71 and name HB* )(resid 71 and name HA ) 1.8 0.0 3.2 !4d assign (resid 71 and name HB* )(resid 72 and name HB* ) 1.8 0.0 6.2 !4d assign (resid 71 and name HB* )(resid 74 and name HB* ) 1.8 0.0 5.7 !4d assign (resid 72 and name HA )(resid 72 and name HB* ) 1.8 0.0 3.2 !4D assign (resid 72 and name HB* )(resid 73 and name HB* ) 1.8 0.0 6.2 !3d c13ny assign (resid 72 and name HA )(resid 75 and name HB* ) 1.8 0.0 4.7 !3d c13ny assign (resid 73 and name HB* )(resid 70 and name HB1 ) 1.8 0.0 5.5 !3d c13ny assign (resid 73 and name HB* )(resid 70 and name HB2 ) 1.8 0.0 5.7 !3d c13ny assign (resid 74 and name HA )(resid 77 and name HB* ) 1.8 0.0 4.2 !3d c13ny assign (resid 74 and name HA )(resid 74 and name HB* ) 1.8 0.0 2.7 assign (resid 74 and name HA )(resid 74 and name HG* ) 1.8 0.0 3.2 assign (resid 74 and name HA )(resid 74 and name HD1 ) 1.8 0.0 4.2 !4d assign (resid 74 and name HA )(resid 74 and name HD2 ) 1.8 0.0 4.2 !4d assign (resid 74 and name HG* )(resid 74 and name HB* ) 1.8 0.0 3.7 !3d c13ny assign (resid 74 and name HG* )(resid 74 and name HD1 ) 1.8 0.0 3.7 !3d c13ny assign (resid 74 and name HG* )(resid 74 and name HD2 ) 1.8 0.0 3.7 !3d c13ny assign (resid 75 and name HB* )(resid 9 and name HD2* ) 1.8 0.0 5.6 !4D assign (resid 75 and name HB* )(resid 9 and name HD1* ) 1.8 0.0 6.6 !4D assign (resid 75 and name HB* )(resid 72 and name HB* ) 1.8 0.0 6.2 !4D assign (resid 77 and name HB* )(resid 77 and name HD2 ) 1.8 0.0 4.2 assign (resid 77 and name HA )(resid 77 and name HB* ) 1.8 0.0 2.7 assign (resid 78 and name HB* )(resid 77 and name HA ) 1.8 0.0 4.7 assign (resid 78 and name HA )(resid 78 and name HB* ) 1.8 0.0 3.2 !4d assign (resid 79 and name HA )(resid 79 and name HB* ) 1.8 0.0 3.2 !Long range introduced at #17 file assign (resid 75 and name HB* )(resid 50 and name HB ) 1.8 0.0 4.7 !17L assign (resid 52 and name HA )(resid 75 and name HA ) 1.8 0.0 3.2 !17L assign (resid 52 and name HA )(resid 75 and name HB* ) 1.8 0.0 4.7 !17L assign (resid 51 and name HD* )(resid 79 and name HB* ) 1.8 0.0 6.7 !17L assign (resid 51 and name HE* )(resid 79 and name HB* ) 1.8 0.0 6.7 !17L assign (resid 76 and name HN )(resid 50 and name HG* ) 1.8 0.0 5.6 !17L assign (resid 76 and name HA1 )(resid 50 and name HG* ) 1.8 0.0 6.6 !17L assign (resid 76 and name HA2 )(resid 50 and name HG* ) 1.8 0.0 6.6 !17L assign (resid 76 and name HA1 )(resid 50 and name HA ) 1.8 0.0 4.7 !17L assign (resid 76 and name HA2 )(resid 50 and name HA ) 1.8 0.0 4.7 !17L assign (resid 52 and name HD1 )(resid 50 and name HG* ) 1.8 0.0 6.6 !17 assign (resid 52 and name HD2 )(resid 50 and name HG* ) 1.8 0.0 6.6 !17 assign (resid 52 and name HD1 )(resid 51 and name HA ) 1.8 0.0 3.2 !17 assign (resid 52 and name HD2 )(resid 51 and name HA ) 1.8 0.0 3.2 !17 assign (resid 52 and name HD1 )(resid 52 and name HG1 ) 1.8 0.0 3.7 !17 assign (resid 52 and name HD1 )(resid 52 and name HG2 ) 1.8 0.0 3.7 assign (resid 52 and name HD2 )(resid 52 and name HG1 ) 1.8 0.0 3.7 assign (resid 52 and name HD2 )(resid 52 and name HG2 ) 1.8 0.0 3.7 assign (resid 39 and name HG1* )(resid 50 and name HB ) 1.8 0.0 4.7 !17
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