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 |
|
|
2447 |
1bxp   |
4195 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
!A LIST OF ALL NMR CONSTRAINTS USED TO CALCULATE THE THREE-DIMENSIONAL SOLUTION !STRUCTURE OF THE COMPLEX OF a-BUNGAROTOXIN WITH A LIBRARY-DERIVED PEPTIDE. !THESE CONSTRAINTS CONSISTED OF 941 INTRAMOLECULAR !CONSTRAINTS WITHIN THE BOUND TOXIN (INCLUDING 291 LONG-RANGE !INTERACTIONS), 98 INTRAPEPTIDE INTERACTIONS (INCLUDING 7 LONG- !RANGE INTERACTIONS), AND 62 INTERMOLECULAR CONSTRAINTS BETWEEN !THE BUNGAROTOXIN AND THE 13-RESIDUE PEPTIDE USED IN THIS !STUDY (LISTED HERE AS RESIDUES 75 - 87). !NOE DISTANCE CONSTRAINTS assign (resid 1 and name HA )(resid 1 and name HD1# ) 4.0 2.2 1.0 assign (resid 1 and name HA )(resid 1 and name HG1# ) 4.0 2.2 1.0 assign (resid 1 and name HA )(resid 1 and name HG2# ) 4.0 2.2 1.0 assign (resid 1 and name HA )(resid 1 and name HB ) 3.0 1.2 0.5 assign (resid 1 and name HB )(resid 1 and name HD1# ) 4.0 2.2 1.0 assign (resid 1 and name HB )(resid 1 and name HG1# ) 4.0 2.2 1.0 assign (resid 1 and name HB )(resid 1 and name HG2# ) 4.0 2.2 1.0 assign (resid 1 and name HD1# )(resid 2 and name HN ) 4.0 1.2 1.0 assign (resid 1 and name HG1# )(resid 2 and name HN ) 3.0 1.2 1.0 assign (resid 1 and name HG2# )(resid 2 and name HN ) 4.0 2.2 1.0 assign (resid 1 and name HA )(resid 2 and name HN ) 3.0 1.2 0.5 assign (resid 1 and name HB )(resid 2 and name HA ) 4.0 2.2 1.0 assign (resid 1 and name HB )(resid 2 and name HN ) 3.0 1.2 0.5 assign (resid 1 and name HD1# )(resid 22 and name HN ) 4.0 2.2 1.0 assign (resid 1 and name HD1# )(resid 62 and name HN ) 4.0 2.2 1.0 assign (resid 1 and name HD1# )(resid 62 and name HA ) 4.0 2.2 1.0 assign (resid 2 and name HG1# )(resid 2 and name HN ) 4.0 2.2 1.0 assign (resid 2 and name HG2# )(resid 2 and name HN ) 3.0 1.2 1.0 assign (resid 2 and name HA )(resid 2 and name HG1# ) 2.5 0.7 0.7 assign (resid 2 and name HA )(resid 2 and name HG2# ) 2.5 0.7 0.7 assign (resid 2 and name HA )(resid 2 and name HB ) 4.0 2.2 1.0 assign (resid 2 and name HA )(resid 2 and name HN ) 4.0 2.2 1.0 assign (resid 2 and name HB )(resid 2 and name HG1# ) 4.0 2.2 1.0 assign (resid 2 and name HB )(resid 2 and name HG2# ) 4.0 2.2 1.0 assign (resid 2 and name HB )(resid 2 and name HN ) 3.0 1.2 0.5 assign (resid 2 and name HG1# )(resid 3 and name HN ) 3.0 1.2 1.0 assign (resid 2 and name HG2# )(resid 3 and name HN ) 3.0 1.2 1.0 assign (resid 2 and name HA )(resid 3 and name HA ) 4.0 2.2 1.0 assign (resid 2 and name HA )(resid 3 and name HN ) 2.5 0.7 0.2 assign (resid 2 and name HB )(resid 3 and name HN ) 3.0 1.2 0.5 assign (resid 2 and name HG1# )(resid 14 and name HN ) 4.0 2.2 1.0 assign (resid 2 and name HA )(resid 15 and name HA ) 3.0 1.2 0.5 assign (resid 2 and name HG# )(resid 15 and name HG2# ) 4.0 2.2 1.5 assign (resid 2 and name HG# )(resid 15 and name HN ) 4.0 2.2 1.0 assign (resid 2 and name HG1# )(resid 16 and name HN ) 4.0 2.2 1.0 assign (resid 2 and name HG2# )(resid 16 and name HN ) 4.0 2.2 1.0 assign (resid 2 and name HA )(resid 16 and name HN ) 3.0 1.2 0.5 assign (resid 2 and name HN )(resid 64 and name HN ) 4.0 2.2 1.0 assign (resid 2 and name HG1# )(resid 64 and name HN ) 4.0 2.2 1.0 assign (resid 2 and name HG2# )(resid 64 and name HN ) 4.0 2.2 1.0 assign (resid 3 and name HN )(resid 3 and name HA ) 3.0 1.2 0.5 assign (resid 3 and name HN )(resid 3 and name HB1 ) 3.0 1.2 0.5 assign (resid 3 and name HN )(resid 3 and name HB2 ) 3.0 1.2 0.5 assign (resid 3 and name HA )(resid 4 and name HN ) 3.0 1.2 0.5 assign (resid 3 and name HB1 )(resid 4 and name HN ) 3.0 1.2 0.5 assign (resid 3 and name HB2 )(resid 4 and name HN ) 3.0 1.2 0.5 assign (resid 3 and name HN )(resid 4 and name HN ) 4.0 2.2 1.0 assign (resid 3 and name HN )(resid 14 and name HN ) 4.0 2.2 1.0 assign (resid 3 and name HN )(resid 14 and name O ) 2.1 0.6 0.2 assign (resid 3 and name N )(resid 14 and name O ) 3.1 0.6 0.2 assign (resid 3 and name HN )(resid 15 and name HG2# ) 4.0 2.2 1.0 assign (resid 3 and name HN )(resid 15 and name HA ) 4.0 2.2 1.0 assign (resid 3 and name CB )(resid 23 and name SG ) 3.0 0.1 0.1 assign (resid 3 and name HB1 )(resid 23 and name HA ) 4.0 2.2 1.0 assign (resid 3 and name HB2 )(resid 23 and name HA ) 4.0 2.2 1.0 assign (resid 3 and name SG )(resid 23 and name CB ) 3.0 0.1 0.1 assign (resid 3 and name SG )(resid 23 and name SG ) 2.0 0.1 0.1 assign (resid 3 and name HB2 )(resid 44 and name HA ) 4.0 2.2 1.0 assign (resid 3 and name HB2 )(resid 44 and name HA ) 4.0 2.2 1.0 assign (resid 3 and name HA )(resid 64 and name HA ) 4.0 2.2 1.0 assign (resid 3 and name HA )(resid 64 and name HN ) 4.0 2.2 1.0 assign (resid 3 and name HB1 )(resid 66 and name HD21 ) 4.0 2.2 1.0 assign (resid 3 and name HB1 )(resid 66 and name HD22 ) 4.0 2.2 1.0 assign (resid 4 and name HN )(resid 4 and name HA ) 3.0 1.2 0.5 assign (resid 4 and name HA )(resid 4 and name HB2 ) 2.5 0.7 0.2 assign (resid 4 and name HA )(resid 4 and name HB1 ) 3.0 1.2 0.5 assign (resid 4 and name HN )(resid 4 and name HB1 ) 3.0 1.2 0.5 assign (resid 4 and name HN )(resid 4 and name HB2 ) 3.0 1.2 0.5 assign (resid 4 and name HN )(resid 4 and name HD2 ) 3.0 1.2 0.5 assign (resid 4 and name HA )(resid 5 and name HN ) 3.0 1.2 0.5 assign (resid 4 and name HB1 )(resid 5 and name HN ) 3.0 1.2 0.5 assign (resid 4 and name HB2 )(resid 5 and name HN ) 3.0 1.2 0.5 assign (resid 4 and name HN )(resid 5 and name HN ) 4.0 2.2 1.0 assign (resid 4 and name HA )(resid 11 and name HD1# ) 4.0 2.2 1.5 assign (resid 4 and name HA )(resid 11 and name HG1# ) 4.0 2.2 1.0 assign (resid 4 and name HA )(resid 11 and name HG2# ) 4.0 2.2 1.5 assign (resid 4 and name HA )(resid 13 and name HA ) 4.0 2.2 1.0 assign (resid 4 and name HD2 )(resid 13 and name HB# ) 4.0 2.2 1.0 assign (resid 4 and name HB1 )(resid 13 and name HA ) 4.0 2.2 1.0 assign (resid 4 and name HB2 )(resid 13 and name HA ) 4.0 2.2 1.0 assign (resid 4 and name HB1 )(resid 13 and name HA ) 4.0 2.2 1.0 ! assign (resid 4 and name HB2 )(resid 13 and name HA ) 4.0 2.2 1.0 assign (resid 4 and name HA )(resid 14 and name HN ) 4.0 2.2 1.0 assign (resid 4 and name HN )(resid 24 and name HN ) 4.0 2.2 1.0 assign (resid 4 and name HD2 )(resid 42 and name HD# ) 4.0 2.2 1.5 assign (resid 4 and name HN )(resid 42 and name HD1# ) 4.0 2.2 1.5 assign (resid 4 and name HN )(resid 42 and name HD2# ) 4.0 2.2 1.5 assign (resid 4 and name HD2 )(resid 64 and name HA ) 4.0 2.2 1.0 assign (resid 4 and name HE1 )(resid 64 and name HB# ) 4.0 2.2 1.0 assign (resid 4 and name HN )(resid 64 and name HA ) 4.0 2.2 1.0 assign (resid 4 and name HD2 )(resid 65 and name HN ) 4.0 2.2 1.0 assign (resid 4 and name HD2 )(resid 66 and name HN ) 4.0 2.2 1.0 assign (resid 4 and name HN )(resid 66 and name HD21 ) 4.0 2.2 1.0 assign (resid 4 and name HN )(resid 66 and name HD22 ) 4.0 2.2 1.0 assign (resid 4 and name HD2 )(resid 67 and name HA ) 4.0 2.2 1.0 assign (resid 4 and name HD2 )(resid 68 and name HN ) 4.0 2.2 1.0 assign (resid 4 and name HD2 )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 5 and name HG2# )(resid 5 and name HA ) 3.0 1.2 1.0 assign (resid 5 and name HG2# )(resid 5 and name HN ) 3.0 1.2 1.0 assign (resid 5 and name HG1 )(resid 5 and name HN ) 3.0 1.2 0.5 assign (resid 5 and name HA )(resid 5 and name HB ) 2.5 0.7 0.2 assign (resid 5 and name HA )(resid 5 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HB )(resid 5 and name HN ) 3.0 1.2 0.5 assign (resid 5 and name HG2# )(resid 6 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HG2# )(resid 6 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HA )(resid 6 and name HN ) 3.0 1.2 0.5 assign (resid 5 and name HA )(resid 6 and name HG2# ) 4.0 2.2 1.0 assign (resid 5 and name HB )(resid 6 and name HG1 ) 4.0 2.2 1.0 assign (resid 5 and name HA )(resid 6 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HB )(resid 6 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HB )(resid 6 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HG2# )(resid 7 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HA )(resid 7 and name HB# ) 3.0 1.2 1.0 assign (resid 5 and name HA )(resid 7 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HB )(resid 7 and name HN ) 3.0 1.2 0.5 assign (resid 5 and name HG1 )(resid 7 and name HB# ) 4.0 2.2 1.0 assign (resid 5 and name HG1 )(resid 7 and name HA ) 4.0 2.2 1.0 assign (resid 5 and name HG2# )(resid 8 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HN )(resid 11 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HG2# )(resid 12 and name HN ) 3.0 1.2 1.0 assign (resid 5 and name HN )(resid 12 and name O ) 2.1 0.6 0.2 assign (resid 5 and name N )(resid 12 and name O ) 3.1 0.6 0.2 assign (resid 5 and name HN )(resid 12 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HN )(resid 13 and name HB# ) 4.0 2.2 1.0 assign (resid 5 and name HN )(resid 13 and name HA ) 4.0 2.2 1.0 assign (resid 5 and name HG2# )(resid 14 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HA )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 5 and name HA )(resid 43 and name HA1 ) 3.0 1.2 0.5 assign (resid 5 and name HA )(resid 43 and name HA2 ) 3.0 1.2 0.5 assign (resid 6 and name HA )(resid 6 and name HB ) 3.0 1.2 0.5 assign (resid 6 and name HG2# )(resid 6 and name HA ) 3.0 1.2 1.0 assign (resid 6 and name HG2# )(resid 6 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HG1 )(resid 6 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 7 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 7 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HG1 )(resid 7 and name HB# ) 4.0 2.2 1.0 assign (resid 6 and name HG1 )(resid 7 and name HA ) 4.0 2.2 1.0 assign (resid 6 and name HN )(resid 7 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HN )(resid 7 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HG1 )(resid 7 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 11 and name HD1# ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 11 and name HG1# ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 11 and name HG2# ) 4.0 2.2 1.0 assign (resid 6 and name HA )(resid 11 and name HD1# ) 4.0 2.2 1.0 assign (resid 6 and name HA )(resid 11 and name HG2# ) 4.0 2.2 1.0 assign (resid 6 and name HA )(resid 11 and name HA ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 12 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 41 and name HA ) 3.0 1.2 1.0 assign (resid 6 and name HB )(resid 41 and name HA ) 4.0 2.2 1.0 assign (resid 6 and name HB )(resid 41 and name HB1 ) 4.0 2.2 1.0 assign (resid 6 and name HB )(resid 41 and name HB2 ) 4.0 2.2 1.0 assign (resid 6 and name HG1 )(resid 41 and name HA ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 41 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HA )(resid 41 and name HA ) 4.0 2.2 1.0 assign (resid 6 and name HG1 )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HB )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HN )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 6 and name HG2# )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 7 and name HB# )(resid 7 and name HN ) 4.0 2.2 1.0 assign (resid 7 and name HA )(resid 7 and name HN ) 3.0 1.2 0.5 assign (resid 7 and name HB# )(resid 8 and name HN ) 3.0 1.2 0.5 assign (resid 7 and name HB# )(resid 8 and name HN ) 4.0 2.2 1.0 assign (resid 7 and name HA )(resid 8 and name HN ) 4.0 2.2 1.0 assign (resid 7 and name HN )(resid 8 and name HN ) 3.0 1.2 0.5 assign (resid 7 and name HB# )(resid 28 and name HE1 ) 4.0 2.2 1.0 assign (resid 8 and name HA )(resid 8 and name HB ) 4.0 2.2 1.0 assign (resid 8 and name HA )(resid 8 and name HN ) 4.0 2.2 1.0 assign (resid 8 and name HG2# )(resid 9 and name HN ) 4.0 2.2 1.0 assign (resid 8 and name HA )(resid 9 and name HN ) 3.0 1.2 0.5 assign (resid 8 and name HB )(resid 9 and name HN ) 3.0 1.2 0.5 assign (resid 8 and name HN )(resid 9 and name HN ) 4.0 2.2 1.0 assign (resid 9 and name HA )(resid 9 and name HN ) 4.0 2.2 1.0 assign (resid 9 and name HB1 )(resid 9 and name HN ) 4.0 2.2 1.0 assign (resid 9 and name HB2 )(resid 9 and name HN ) 4.0 2.2 1.0 assign (resid 10 and name HA )(resid 10 and name HB1 ) 4.0 2.2 1.0 assign (resid 10 and name HA )(resid 10 and name HB2 ) 4.0 2.2 1.0 assign (resid 10 and name HG1 )(resid 10 and name HD1 ) 4.0 2.2 1.0 assign (resid 10 and name HG1 )(resid 10 and name HD2 ) 4.0 2.2 1.0 assign (resid 10 and name HG2 )(resid 10 and name HD1 ) 4.0 2.2 1.0 assign (resid 10 and name HG2 )(resid 10 and name HD2 ) 4.0 2.2 1.0 assign (resid 10 and name HB1 )(resid 10 and name HD1 ) 4.0 2.2 1.0 assign (resid 10 and name HB1 )(resid 10 and name HD2 ) 4.0 2.2 1.0 assign (resid 10 and name HB2 )(resid 10 and name HD1 ) 4.0 2.2 1.0 assign (resid 10 and name HB2 )(resid 10 and name HD2 ) 4.0 2.2 1.0 assign (resid 10 and name HG# )(resid 11 and name HN ) 4.0 2.2 1.0 assign (resid 10 and name HA )(resid 11 and name HN ) 3.0 1.2 0.5 assign (resid 10 and name HB1 )(resid 11 and name HN ) 3.0 1.2 0.5 assign (resid 10 and name HB2 )(resid 11 and name HN ) 3.0 1.2 0.5 assign (resid 11 and name HG1# )(resid 11 and name HD1# ) 4.0 2.2 1.0 assign (resid 11 and name HG1# )(resid 11 and name HG2# ) 4.0 2.2 1.0 assign (resid 11 and name HG1# )(resid 11 and name HN ) 4.0 2.2 1.0 assign (resid 11 and name HG2# )(resid 11 and name HN ) 4.0 2.2 1.0 assign (resid 11 and name HA )(resid 11 and name HD1# ) 4.0 2.2 1.0 assign (resid 11 and name HA )(resid 11 and name HG1# ) 4.0 2.2 1.0 assign (resid 11 and name HA )(resid 11 and name HG2# ) 4.0 2.2 1.0 assign (resid 11 and name HA )(resid 11 and name HB ) 4.0 2.2 1.0 assign (resid 11 and name HA )(resid 11 and name HN ) 3.0 1.2 0.5 assign (resid 11 and name HB )(resid 11 and name HD1# ) 4.0 2.2 1.0 assign (resid 11 and name HB )(resid 11 and name HG2# ) 4.0 2.2 1.0 assign (resid 11 and name HB )(resid 11 and name HN ) 2.5 0.7 0.2 assign (resid 11 and name HD1# )(resid 12 and name HN ) 4.0 2.2 1.0 assign (resid 11 and name HG1# )(resid 12 and name HN ) 2.5 0.7 0.7 assign (resid 11 and name HG2# )(resid 12 and name HN ) 4.0 2.2 1.0 assign (resid 11 and name HA )(resid 12 and name HN ) 3.0 1.2 0.5 assign (resid 11 and name HB )(resid 12 and name HN ) 4.0 2.2 1.0 assign (resid 11 and name HN )(resid 12 and name HN ) 4.0 2.2 1.0 assign (resid 11 and name HD1# )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 11 and name HD1# )(resid 68 and name HN ) 4.0 2.2 1.0 assign (resid 11 and name HD1# )(resid 68 and name HB# ) 4.0 2.2 1.0 assign (resid 11 and name HG2# )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 11 and name HD1# )(resid 71 and name HE21 ) 4.0 2.2 1.0 assign (resid 11 and name HD1# )(resid 71 and name HE22 ) 4.0 2.2 1.0 assign (resid 12 and name HB# )(resid 12 and name HN ) 3.0 1.2 0.5 assign (resid 12 and name HA )(resid 12 and name HB1 ) 2.5 0.7 0.2 assign (resid 12 and name HA )(resid 12 and name HB2 ) 2.5 0.7 0.2 assign (resid 12 and name HA )(resid 12 and name HN ) 4.0 2.2 1.0 assign (resid 12 and name HB# )(resid 13 and name HN ) 3.0 1.2 0.5 assign (resid 12 and name HA )(resid 13 and name HN ) 3.0 1.2 0.5 assign (resid 12 and name HN )(resid 13 and name HN ) 4.0 2.2 1.0 assign (resid 12 and name HN )(resid 13 and name HA ) 4.0 2.2 1.0 assign (resid 13 and name HB# )(resid 13 and name HN ) 3.0 1.2 0.5 assign (resid 13 and name HA )(resid 13 and name HB# ) 2.5 0.7 0.2 assign (resid 13 and name HA )(resid 13 and name HN ) 4.0 2.2 1.0 assign (resid 13 and name HB# )(resid 14 and name HN ) 3.0 1.2 0.5 assign (resid 13 and name HA )(resid 14 and name HN ) 2.5 0.7 0.2 assign (resid 13 and name HN )(resid 14 and name HN ) 4.0 2.2 1.0 assign (resid 13 and name HB# )(resid 15 and name HN ) 4.0 2.2 1.0 assign (resid 14 and name HG# )(resid 14 and name HN ) 3.0 1.2 1.0 assign (resid 14 and name HA )(resid 14 and name HG1# ) 4.0 2.2 1.0 assign (resid 14 and name HA )(resid 14 and name HG2# ) 4.0 2.2 1.0 assign (resid 14 and name HA )(resid 14 and name HB ) 3.0 1.2 0.5 assign (resid 14 and name HA )(resid 14 and name HN ) 4.0 2.2 1.0 assign (resid 14 and name HB )(resid 14 and name HN ) 4.0 2.2 1.0 assign (resid 14 and name HG# )(resid 15 and name HA ) 3.0 1.2 1.0 assign (resid 14 and name HG# )(resid 15 and name HB ) 3.0 1.2 1.0 assign (resid 14 and name HG# )(resid 15 and name HA ) 4.0 2.2 1.0 assign (resid 14 and name HG1# )(resid 15 and name HN ) 3.0 1.2 1.0 assign (resid 14 and name HG2# )(resid 15 and name HN ) 3.0 1.2 1.0 assign (resid 14 and name HA )(resid 15 and name HN ) 3.0 1.2 0.5 assign (resid 14 and name HB )(resid 15 and name HN ) 3.0 1.2 0.5 assign (resid 14 and name HN )(resid 15 and name HN ) 4.0 2.2 1.0 assign (resid 15 and name HG2# )(resid 15 and name HN ) 3.0 1.2 1.0 assign (resid 15 and name HA )(resid 15 and name HG2# ) 4.0 2.2 1.0 assign (resid 15 and name HA )(resid 15 and name HB ) 4.0 2.2 1.0 assign (resid 15 and name HA )(resid 15 and name HN ) 4.0 2.2 1.0 assign (resid 15 and name HG2# )(resid 16 and name HN ) 4.0 2.2 1.0 assign (resid 15 and name HA )(resid 16 and name HN ) 3.0 1.2 0.5 assign (resid 15 and name HB )(resid 16 and name HN ) 4.0 2.2 1.0 assign (resid 15 and name HN )(resid 16 and name HN ) 4.0 2.2 1.0 assign (resid 16 and name HA )(resid 16 and name HN ) 4.0 2.2 1.0 assign (resid 16 and name HB1 )(resid 16 and name HN ) 3.0 1.2 0.5 assign (resid 16 and name HB2 )(resid 16 and name HN ) 3.0 1.2 0.5 assign (resid 16 and name HA )(resid 17 and name HD1 ) 3.0 1.2 0.5 assign (resid 16 and name HA )(resid 17 and name HD2 ) 3.0 1.2 0.5 assign (resid 16 and name HB1 )(resid 17 and name HD# ) 4.0 2.2 1.0 assign (resid 16 and name HB2 )(resid 17 and name HD# ) 4.0 2.2 1.0 assign (resid 16 and name CB )(resid 44 and name SG ) 3.0 0.1 0.1 assign (resid 16 and name SG )(resid 44 and name CB ) 3.0 0.1 0.1 assign (resid 16 and name SG )(resid 44 and name SG ) 2.0 0.1 0.1 assign (resid 17 and name HA )(resid 17 and name HB1 ) 4.0 2.2 1.0 assign (resid 17 and name HA )(resid 17 and name HB2 ) 4.0 2.2 1.0 assign (resid 17 and name HA )(resid 18 and name HD1 ) 4.0 2.2 1.0 assign (resid 17 and name HA )(resid 18 and name HD2 ) 4.0 2.2 1.0 assign (resid 18 and name HG# )(resid 18 and name HD1 ) 4.0 2.2 1.0 assign (resid 18 and name HG# )(resid 18 and name HD2 ) 4.0 2.2 1.0 assign (resid 18 and name HB# )(resid 19 and name HN ) 4.0 2.2 1.0 assign (resid 18 and name HA )(resid 19 and name HN ) 3.0 1.2 0.5 assign (resid 19 and name HA1 )(resid 19 and name HN ) 3.0 1.2 0.5 assign (resid 19 and name HA2 )(resid 19 and name HN ) 3.0 1.2 0.5 assign (resid 19 and name HA1 )(resid 20 and name HN ) 4.0 2.2 1.0 assign (resid 19 and name HA2 )(resid 20 and name HN ) 4.0 2.2 1.0 assign (resid 19 and name HN )(resid 20 and name HB# ) 4.0 2.2 1.0 assign (resid 19 and name HN )(resid 20 and name HN ) 4.0 2.2 1.0 assign (resid 19 and name HA1 )(resid 21 and name HD21 ) 4.0 2.2 1.0 assign (resid 19 and name HA2 )(resid 21 and name HD21 ) 4.0 2.2 1.0 assign (resid 19 and name HA1 )(resid 21 and name HD22 ) 4.0 2.2 1.0 assign (resid 19 and name HA2 )(resid 21 and name HD22 ) 4.0 2.2 1.0 assign (resid 20 and name HB# )(resid 20 and name HN ) 3.0 1.2 0.5 assign (resid 20 and name HG# )(resid 20 and name HN ) 4.0 2.2 1.0 assign (resid 20 and name HA )(resid 20 and name HN ) 3.0 1.2 0.5 assign (resid 20 and name HB# )(resid 21 and name HN ) 4.0 2.2 1.0 assign (resid 20 and name HG# )(resid 21 and name HN ) 4.0 2.2 1.0 assign (resid 20 and name HA )(resid 21 and name HN ) 3.0 1.2 0.5 assign (resid 20 and name HN )(resid 21 and name HN ) 4.0 2.2 1.0 assign (resid 20 and name HA )(resid 22 and name HN ) 4.0 2.2 1.0 assign (resid 20 and name HN )(resid 45 and name HA ) 4.0 2.2 1.0 assign (resid 20 and name HN )(resid 45 and name HN ) 4.0 2.2 1.0 assign (resid 20 and name HB# )(resid 46 and name HA ) 4.0 2.2 1.0 assign (resid 20 and name HG# )(resid 46 and name HA ) 3.0 1.2 0.5 assign (resid 20 and name HA )(resid 46 and name HA ) 3.0 1.2 0.5 assign (resid 20 and name HN )(resid 46 and name HB# ) 4.0 2.2 1.0 assign (resid 20 and name HN )(resid 46 and name HA ) 4.0 2.2 1.0 assign (resid 21 and name HA )(resid 21 and name HN ) 3.0 1.2 0.5 assign (resid 21 and name HB1 )(resid 21 and name HN ) 3.0 1.2 0.5 assign (resid 21 and name HB2 )(resid 21 and name HN ) 3.0 1.2 0.5 assign (resid 21 and name HB1 )(resid 21 and name HD21 ) 3.0 1.2 0.5 assign (resid 21 and name HB2 )(resid 21 and name HD21 ) 3.0 1.2 0.5 assign (resid 21 and name HB1 )(resid 21 and name HD22 ) 4.0 2.2 1.0 assign (resid 21 and name HB2 )(resid 21 and name HD22 ) 4.0 2.2 1.0 assign (resid 21 and name HB# )(resid 22 and name HD1# ) 4.0 2.2 1.0 assign (resid 21 and name HB# )(resid 22 and name HD2# ) 4.0 2.2 1.0 assign (resid 21 and name HA )(resid 22 and name HN ) 3.0 1.2 0.5 assign (resid 21 and name HB1 )(resid 22 and name HN ) 4.0 2.2 1.0 assign (resid 21 and name HB2 )(resid 22 and name HN ) 4.0 2.2 1.0 assign (resid 21 and name HN )(resid 22 and name HN ) 3.0 1.2 0.5 assign (resid 21 and name HN )(resid 45 and name HB# ) 4.0 2.2 1.0 assign (resid 21 and name HN )(resid 45 and name HN ) 4.0 2.2 1.0 assign (resid 21 and name HN )(resid 46 and name HB# ) 4.0 2.2 1.0 assign (resid 21 and name HN )(resid 46 and name HA ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 22 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HD2# )(resid 22 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HA )(resid 22 and name HN ) 3.0 1.2 0.5 assign (resid 22 and name HB# )(resid 22 and name HN ) 3.0 1.2 0.5 assign (resid 22 and name HG )(resid 22 and name HN ) 3.0 1.2 0.5 assign (resid 22 and name HD1# )(resid 23 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HD2# )(resid 23 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HA )(resid 23 and name HA ) 4.0 2.2 1.0 assign (resid 22 and name HA )(resid 23 and name HN ) 3.0 1.2 0.5 assign (resid 22 and name HN )(resid 23 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 25 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HN )(resid 44 and name HA ) 4.0 2.2 1.0 assign (resid 22 and name HB# )(resid 45 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 45 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HN )(resid 45 and name HB# ) 4.0 2.2 1.0 assign (resid 22 and name HD# )(resid 45 and name HB# ) 4.0 2.2 2.0 assign (resid 22 and name HD# )(resid 45 and name HA ) 4.0 2.2 1.5 assign (resid 22 and name HN )(resid 45 and name HN ) 3.0 1.2 0.5 assign (resid 22 and name HN )(resid 45 and name O ) 2.1 0.6 0.2 assign (resid 22 and name N )(resid 45 and name O ) 3.1 0.6 0.2 assign (resid 22 and name O )(resid 45 and name HN ) 2.1 0.6 0.2 assign (resid 22 and name O )(resid 45 and name N ) 3.1 0.6 0.2 assign (resid 22 and name HN )(resid 46 and name HA ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 47 and name HA ) 3.0 1.2 1.0 assign (resid 22 and name HD2# )(resid 47 and name HA ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 47 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 48 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HD2# )(resid 48 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 59 and name HB1 ) 4.0 2.2 1.0 assign (resid 22 and name HD2# )(resid 59 and name HB1 ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 59 and name HB2 ) 4.0 2.2 1.0 assign (resid 22 and name HD2# )(resid 59 and name HB2 ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 59 and name HA ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 60 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HD2# )(resid 60 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HB1 )(resid 60 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HB2 )(resid 60 and name HN ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 61 and name HA ) 3.0 1.2 1.0 assign (resid 22 and name HD2# )(resid 61 and name HA ) 4.0 2.2 1.0 assign (resid 22 and name HD1# )(resid 61 and name HB# ) 4.0 2.2 1.0 assign (resid 22 and name HD2# )(resid 61 and name HB# ) 4.0 2.2 1.0 assign (resid 23 and name HA )(resid 23 and name HB1 ) 3.0 1.2 0.5 assign (resid 23 and name HA )(resid 23 and name HB2 ) 3.0 1.2 0.5 assign (resid 23 and name HA )(resid 23 and name HN ) 3.0 1.2 0.5 assign (resid 23 and name HB1 )(resid 23 and name HN ) 3.0 1.2 0.5 assign (resid 23 and name HB2 )(resid 23 and name HN ) 3.0 1.2 0.5 assign (resid 23 and name HA )(resid 24 and name HD# ) 3.0 1.2 0.5 assign (resid 23 and name HA )(resid 24 and name HN ) 3.0 1.2 0.5 assign (resid 23 and name HN )(resid 24 and name HN ) 4.0 2.2 1.0 assign (resid 23 and name HB1 )(resid 24 and name HN ) 3.0 1.2 0.5 assign (resid 23 and name HB2 )(resid 24 and name HN ) 3.0 1.2 0.5 assign (resid 23 and name HB1 )(resid 43 and name HN ) 4.0 2.2 1.0 assign (resid 23 and name HB2 )(resid 43 and name HN ) 4.0 2.2 1.0 assign (resid 23 and name HA )(resid 43 and name HN ) 4.0 2.2 1.0 assign (resid 23 and name HA )(resid 44 and name HA ) 2.5 0.7 0.2 assign (resid 23 and name HA )(resid 45 and name HN ) 3.0 1.4 0.5 assign (resid 23 and name HB2 )(resid 60 and name HN ) 4.0 2.2 1.0 assign (resid 23 and name HN )(resid 60 and name HN ) 3.0 1.2 0.5 assign (resid 23 and name HN )(resid 60 and name O ) 2.1 0.6 0.2 assign (resid 23 and name N )(resid 60 and name O ) 3.1 0.6 0.2 assign (resid 23 and name O )(resid 60 and name HN ) 2.1 0.6 0.2 assign (resid 23 and name O )(resid 60 and name N ) 3.1 0.6 0.2 assign (resid 23 and name HN )(resid 61 and name HA ) 4.0 2.2 1.0 assign (resid 23 and name HB1 )(resid 66 and name HA ) 4.0 2.2 1.0 assign (resid 23 and name HB2 )(resid 66 and name HA ) 4.0 2.2 1.0 assign (resid 23 and name HB1 )(resid 66 and name HD2# ) 4.0 2.2 1.0 assign (resid 23 and name HB2 )(resid 66 and name HD2# ) 4.0 2.2 1.0 assign (resid 24 and name HA )(resid 24 and name HD# ) 3.0 1.2 0.5 assign (resid 24 and name HA )(resid 24 and name HB1 ) 3.0 1.2 0.5 assign (resid 24 and name HA )(resid 24 and name HB2 ) 3.0 1.2 0.5 assign (resid 24 and name HA )(resid 24 and name HN ) 2.5 0.7 0.2 assign (resid 24 and name HB1 )(resid 24 and name HD# ) 3.0 1.2 0.5 assign (resid 24 and name HB1 )(resid 24 and name HE# ) 4.0 2.2 1.0 assign (resid 24 and name HB1 )(resid 24 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HB2 )(resid 24 and name HD# ) 3.0 1.2 0.5 assign (resid 24 and name HB2 )(resid 24 and name HE# ) 4.0 2.2 1.0 assign (resid 24 and name HB2 )(resid 24 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HN )(resid 24 and name HD# ) 4.0 2.2 1.0 assign (resid 24 and name HN )(resid 24 and name HE# ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 25 and name HA ) 3.0 1.2 0.5 assign (resid 24 and name HD# )(resid 25 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HA )(resid 25 and name HN ) 3.0 1.2 0.5 assign (resid 24 and name HB1 )(resid 25 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HB2 )(resid 25 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 26 and name HG# ) 3.0 1.2 0.5 assign (resid 24 and name HD# )(resid 26 and name HA ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 26 and name HB2 ) 3.0 1.2 0.5 assign (resid 24 and name HD# )(resid 26 and name HB1 ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 26 and name HN ) 3.0 1.2 0.5 assign (resid 24 and name HE# )(resid 26 and name HG# ) 3.0 1.2 0.5 assign (resid 24 and name HE# )(resid 26 and name HA ) 4.0 2.2 1.0 assign (resid 24 and name HE# )(resid 26 and name HB1 ) 3.0 1.2 0.5 assign (resid 24 and name HE# )(resid 26 and name HB2 ) 3.0 1.2 0.5 assign (resid 24 and name HE# )(resid 26 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 42 and name HA ) 4.0 2.2 1.0 assign (resid 24 and name HE# )(resid 42 and name HA ) 4.0 2.2 1.0 assign (resid 24 and name HE# )(resid 43 and name HA# ) 4.0 2.2 1.0 assign (resid 24 and name HB1 )(resid 43 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HB2 )(resid 43 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HN )(resid 43 and name HN ) 3.0 1.2 0.5 assign (resid 24 and name HN )(resid 43 and name O ) 2.1 0.6 0.2 assign (resid 24 and name N )(resid 43 and name O ) 3.1 0.6 0.2 assign (resid 24 and name O )(resid 43 and name HN ) 2.1 0.6 0.2 assign (resid 24 and name O )(resid 43 and name N ) 3.1 0.6 0.2 assign (resid 24 and name HD# )(resid 44 and name HA ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 44 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HE# )(resid 44 and name HA ) 4.0 2.2 1.0 assign (resid 24 and name HE# )(resid 44 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HN )(resid 44 and name HA ) 3.0 1.2 0.5 assign (resid 24 and name HD# )(resid 45 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HN )(resid 45 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HB# )(resid 45 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 45 and name HB# ) 3.0 1.2 1.0 assign (resid 24 and name HE# )(resid 45 and name HB# ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 49 and name HD1 ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 49 and name HD2 ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 57 and name HG1# ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 57 and name HG2# ) 4.0 2.2 1.0 assign (resid 24 and name HA )(resid 58 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HB1 )(resid 58 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HD# )(resid 58 and name HN ) 4.0 2.2 1.0 assign (resid 24 and name HB# )(resid 59 and name HA ) 3.0 1.2 0.5 assign (resid 24 and name HA )(resid 59 and name HB1 ) 4.0 2.2 1.0 assign (resid 24 and name HA )(resid 59 and name HA ) 2.5 0.7 0.2 assign (resid 24 and name HA )(resid 60 and name HN ) 3.0 1.2 0.5 assign (resid 24 and name HN )(resid 66 and name HD21 ) 4.0 2.2 1.0 assign (resid 24 and name HN )(resid 66 and name HD22 ) 4.0 2.2 1.0 assign (resid 25 and name HB# )(resid 25 and name HN ) 4.0 2.2 1.0 assign (resid 25 and name HB# )(resid 25 and name HA ) 3.0 1.2 0.5 assign (resid 25 and name HG1 )(resid 25 and name HA ) 3.0 1.2 0.5 assign (resid 25 and name HG2 )(resid 25 and name HA ) 3.0 1.2 0.5 assign (resid 25 and name HG# )(resid 25 and name HN ) 4.0 2.2 1.0 assign (resid 25 and name HA )(resid 25 and name HN ) 4.0 2.2 1.0 assign (resid 25 and name HB# )(resid 26 and name HN ) 4.0 2.2 1.0 assign (resid 25 and name HA )(resid 26 and name HA ) 4.0 2.2 1.0 assign (resid 25 and name HA )(resid 26 and name HN ) 3.0 1.2 0.5 assign (resid 25 and name HN )(resid 26 and name HN ) 4.0 2.2 1.0 assign (resid 25 and name HA )(resid 42 and name HA ) 2.5 0.7 0.2 assign (resid 25 and name HA )(resid 42 and name HD2# ) 2.5 0.7 0.7 assign (resid 25 and name HA )(resid 43 and name HN ) 3.0 1.2 0.5 assign (resid 25 and name HN )(resid 58 and name HN ) 3.0 1.2 0.5 assign (resid 25 and name HN )(resid 58 and name O ) 2.1 0.6 0.2 assign (resid 25 and name N )(resid 58 and name O ) 3.1 0.6 0.2 assign (resid 25 and name HN )(resid 59 and name HA ) 3.0 1.2 0.5 assign (resid 26 and name HE# )(resid 26 and name HN ) 4.0 2.2 1.0 assign (resid 26 and name HG# )(resid 26 and name HN ) 4.0 2.2 1.0 assign (resid 26 and name HA )(resid 26 and name HN ) 3.0 1.2 0.5 assign (resid 26 and name HB1 )(resid 26 and name HN ) 3.0 1.2 0.5 assign (resid 26 and name HB2 )(resid 26 and name HN ) 4.0 2.2 1.0 assign (resid 26 and name HB1 )(resid 26 and name HA ) 3.0 1.2 0.5 assign (resid 26 and name HB2 )(resid 26 and name HA ) 3.0 1.2 0.5 assign (resid 26 and name HG# )(resid 27 and name HA ) 4.0 2.2 1.0 assign (resid 26 and name HG# )(resid 27 and name HN ) 3.0 1.2 0.5 assign (resid 26 and name HA )(resid 27 and name HA ) 4.0 2.2 1.0 assign (resid 26 and name HA )(resid 27 and name HN ) 3.0 1.2 0.5 assign (resid 26 and name HB1 )(resid 27 and name HN ) 4.0 2.2 1.0 assign (resid 26 and name HB2 )(resid 27 and name HN ) 4.0 2.2 1.0 assign (resid 26 and name HN )(resid 27 and name HA ) 4.0 2.2 1.0 assign (resid 26 and name HN )(resid 27 and name HN ) 4.0 2.2 1.0 assign (resid 26 and name HB1 )(resid 28 and name HE3 ) 4.0 2.2 1.0 assign (resid 26 and name HB2 )(resid 28 and name HE3 ) 4.0 2.2 1.0 assign (resid 26 and name HN )(resid 40 and name HA ) 4.0 2.2 1.0 assign (resid 26 and name HN )(resid 41 and name HB2 ) 4.0 2.2 1.0 assign (resid 26 and name HN )(resid 41 and name HN ) 3.0 1.2 0.5 assign (resid 26 and name HN )(resid 41 and name O ) 2.1 0.6 0.2 assign (resid 26 and name N )(resid 41 and name O ) 3.1 0.6 0.2 assign (resid 26 and name O )(resid 41 and name HN ) 2.1 0.6 0.2 assign (resid 26 and name O )(resid 41 and name N ) 3.1 0.6 0.2 assign (resid 26 and name HN )(resid 42 and name HA ) 3.0 1.2 0.5 assign (resid 26 and name HA )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 26 and name HA )(resid 57 and name HG1# ) 4.0 2.2 1.0 assign (resid 26 and name HA )(resid 57 and name HG2# ) 4.0 2.2 1.0 assign (resid 26 and name HA )(resid 57 and name HA ) 2.5 0.7 0.2 assign (resid 26 and name HA )(resid 58 and name HN ) 3.0 1.2 0.5 assign (resid 27 and name HG# )(resid 27 and name HN ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 27 and name HB1 ) 3.0 1.2 0.5 assign (resid 27 and name HA )(resid 27 and name HB2 ) 3.0 1.2 0.5 assign (resid 27 and name HA )(resid 27 and name HG1 ) 3.0 1.2 0.5 assign (resid 27 and name HA )(resid 27 and name HG2 ) 3.0 1.2 0.5 assign (resid 27 and name HA )(resid 27 and name HN ) 3.0 1.2 0.5 assign (resid 27 and name HB1 )(resid 27 and name HN ) 3.0 1.2 0.5 assign (resid 27 and name HB2 )(resid 27 and name HN ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 28 and name HB1 ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 28 and name HB2 ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 28 and name HA ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 28 and name HD1 ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 28 and name HN ) 3.0 1.2 0.5 assign (resid 27 and name HB1 )(resid 28 and name HN ) 4.0 2.2 1.0 assign (resid 27 and name HB2 )(resid 28 and name HN ) 4.0 2.2 1.0 assign (resid 27 and name HG1 )(resid 28 and name HN ) 4.0 2.2 1.0 assign (resid 27 and name HG2 )(resid 28 and name HN ) 4.0 2.2 1.0 assign (resid 27 and name HN )(resid 28 and name HN ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 38 and name HB1 ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 38 and name HB2 ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 38 and name HG# ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 39 and name HG# ) 4.0 2.2 1.5 assign (resid 27 and name HA )(resid 39 and name HB ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 40 and name HG1# ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 40 and name HG2# ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 40 and name HA ) 3.0 1.2 0.5 assign (resid 27 and name HG1 )(resid 40 and name HA ) 3.0 1.2 0.5 assign (resid 27 and name HG1 )(resid 40 and name HG2# ) 4.0 2.2 1.0 assign (resid 27 and name HG2 )(resid 40 and name HA ) 3.0 1.2 0.5 assign (resid 27 and name HG2 )(resid 40 and name HG2# ) 4.0 2.2 1.0 assign (resid 27 and name HA )(resid 41 and name HN ) 3.0 1.2 0.5 assign (resid 27 and name HN )(resid 41 and name HB2 ) 4.0 2.2 1.0 assign (resid 27 and name HN )(resid 56 and name HN ) 3.0 1.2 0.5 assign (resid 27 and name HN )(resid 57 and name HG1# ) 4.0 2.2 1.0 assign (resid 27 and name HN )(resid 57 and name HG2# ) 4.0 2.2 1.0 assign (resid 27 and name HN )(resid 57 and name HA ) 3.0 1.2 0.5 assign (resid 28 and name HA )(resid 28 and name HB1 ) 2.5 0.7 0.2 assign (resid 28 and name HA )(resid 28 and name HB2 ) 2.5 0.7 0.2 assign (resid 28 and name HA )(resid 28 and name HN ) 4.0 2.2 1.0 assign (resid 28 and name HB1 )(resid 28 and name HN ) 4.0 2.2 1.0 assign (resid 28 and name HB2 )(resid 28 and name HN ) 4.0 2.2 1.0 assign (resid 28 and name HD1 )(resid 28 and name HA ) 4.0 2.2 1.0 assign (resid 28 and name HE3 )(resid 28 and name HN ) 4.0 2.2 1.0 assign (resid 28 and name HA )(resid 29 and name HA ) 4.0 2.2 1.0 assign (resid 28 and name HA )(resid 29 and name HN ) 3.0 1.2 0.5 assign (resid 28 and name HB1 )(resid 29 and name HN ) 3.0 1.2 0.5 assign (resid 28 and name HB2 )(resid 29 and name HN ) 3.0 1.2 0.5 assign (resid 28 and name HD1 )(resid 29 and name HN ) 4.0 2.2 1.0 assign (resid 28 and name HE3 )(resid 29 and name HN ) 4.0 2.2 1.0 assign (resid 28 and name HN )(resid 29 and name HN ) 4.0 2.2 1.0 assign (resid 28 and name HE1 )(resid 30 and name HA ) 4.0 2.2 1.0 assign (resid 28 and name HE1 )(resid 30 and name HB# ) 4.0 2.2 1.0 assign (resid 28 and name HN )(resid 38 and name HB2 ) 4.0 2.2 1.0 assign (resid 28 and name HN )(resid 38 and name HG# ) 4.0 2.2 1.0 assign (resid 28 and name HN )(resid 38 and name HA ) 4.0 2.2 1.0 assign (resid 28 and name HD1 )(resid 39 and name HG1# ) 4.0 2.2 1.0 assign (resid 28 and name HD1 )(resid 39 and name HG2# ) 4.0 2.2 1.0 assign (resid 28 and name HD1 )(resid 39 and name HB ) 4.0 2.2 1.0 assign (resid 28 and name HE1 )(resid 39 and name HG1# ) 4.0 2.2 1.0 assign (resid 28 and name HE1 )(resid 39 and name HG2# ) 4.0 2.2 1.0 assign (resid 28 and name HE1 )(resid 39 and name HB ) 4.0 2.2 1.0 assign (resid 28 and name HN )(resid 39 and name HG# ) 4.0 2.2 1.0 assign (resid 28 and name HN )(resid 39 and name HB ) 4.0 2.2 1.0 assign (resid 28 and name HZ2 )(resid 39 and name HG1# ) 4.0 2.2 1.0 assign (resid 28 and name HZ2 )(resid 39 and name HG2# ) 4.0 2.2 1.0 assign (resid 28 and name HZ2 )(resid 39 and name HB ) 4.0 2.2 1.0 assign (resid 28 and name HN )(resid 39 and name HN ) 4.0 2.2 1.0 assign (resid 28 and name HZ3 )(resid 41 and name HB2 ) 4.0 2.2 1.0 assign (resid 28 and name HE1 )(resid 41 and name HB1 ) 4.0 2.2 1.0 assign (resid 28 and name HE1 )(resid 41 and name HB2 ) 4.0 2.2 1.0 assign (resid 28 and name HB1 )(resid 55 and name HA ) 4.0 2.2 1.0 assign (resid 28 and name HB2 )(resid 55 and name HA ) 4.0 2.2 1.0 assign (resid 28 and name HA )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 29 and name HA )(resid 29 and name HN ) 4.0 2.2 1.0 assign (resid 29 and name HB1 )(resid 29 and name HA ) 3.0 1.2 0.5 assign (resid 29 and name HB2 )(resid 29 and name HA ) 3.0 1.2 0.5 assign (resid 29 and name HB1 )(resid 29 and name HN ) 3.0 1.2 0.5 assign (resid 29 and name HB2 )(resid 29 and name HN ) 3.0 1.2 0.5 assign (resid 29 and name HB1 )(resid 30 and name HN ) 4.0 2.2 1.0 assign (resid 29 and name HB2 )(resid 30 and name HN ) 4.0 2.2 1.0 assign (resid 29 and name HA )(resid 30 and name HA ) 4.0 2.2 1.0 assign (resid 29 and name HA )(resid 30 and name HN ) 3.0 1.2 0.5 assign (resid 29 and name CB )(resid 33 and name SG ) 3.0 0.1 0.1 assign (resid 29 and name HA )(resid 33 and name HB# ) 4.0 2.2 1.0 assign (resid 29 and name SG )(resid 33 and name CB ) 3.0 0.1 0.1 assign (resid 29 and name SG )(resid 33 and name SG ) 2.0 0.1 0.1 assign (resid 29 and name HA )(resid 34 and name HN ) 4.0 2.2 1.0 assign (resid 29 and name HA )(resid 38 and name HA ) 3.0 1.2 0.5 assign (resid 29 and name HA )(resid 38 and name HN ) 4.0 2.2 1.0 assign (resid 29 and name HB1 )(resid 38 and name HA ) 4.0 2.2 1.0 assign (resid 29 and name HB2 )(resid 38 and name HA ) 4.0 2.2 1.0 assign (resid 29 and name HN )(resid 38 and name HB2 ) 4.0 2.2 1.0 assign (resid 29 and name HN )(resid 38 and name HG# ) 4.0 2.2 1.0 assign (resid 29 and name HA )(resid 39 and name HG# ) 3.0 1.2 1.0 assign (resid 29 and name HA )(resid 39 and name HN ) 4.0 2.2 1.0 assign (resid 30 and name HA )(resid 30 and name HB1 ) 3.0 1.2 0.5 assign (resid 30 and name HA )(resid 30 and name HB2 ) 3.0 1.2 0.5 assign (resid 30 and name HA )(resid 30 and name HN ) 4.0 2.2 1.0 assign (resid 30 and name HB1 )(resid 30 and name HN ) 4.0 2.2 1.0 assign (resid 30 and name HB2 )(resid 30 and name HN ) 4.0 2.2 1.0 assign (resid 30 and name HA )(resid 31 and name HN ) 4.0 2.2 1.0 assign (resid 30 and name HB1 )(resid 31 and name HN ) 4.0 2.2 1.0 assign (resid 30 and name HB2 )(resid 31 and name HN ) 4.0 2.2 1.0 assign (resid 30 and name HN )(resid 33 and name HB# ) 4.0 2.2 1.0 assign (resid 30 and name HN )(resid 34 and name HN ) 4.0 2.2 1.0 assign (resid 30 and name HN )(resid 38 and name HA ) 4.0 2.2 1.0 assign (resid 30 and name HA )(resid 39 and name HG# ) 4.0 2.2 1.0 assign (resid 30 and name HB1 )(resid 39 and name HG# ) 4.0 2.2 1.0 assign (resid 30 and name HB2 )(resid 39 and name HG# ) 4.0 2.2 1.0 assign (resid 30 and name HN )(resid 39 and name HG# ) 4.0 2.2 1.0 assign (resid 30 and name HN )(resid 39 and name HN ) 4.0 2.2 1.0 assign (resid 31 and name HB# )(resid 31 and name HN ) 4.0 2.2 1.0 assign (resid 31 and name HA )(resid 31 and name HN ) 3.0 1.2 0.5 assign (resid 31 and name HB# )(resid 32 and name HD# ) 4.0 2.2 1.0 assign (resid 31 and name HB# )(resid 32 and name HE# ) 4.0 2.2 1.0 assign (resid 31 and name HB# )(resid 32 and name HN ) 4.0 2.2 1.0 assign (resid 31 and name HA )(resid 32 and name HN ) 4.0 2.2 1.0 assign (resid 31 and name HN )(resid 32 and name HN ) 4.0 2.2 1.0 assign (resid 32 and name HB1 )(resid 32 and name HN ) 4.0 2.2 1.0 assign (resid 32 and name HB2 )(resid 32 and name HN ) 4.0 2.2 1.0 assign (resid 32 and name HN )(resid 34 and name HN ) 4.0 2.2 1.0 assign (resid 33 and name HA )(resid 33 and name HB1 ) 4.0 2.2 1.0 assign (resid 33 and name HA )(resid 33 and name HB2 ) 4.0 2.2 1.0 assign (resid 34 and name HA )(resid 34 and name HN ) 4.0 2.2 1.0 assign (resid 34 and name HB1 )(resid 34 and name HA ) 4.0 2.2 1.0 assign (resid 34 and name HB1 )(resid 34 and name HN ) 4.0 2.2 1.0 assign (resid 34 and name HB2 )(resid 34 and name HA ) 4.0 2.2 1.0 assign (resid 34 and name HB2 )(resid 34 and name HN ) 4.0 2.2 1.0 assign (resid 34 and name HN )(resid 36 and name HN ) 4.0 2.2 1.0 assign (resid 34 and name HN )(resid 37 and name HN ) 4.0 2.2 1.0 assign (resid 35 and name HA )(resid 35 and name HN ) 4.0 2.2 1.0 assign (resid 35 and name HB1 )(resid 35 and name HA ) 4.0 2.2 1.0 assign (resid 35 and name HB1 )(resid 35 and name HN ) 4.0 2.2 1.0 assign (resid 35 and name HB2 )(resid 35 and name HA ) 4.0 2.2 1.0 assign (resid 35 and name HB2 )(resid 35 and name HN ) 4.0 2.2 1.0 assign (resid 35 and name HB# )(resid 36 and name HN ) 4.0 2.2 1.0 assign (resid 35 and name HA )(resid 36 and name HN ) 4.0 2.2 1.0 assign (resid 35 and name HN )(resid 36 and name HN ) 4.0 2.2 1.0 assign (resid 36 and name HB1 )(resid 36 and name HN ) 4.0 2.2 1.0 assign (resid 36 and name HB2 )(resid 36 and name HN ) 3.0 1.2 0.5 assign (resid 36 and name HG# )(resid 36 and name HN ) 4.0 2.2 1.0 assign (resid 36 and name HA )(resid 36 and name HN ) 4.0 2.2 1.0 assign (resid 36 and name HN )(resid 37 and name HN ) 3.0 1.2 0.5 assign (resid 37 and name HN )(resid 37 and name HA# ) 3.0 1.2 0.5 assign (resid 37 and name HA1 )(resid 38 and name HN ) 3.0 1.2 0.5 assign (resid 37 and name HA2 )(resid 38 and name HN ) 3.0 1.2 0.5 assign (resid 37 and name HN )(resid 38 and name HN ) 4.0 2.2 1.0 assign (resid 38 and name HB2 )(resid 38 and name HN ) 3.0 1.2 0.5 assign (resid 38 and name HG# )(resid 38 and name HN ) 3.0 1.2 0.5 assign (resid 38 and name HA )(resid 38 and name HN ) 4.0 2.2 1.0 assign (resid 38 and name HA )(resid 38 and name HE# ) 4.0 2.2 1.0 assign (resid 38 and name HB1 )(resid 39 and name HN ) 4.0 2.2 1.0 assign (resid 38 and name HG# )(resid 39 and name HN ) 4.0 2.2 1.0 assign (resid 38 and name HA )(resid 39 and name HN ) 3.0 1.2 0.5 assign (resid 38 and name HA )(resid 39 and name HG# ) 4.0 2.2 1.5 assign (resid 38 and name HN )(resid 39 and name HN ) 4.0 2.2 1.0 assign (resid 38 and name HN )(resid 40 and name HG2# ) 4.0 2.2 1.0 assign (resid 39 and name HG# )(resid 39 and name HN ) 3.0 1.2 1.0 assign (resid 39 and name HA )(resid 39 and name HN ) 4.0 2.2 1.0 assign (resid 39 and name HB )(resid 39 and name HN ) 4.0 2.2 1.0 assign (resid 39 and name HG1# )(resid 40 and name HN ) 4.0 2.2 1.0 assign (resid 39 and name HG2# )(resid 40 and name HN ) 4.0 2.2 1.0 assign (resid 39 and name HA )(resid 40 and name HN ) 4.0 2.2 1.0 assign (resid 39 and name HB )(resid 40 and name HN ) 4.0 2.2 1.0 assign (resid 39 and name HG# )(resid 41 and name HN ) 4.0 2.2 1.5 assign (resid 40 and name HG1# )(resid 40 and name HN ) 4.0 2.2 1.0 assign (resid 40 and name HG2# )(resid 40 and name HN ) 4.0 2.2 1.0 assign (resid 40 and name HA )(resid 40 and name HN ) 3.0 1.2 0.5 assign (resid 40 and name HG1# )(resid 41 and name HN ) 4.0 2.2 1.0 assign (resid 40 and name HG2# )(resid 41 and name HN ) 3.0 1.2 1.0 assign (resid 40 and name HA )(resid 41 and name HN ) 2.5 0.7 0.2 assign (resid 40 and name HB )(resid 41 and name HN ) 4.0 2.2 1.0 assign (resid 40 and name HB )(resid 41 and name HA ) 4.0 2.2 1.0 assign (resid 40 and name HN )(resid 41 and name HA ) 4.0 2.2 1.0 assign (resid 40 and name HN )(resid 41 and name HB1 ) 4.0 2.2 1.0 assign (resid 40 and name HN )(resid 41 and name HB2 ) 4.0 2.2 1.0 assign (resid 40 and name HG1# )(resid 68 and name HA ) 3.0 1.2 1.0 assign (resid 40 and name HG1# )(resid 68 and name HE1 ) 4.0 2.2 1.0 assign (resid 40 and name HG2# )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 40 and name HG2# )(resid 68 and name HE1 ) 4.0 2.2 1.0 assign (resid 40 and name HB )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 40 and name HG1# )(resid 69 and name HD1 ) 4.0 2.2 1.0 assign (resid 40 and name HG1# )(resid 69 and name HD2 ) 4.0 2.2 1.0 assign (resid 40 and name HG2# )(resid 69 and name HD1 ) 4.0 2.2 1.0 assign (resid 40 and name HG2# )(resid 69 and name HD2 ) 4.0 2.2 1.0 assign (resid 41 and name HA )(resid 42 and name HN ) 3.0 1.2 0.5 assign (resid 41 and name HB1 )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 41 and name HB2 )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 41 and name HN )(resid 42 and name HD1# ) 4.0 2.2 1.0 assign (resid 42 and name HD1# )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 42 and name HD2# )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 42 and name HA )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 42 and name HB1 )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 42 and name HB2 )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 42 and name HG )(resid 42 and name HN ) 4.0 2.2 1.0 assign (resid 42 and name HB# )(resid 42 and name HA ) 3.0 1.2 0.5 assign (resid 42 and name HG )(resid 42 and name HA ) 3.0 1.2 0.5 assign (resid 42 and name HD1# )(resid 42 and name HA ) 4.0 2.2 1.0 assign (resid 42 and name HD2# )(resid 42 and name HA ) 4.0 2.2 1.0 assign (resid 42 and name HB# )(resid 43 and name HN ) 4.0 2.2 1.0 assign (resid 42 and name HD1# )(resid 43 and name HN ) 4.0 2.2 1.0 assign (resid 42 and name HD2# )(resid 43 and name HN ) 3.0 1.2 1.0 assign (resid 42 and name HA )(resid 43 and name HN ) 3.0 1.2 0.5 assign (resid 42 and name HB# )(resid 66 and name HD21 ) 4.0 2.2 1.0 assign (resid 42 and name HB# )(resid 66 and name HD22 ) 4.0 2.2 1.0 assign (resid 42 and name HD1# )(resid 66 and name HD21 ) 4.0 2.2 1.0 assign (resid 42 and name HD1# )(resid 66 and name HD22 ) 4.0 2.2 1.0 assign (resid 42 and name HD2# )(resid 66 and name HD21 ) 4.0 2.2 1.0 assign (resid 42 and name HD2# )(resid 66 and name HD22 ) 4.0 2.2 1.0 assign (resid 42 and name HD# )(resid 68 and name HN ) 4.0 2.2 1.5 assign (resid 43 and name HA1 )(resid 43 and name HN ) 3.0 1.2 0.5 assign (resid 43 and name HA2 )(resid 43 and name HN ) 3.0 1.2 0.5 assign (resid 43 and name HA1 )(resid 44 and name HA ) 4.0 2.2 1.0 assign (resid 43 and name HA1 )(resid 44 and name HN ) 3.0 1.2 0.5 assign (resid 43 and name HA2 )(resid 44 and name HA ) 4.0 2.2 1.0 assign (resid 43 and name HA2 )(resid 44 and name HN ) 3.0 1.2 0.5 assign (resid 43 and name HN )(resid 44 and name HN ) 4.0 2.2 1.0 assign (resid 43 and name HN )(resid 66 and name HD21 ) 4.0 2.2 1.0 assign (resid 43 and name HN )(resid 66 and name HD22 ) 4.0 2.2 1.0 assign (resid 43 and name HN )(resid 66 and name HB1 ) 4.0 2.2 1.0 assign (resid 43 and name HN )(resid 66 and name HB2 ) 4.0 2.2 1.0 assign (resid 44 and name HA )(resid 44 and name HN ) 3.0 1.2 0.5 assign (resid 44 and name HB1 )(resid 44 and name HA ) 3.0 1.2 0.5 assign (resid 44 and name HB2 )(resid 44 and name HA ) 3.0 1.2 0.5 assign (resid 44 and name HB1 )(resid 44 and name HN ) 3.0 1.2 0.5 assign (resid 44 and name HB2 )(resid 44 and name HN ) 3.0 1.2 0.5 assign (resid 44 and name HA )(resid 45 and name HB# ) 4.0 2.2 1.0 assign (resid 44 and name HA )(resid 45 and name HA ) 4.0 2.2 1.0 assign (resid 44 and name HA )(resid 45 and name HN ) 2.5 0.7 0.2 assign (resid 44 and name HB1 )(resid 45 and name HN ) 3.0 1.2 0.5 assign (resid 44 and name HB2 )(resid 45 and name HN ) 3.0 1.2 0.5 assign (resid 44 and name HN )(resid 45 and name HN ) 4.0 2.2 1.0 assign (resid 45 and name HB# )(resid 45 and name HN ) 3.0 1.2 0.5 assign (resid 45 and name HA )(resid 45 and name HN ) 2.5 0.7 0.2 assign (resid 45 and name HB# )(resid 46 and name HN ) 3.0 1.2 1.0 assign (resid 45 and name HA )(resid 46 and name HN ) 3.0 1.2 0.5 assign (resid 45 and name HN )(resid 46 and name HN ) 4.0 2.2 1.0 assign (resid 45 and name HB# )(resid 47 and name HN ) 4.0 2.2 1.0 assign (resid 45 and name HA )(resid 47 and name HN ) 4.0 2.2 1.0 assign (resid 45 and name HB# )(resid 48 and name HN ) 4.0 2.2 1.0 assign (resid 45 and name HA )(resid 49 and name HG# ) 4.0 2.2 1.0 assign (resid 46 and name HB# )(resid 46 and name HA ) 2.5 0.7 0.2 assign (resid 46 and name HB# )(resid 46 and name HN ) 4.0 2.2 1.0 assign (resid 46 and name HA )(resid 46 and name HN ) 4.0 2.2 1.0 assign (resid 46 and name HB# )(resid 47 and name HN ) 3.0 1.2 1.0 assign (resid 46 and name HA )(resid 47 and name HN ) 4.0 2.2 1.0 assign (resid 46 and name HN )(resid 47 and name HN ) 3.0 1.2 0.5 assign (resid 47 and name HG2# )(resid 47 and name HN ) 3.0 1.2 1.0 assign (resid 47 and name HA )(resid 47 and name HB ) 2.5 0.7 0.2 assign (resid 47 and name HA )(resid 47 and name HN ) 3.0 1.2 0.5 assign (resid 47 and name HB )(resid 47 and name HN ) 4.0 2.2 1.0 assign (resid 47 and name HG2# )(resid 48 and name HN ) 4.0 2.2 1.0 assign (resid 47 and name HA )(resid 48 and name HN ) 4.0 2.2 1.0 assign (resid 47 and name HN )(resid 48 and name HA ) 4.0 2.2 1.0 assign (resid 47 and name HB )(resid 48 and name HN ) 4.0 2.2 1.0 assign (resid 47 and name HN )(resid 48 and name HN ) 4.0 2.2 1.0 assign (resid 48 and name HA )(resid 48 and name HN ) 3.0 1.2 0.5 assign (resid 48 and name HA )(resid 49 and name HD1 ) 4.0 2.2 1.0 assign (resid 48 and name HA )(resid 49 and name HD2 ) 4.0 2.2 1.0 assign (resid 48 and name CB )(resid 59 and name SG ) 3.0 0.1 0.1 assign (resid 48 and name SG )(resid 59 and name CB ) 3.0 0.1 0.1 assign (resid 48 and name SG )(resid 59 and name SG ) 2.0 0.1 0.1 assign (resid 49 and name HA )(resid 49 and name HB1 ) 4.0 2.2 1.0 assign (resid 49 and name HA )(resid 49 and name HB2 ) 4.0 2.2 1.0 assign (resid 49 and name HA )(resid 49 and name HG1 ) 4.0 2.2 1.0 assign (resid 49 and name HA )(resid 49 and name HG2 ) 4.0 2.2 1.0 assign (resid 49 and name HG1 )(resid 49 and name HD1 ) 4.0 2.2 1.0 assign (resid 49 and name HG1 )(resid 49 and name HD2 ) 4.0 2.2 1.0 assign (resid 49 and name HG2 )(resid 49 and name HD1 ) 4.0 2.2 1.0 assign (resid 49 and name HG2 )(resid 49 and name HD2 ) 4.0 2.2 1.0 assign (resid 49 and name HB# )(resid 50 and name HN ) 3.0 1.2 0.5 assign (resid 49 and name HA )(resid 50 and name HN ) 3.0 1.2 0.5 assign (resid 49 and name HB# )(resid 57 and name HG2# ) 4.0 2.2 1.0 assign (resid 49 and name HD# )(resid 57 and name HG2# ) 4.0 2.2 1.0 assign (resid 50 and name HB# )(resid 50 and name HN ) 3.0 1.2 0.5 assign (resid 50 and name HA )(resid 50 and name HN ) 3.0 1.2 0.5 assign (resid 50 and name HB# )(resid 51 and name HN ) 3.0 1.2 0.5 assign (resid 50 and name HA )(resid 51 and name HN ) 3.0 1.2 0.5 assign (resid 50 and name HN )(resid 51 and name HN ) 4.0 2.2 1.0 assign (resid 51 and name HB# )(resid 51 and name HN ) 4.0 2.2 1.0 assign (resid 51 and name HG# )(resid 51 and name HN ) 4.0 2.2 1.0 assign (resid 51 and name HA )(resid 51 and name HN ) 3.0 1.2 0.5 assign (resid 51 and name HA )(resid 52 and name HN ) 2.5 0.7 0.2 assign (resid 52 and name HA )(resid 52 and name HN ) 4.0 2.2 1.0 assign (resid 52 and name HN )(resid 53 and name HB# ) 4.0 2.2 1.0 assign (resid 52 and name HN )(resid 53 and name HD1 ) 4.0 2.2 1.0 assign (resid 52 and name HN )(resid 53 and name HD2 ) 4.0 2.2 1.0 assign (resid 52 and name HA )(resid 53 and name HD1 ) 4.0 2.2 1.0 assign (resid 52 and name HA )(resid 53 and name HD2 ) 4.0 2.2 1.0 assign (resid 52 and name HN )(resid 55 and name HN ) 4.0 2.2 1.0 assign (resid 52 and name HN )(resid 55 and name HB2 ) 4.0 2.2 1.0 assign (resid 53 and name HA )(resid 53 and name HB1 ) 4.0 2.2 1.0 assign (resid 53 and name HA )(resid 53 and name HB2 ) 4.0 2.2 1.0 assign (resid 53 and name HA )(resid 53 and name HG# ) 4.0 2.2 1.0 assign (resid 53 and name HA )(resid 54 and name HE# ) 4.0 2.2 1.0 assign (resid 53 and name HB# )(resid 54 and name HN ) 4.0 2.2 1.0 assign (resid 53 and name HB# )(resid 54 and name HD# ) 4.0 2.2 1.0 assign (resid 53 and name HD# )(resid 54 and name HD# ) 4.0 2.2 1.0 assign (resid 53 and name HD# )(resid 54 and name HE# ) 4.0 2.2 1.0 assign (resid 53 and name HD# )(resid 54 and name HN ) 4.0 2.2 1.0 assign (resid 53 and name HG# )(resid 54 and name HN ) 4.0 2.2 1.0 assign (resid 53 and name HA )(resid 54 and name HN ) 3.0 1.2 0.5 assign (resid 53 and name HA )(resid 55 and name HN ) 4.0 2.2 1.0 assign (resid 54 and name HB# )(resid 54 and name HN ) 4.0 2.2 1.0 assign (resid 54 and name HD# )(resid 54 and name HB1 ) 4.0 2.2 1.0 assign (resid 54 and name HD# )(resid 54 and name HB2 ) 4.0 2.2 1.0 assign (resid 54 and name HA )(resid 54 and name HN ) 4.0 2.2 1.0 assign (resid 54 and name HE# )(resid 55 and name HN ) 4.0 2.2 1.0 assign (resid 54 and name HB# )(resid 55 and name HN ) 4.0 2.2 1.0 assign (resid 54 and name HA )(resid 55 and name HN ) 4.0 2.2 1.0 assign (resid 54 and name HN )(resid 55 and name HN ) 4.0 2.2 1.0 assign (resid 55 and name HB2 )(resid 55 and name HN ) 3.0 1.2 0.5 assign (resid 55 and name HA )(resid 55 and name HN ) 3.0 1.2 0.5 assign (resid 55 and name HA )(resid 55 and name HB# ) 3.0 1.2 0.5 assign (resid 55 and name HB2 )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 55 and name HG# )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 55 and name HA )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 55 and name HN )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 56 and name HG# )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 56 and name HA )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 56 and name HB1 )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 56 and name HB2 )(resid 56 and name HN ) 4.0 2.2 1.0 assign (resid 56 and name HA )(resid 57 and name HN ) 4.0 2.2 1.0 assign (resid 56 and name HB1 )(resid 57 and name HN ) 4.0 2.2 1.0 assign (resid 56 and name HB2 )(resid 57 and name HN ) 4.0 2.2 1.0 assign (resid 56 and name HN )(resid 57 and name HN ) 4.0 2.2 1.0 assign (resid 57 and name HG1# )(resid 57 and name HN ) 4.0 2.2 1.0 assign (resid 57 and name HG2# )(resid 57 and name HN ) 4.0 2.2 1.0 assign (resid 57 and name HG1# )(resid 57 and name HA ) 3.0 1.2 0.5 assign (resid 57 and name HG2# )(resid 57 and name HA ) 3.0 1.2 0.5 assign (resid 57 and name HB )(resid 57 and name HA ) 3.0 1.2 0.5 assign (resid 57 and name HA )(resid 57 and name HN ) 4.0 2.2 1.0 assign (resid 57 and name HB )(resid 57 and name HN ) 3.0 1.2 0.5 assign (resid 57 and name HG1# )(resid 58 and name HN ) 4.0 2.2 1.0 assign (resid 57 and name HG2# )(resid 58 and name HN ) 3.0 1.2 1.0 assign (resid 57 and name HA )(resid 58 and name HN ) 2.5 0.7 0.2 assign (resid 57 and name HB )(resid 58 and name HN ) 4.0 2.2 1.0 assign (resid 57 and name HN )(resid 58 and name HN ) 4.0 2.2 1.0 assign (resid 58 and name HG2# )(resid 58 and name HN ) 4.0 2.2 1.0 assign (resid 58 and name HA )(resid 58 and name HN ) 3.0 1.2 0.5 assign (resid 58 and name HB )(resid 58 and name HN ) 3.0 1.2 0.5 assign (resid 58 and name HG2# )(resid 59 and name HN ) 4.0 2.2 1.0 assign (resid 59 and name HA )(resid 59 and name HN ) 4.0 2.2 1.0 assign (resid 59 and name HB1 )(resid 59 and name HN ) 4.0 2.2 1.0 assign (resid 59 and name HB2 )(resid 59 and name HN ) 4.0 2.2 1.0 assign (resid 59 and name HB1 )(resid 60 and name HA ) 3.0 1.2 0.5 assign (resid 59 and name HA )(resid 60 and name HA ) 4.0 2.2 1.0 assign (resid 59 and name HA )(resid 60 and name HN ) 3.0 1.2 0.5 assign (resid 59 and name HB2 )(resid 60 and name HN ) 3.0 1.2 0.5 assign (resid 59 and name HB1 )(resid 60 and name HN ) 4.0 2.2 1.0 assign (resid 60 and name HA )(resid 60 and name HB1 ) 3.0 1.2 0.5 assign (resid 60 and name HA )(resid 60 and name HB2 ) 3.0 1.2 0.5 assign (resid 60 and name HA )(resid 60 and name HN ) 3.0 1.2 0.5 assign (resid 60 and name HB1 )(resid 60 and name HN ) 4.0 2.2 1.0 assign (resid 60 and name HB2 )(resid 60 and name HN ) 4.0 2.2 1.0 assign (resid 60 and name HB1 )(resid 61 and name HN ) 4.0 2.2 1.0 assign (resid 60 and name HB2 )(resid 61 and name HN ) 4.0 2.2 1.0 assign (resid 60 and name HA )(resid 61 and name HB# ) 4.0 2.2 1.0 assign (resid 60 and name HA )(resid 61 and name HN ) 3.0 1.2 0.5 assign (resid 60 and name HB# )(resid 62 and name HN ) 4.0 2.2 1.0 assign (resid 60 and name HA )(resid 62 and name HN ) 4.0 2.2 1.0 assign (resid 60 and name CB )(resid 65 and name SG ) 3.0 0.1 0.1 assign (resid 60 and name SG )(resid 65 and name CB ) 3.0 0.1 0.1 assign (resid 60 and name SG )(resid 65 and name SG ) 2.0 0.1 0.1 assign (resid 60 and name HB# )(resid 66 and name HD2# ) 4.0 2.2 1.0 assign (resid 60 and name HA )(resid 66 and name HD21 ) 4.0 2.2 1.0 assign (resid 60 and name HA )(resid 66 and name HD22 ) 4.0 2.2 1.0 assign (resid 60 and name HB# )(resid 66 and name HN ) 4.0 2.2 1.0 assign (resid 61 and name HA )(resid 61 and name HB1 ) 2.5 0.7 0.2 assign (resid 61 and name HA )(resid 61 and name HB2 ) 2.5 0.7 0.2 assign (resid 61 and name HA )(resid 61 and name HN ) 3.0 1.2 0.5 assign (resid 61 and name HB1 )(resid 61 and name HN ) 4.0 2.2 1.0 assign (resid 61 and name HB2 )(resid 61 and name HN ) 4.0 2.2 1.0 assign (resid 61 and name HA )(resid 62 and name HN ) 3.0 1.2 0.5 assign (resid 61 and name HN )(resid 62 and name HN ) 4.0 2.2 1.0 assign (resid 62 and name HG2# )(resid 62 and name HA ) 3.0 1.2 1.0 assign (resid 62 and name HG2# )(resid 62 and name HB ) 3.0 1.2 1.0 assign (resid 62 and name HG2# )(resid 62 and name HN ) 3.0 1.2 1.0 assign (resid 62 and name HA )(resid 62 and name HB ) 3.0 1.2 0.5 assign (resid 62 and name HA )(resid 62 and name HN ) 3.0 1.2 0.5 assign (resid 62 and name HB )(resid 62 and name HN ) 3.0 1.2 0.5 assign (resid 62 and name HG2# )(resid 63 and name HN ) 4.0 2.2 1.0 assign (resid 62 and name HA )(resid 63 and name HN ) 3.0 1.2 0.5 assign (resid 62 and name HB )(resid 63 and name HN ) 3.0 1.2 0.5 assign (resid 62 and name HN )(resid 65 and name HB2 ) 4.0 2.2 1.0 assign (resid 62 and name HN )(resid 65 and name HA ) 4.0 2.2 1.0 assign (resid 63 and name HA )(resid 63 and name HN ) 3.0 1.2 0.5 assign (resid 63 and name HB1 )(resid 63 and name HN ) 3.0 1.2 0.5 assign (resid 63 and name HB2 )(resid 63 and name HN ) 3.0 1.2 0.5 assign (resid 63 and name HA )(resid 64 and name HN ) 4.0 2.2 1.0 assign (resid 63 and name HN )(resid 64 and name HN ) 4.0 2.2 1.0 assign (resid 63 and name HB1 )(resid 64 and name HN ) 4.0 2.2 1.0 assign (resid 63 and name HB2 )(resid 64 and name HN ) 4.0 2.2 1.0 assign (resid 63 and name HB# )(resid 64 and name HB# ) 4.0 2.2 1.0 assign (resid 63 and name HA )(resid 65 and name HN ) 4.0 2.2 1.0 assign (resid 64 and name HB# )(resid 64 and name HN ) 4.0 2.2 1.0 assign (resid 64 and name HA )(resid 64 and name HN ) 3.0 1.2 0.5 assign (resid 64 and name HB# )(resid 65 and name HN ) 4.0 2.2 1.0 assign (resid 64 and name HA )(resid 65 and name HN ) 3.0 1.2 0.5 assign (resid 64 and name HN )(resid 65 and name HN ) 4.0 2.2 1.0 assign (resid 64 and name HA )(resid 66 and name HN ) 3.0 1.2 0.5 assign (resid 65 and name HA )(resid 65 and name HB1 ) 3.0 1.2 0.5 assign (resid 65 and name HA )(resid 65 and name HB2 ) 3.0 1.2 0.5 assign (resid 65 and name HA )(resid 65 and name HN ) 4.0 2.2 1.0 assign (resid 65 and name HB1 )(resid 65 and name HN ) 4.0 2.2 1.0 assign (resid 65 and name HB2 )(resid 65 and name HN ) 4.0 2.2 1.0 assign (resid 65 and name HA )(resid 66 and name HN ) 4.0 2.2 1.0 assign (resid 65 and name HN )(resid 66 and name HN ) 3.0 1.2 0.5 assign (resid 66 and name HA )(resid 66 and name HN ) 3.0 1.2 0.5 assign (resid 66 and name HB1 )(resid 66 and name HN ) 3.0 1.2 0.5 assign (resid 66 and name HB2 )(resid 66 and name HN ) 3.0 1.2 0.5 assign (resid 66 and name HD21 )(resid 66 and name HN ) 4.0 2.2 1.0 assign (resid 66 and name HD22 )(resid 66 and name HN ) 4.0 2.2 1.0 assign (resid 66 and name HD21 )(resid 66 and name HB1 ) 4.0 2.2 1.0 assign (resid 66 and name HD22 )(resid 66 and name HB2 ) 4.0 2.2 1.0 assign (resid 66 and name HA )(resid 67 and name HD1 ) 3.0 1.2 0.5 assign (resid 66 and name HA )(resid 67 and name HD2 ) 3.0 1.2 0.5 assign (resid 66 and name HN )(resid 67 and name HD# ) 4.0 2.2 1.0 assign (resid 67 and name HA )(resid 67 and name HB# ) 4.0 2.2 1.0 assign (resid 67 and name HA )(resid 67 and name HG# ) 4.0 2.2 1.0 assign (resid 67 and name HB# )(resid 68 and name HN ) 4.0 2.2 1.0 assign (resid 67 and name HA )(resid 68 and name HN ) 3.0 1.2 0.5 assign (resid 68 and name HA )(resid 68 and name HN ) 3.0 1.2 0.5 assign (resid 68 and name HA )(resid 69 and name HD1 ) 4.0 2.2 1.0 assign (resid 68 and name HA )(resid 69 and name HD2 ) 4.0 2.2 1.0 assign (resid 68 and name HE1 )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 68 and name HD1 )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 68 and name HD1 )(resid 68 and name HE1 ) 4.0 2.2 1.0 assign (resid 68 and name HA )(resid 69 and name HD1 ) 4.0 2.2 1.0 assign (resid 68 and name HA )(resid 69 and name HD2 ) 4.0 2.2 1.0 assign (resid 68 and name HE1 )(resid 70 and name HB1 ) 4.0 2.2 1.0 assign (resid 68 and name HE1 )(resid 70 and name HB2 ) 4.0 2.2 1.0 assign (resid 68 and name HE1 )(resid 70 and name HG1 ) 4.0 2.2 1.0 assign (resid 68 and name HE1 )(resid 70 and name HG2 ) 4.0 2.2 1.0 assign (resid 68 and name HE1 )(resid 70 and name HN ) 4.0 2.2 1.0 assign (resid 69 and name HA )(resid 70 and name HN ) 4.0 2.2 1.0 assign (resid 69 and name HD# )(resid 70 and name HN ) 4.0 2.2 1.0 assign (resid 69 and name HA )(resid 71 and name HN ) 4.0 2.2 1.0 assign (resid 69 and name HA )(resid 71 and name HN ) 4.0 2.2 1.0 assign (resid 70 and name HA )(resid 70 and name HN ) 3.0 1.2 0.5 assign (resid 70 and name HZ# )(resid 70 and name HB1 ) 4.0 2.2 1.0 assign (resid 70 and name HZ# )(resid 70 and name HB2 ) 4.0 2.2 1.0 assign (resid 70 and name HZ# )(resid 70 and name HG# ) 4.0 2.2 1.0 assign (resid 70 and name HZ# )(resid 70 and name HD# ) 4.0 2.2 1.0 assign (resid 70 and name HZ# )(resid 70 and name HE# ) 4.0 2.2 1.0 assign (resid 70 and name HA )(resid 71 and name HN ) 4.0 2.2 1.0 assign (resid 70 and name HN )(resid 71 and name HN ) 3.0 1.2 0.5 assign (resid 70 and name HZ# )(resid 71 and name HB1 ) 4.0 2.2 1.0 assign (resid 70 and name HZ# )(resid 71 and name HB2 ) 4.0 2.2 1.0 assign (resid 71 and name HG# )(resid 71 and name HN ) 3.0 1.2 0.5 assign (resid 71 and name HA )(resid 71 and name HN ) 3.0 1.2 0.5 assign (resid 71 and name HB1 )(resid 71 and name HN ) 4.0 2.2 1.0 assign (resid 71 and name HB2 )(resid 71 and name HN ) 4.0 2.2 1.0 assign (resid 71 and name HB1 )(resid 71 and name HE21 ) 4.0 2.2 1.0 assign (resid 71 and name HB2 )(resid 71 and name HE21 ) 4.0 2.2 1.0 assign (resid 71 and name HB1 )(resid 71 and name HE22 ) 4.0 2.2 1.0 assign (resid 71 and name HB2 )(resid 71 and name HE22 ) 4.0 2.2 1.0 assign (resid 71 and name HG# )(resid 71 and name HE21 ) 4.0 2.2 1.0 assign (resid 71 and name HG# )(resid 71 and name HE22 ) 4.0 2.2 1.0 assign (resid 71 and name HB# )(resid 72 and name HN ) 4.0 2.2 1.0 assign (resid 71 and name HG# )(resid 72 and name HN ) 4.0 2.2 1.0 assign (resid 71 and name HA )(resid 72 and name HN ) 3.0 1.2 0.5 assign (resid 72 and name HB# )(resid 72 and name HN ) 4.0 2.2 1.0 assign (resid 72 and name HA )(resid 72 and name HN ) 4.0 2.2 1.0 assign (resid 72 and name HA )(resid 73 and name HD1 ) 3.0 1.2 0.5 assign (resid 72 and name HA )(resid 73 and name HD2 ) 3.0 1.2 0.5 assign (resid 73 and name HA )(resid 74 and name HN ) 2.5 0.7 0.2 assign (resid 73 and name HB1 )(resid 74 and name HN ) 4.0 2.2 1.0 assign (resid 73 and name HB2 )(resid 74 and name HN ) 4.0 2.2 1.0 assign (resid 74 and name HA1 )(resid 74 and name HN ) 3.0 1.2 0.5 assign (resid 74 and name HA2 )(resid 74 and name HN ) 4.0 2.2 1.0 assign (resid 75 and name HA )(resid 76 and name HN ) 3.0 1.2 0.5 assign (resid 75 and name HB# )(resid 76 and name HN ) 4.0 2.2 1.0 assign (resid 76 and name HH# )(resid 39 and name HG# ) 4.0 2.2 1.5 assign (resid 76 and name HB# )(resid 76 and name HN ) 4.0 2.2 1.0 assign (resid 76 and name HG# )(resid 76 and name HN ) 4.0 2.2 1.0 assign (resid 76 and name HA )(resid 76 and name HN ) 4.0 2.2 1.0 assign (resid 76 and name HH# )(resid 76 and name HD# ) 4.0 2.2 1.0 assign (resid 76 and name HH# )(resid 76 and name HG# ) 4.0 2.2 1.0 assign (resid 76 and name HH# )(resid 76 and name HB# ) 4.0 2.2 1.0 assign (resid 76 and name HN )(resid 77 and name HN ) 4.0 2.2 1.0 assign (resid 76 and name HB# )(resid 77 and name HN ) 4.0 2.2 1.0 assign (resid 76 and name HA )(resid 77 and name HN ) 4.0 2.2 1.0 assign (resid 76 and name HB# )(resid 79 and name HN ) 4.0 2.2 1.0 assign (resid 76 and name HN )(resid 84 and name HA ) 4.0 2.2 1.0 assign (resid 76 and name HN )(resid 84 and name HB# ) 4.0 2.2 1.0 assign (resid 76 and name HN )(resid 85 and name HD# ) 4.0 2.2 1.0 assign (resid 76 and name HN )(resid 85 and name HE# ) 4.0 2.2 1.0 assign (resid 77 and name HD# )(resid 6 and name HA ) 4.0 2.2 1.0 assign (resid 77 and name HE# )(resid 6 and name HA ) 4.0 2.2 1.0 assign (resid 77 and name HD# )(resid 6 and name HB ) 4.0 2.2 1.0 assign (resid 77 and name HE# )(resid 6 and name HB ) 4.0 2.2 1.0 assign (resid 77 and name HD# )(resid 6 and name HG2# ) 4.0 2.2 1.0 assign (resid 77 and name HE# )(resid 6 and name HG2# ) 4.0 2.2 1.0 assign (resid 77 and name HE# )(resid 7 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HE# )(resid 11 and name HG1# ) 4.0 2.2 1.0 assign (resid 77 and name HE# )(resid 11 and name HD1# ) 3.0 1.2 1.0 assign (resid 77 and name HE# )(resid 11 and name HB ) 4.0 2.2 1.0 assign (resid 77 and name HD# )(resid 11 and name HB ) 3.0 1.2 0.5 assign (resid 77 and name HD# )(resid 11 and name HD1# ) 3.0 1.2 1.0 assign (resid 77 and name HD# )(resid 11 and name HG2# ) 3.0 1.2 1.0 assign (resid 77 and name HN )(resid 39 and name HG# ) 4.0 2.2 1.5 assign (resid 77 and name HB1 )(resid 68 and name HD1 ) 4.0 2.2 1.0 assign (resid 77 and name HB1 )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 77 and name HB2 )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 77 and name HD# )(resid 77 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HE# )(resid 77 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HA )(resid 77 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HB1 )(resid 77 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HB2 )(resid 77 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HD# )(resid 78 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HD# )(resid 78 and name HA ) 4.0 2.2 1.0 assign (resid 77 and name HA )(resid 78 and name HN ) 3.0 1.2 0.5 assign (resid 77 and name HB1 )(resid 78 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HB2 )(resid 78 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HN )(resid 78 and name HN ) 4.0 2.2 1.0 assign (resid 77 and name HD# )(resid 84 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HD# )(resid 30 and name HB# ) 4.0 2.2 1.0 assign (resid 78 and name HE# )(resid 30 and name HB# ) 4.0 2.2 1.0 assign (resid 78 and name HD# )(resid 36 and name HB1 ) 4.0 2.2 1.0 assign (resid 78 and name HD# )(resid 36 and name HB2 ) 4.0 2.2 1.0 assign (resid 78 and name HE# )(resid 36 and name HB1 ) 4.0 2.2 1.0 assign (resid 78 and name HE# )(resid 36 and name HB2 ) 4.0 2.2 1.0 assign (resid 78 and name HD# )(resid 36 and name HG1 ) 4.0 2.2 1.0 assign (resid 78 and name HD# )(resid 36 and name HG2 ) 4.0 2.2 1.0 assign (resid 78 and name HE# )(resid 36 and name HG1 ) 4.0 2.2 1.0 assign (resid 78 and name HE# )(resid 36 and name HG2 ) 4.0 2.2 1.0 assign (resid 78 and name HD# )(resid 39 and name HA ) 4.0 2.2 1.0 assign (resid 78 and name HE# )(resid 39 and name HA ) 4.0 2.2 1.0 assign (resid 78 and name HD# )(resid 39 and name HG1# ) 4.0 2.2 1.0 assign (resid 78 and name HD# )(resid 39 and name HG2# ) 4.0 2.2 1.0 assign (resid 78 and name HE# )(resid 39 and name HG1# ) 4.0 2.2 1.0 assign (resid 78 and name HE# )(resid 39 and name HG2# ) 4.0 2.2 1.0 assign (resid 78 and name HA )(resid 39 and name HA ) 2.5 0.7 0.5 assign (resid 78 and name HA )(resid 39 and name HG1# ) 3.0 1.2 1.0 assign (resid 78 and name HA )(resid 39 and name HG2# ) 3.0 1.2 1.0 assign (resid 78 and name HA )(resid 40 and name HG2# ) 3.0 1.2 1.0 assign (resid 78 and name HA )(resid 40 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HA )(resid 78 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HB1 )(resid 78 and name HA ) 3.0 1.2 0.5 assign (resid 78 and name HB2 )(resid 78 and name HA ) 3.0 1.2 0.5 assign (resid 78 and name HB1 )(resid 78 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HB2 )(resid 78 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HA )(resid 79 and name HN ) 3.0 1.2 0.5 assign (resid 78 and name HB1 )(resid 79 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HB2 )(resid 79 and name HN ) 3.0 1.2 0.5 assign (resid 78 and name HN )(resid 79 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HD# )(resid 79 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HE# )(resid 79 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HB1 )(resid 80 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HB2 )(resid 80 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HN )(resid 81 and name HN ) 4.0 2.2 1.0 assign (resid 78 and name HN )(resid 85 and name HE# ) 4.0 2.2 1.0 assign (resid 78 and name HN )(resid 85 and name HD# ) 4.0 2.2 1.0 assign (resid 79 and name HN )(resid 38 and name HN ) 4.0 2.2 1.0 assign (resid 79 and name HB# )(resid 38 and name HN ) 4.0 2.2 1.0 assign (resid 79 and name HG# )(resid 38 and name HN ) 4.0 2.2 1.0 assign (resid 79 and name HN )(resid 39 and name HA ) 4.0 2.2 1.0 assign (resid 79 and name HB# )(resid 40 and name HG2# ) 3.0 1.2 1.0 assign (resid 79 and name HN )(resid 40 and name HG2# ) 4.0 2.2 1.0 assign (resid 79 and name HN )(resid 40 and name HN ) 4.0 2.2 1.0 assign (resid 79 and name HB# )(resid 68 and name HD1 ) 4.0 2.2 1.0 assign (resid 79 and name HA )(resid 79 and name HN ) 3.0 1.2 0.5 assign (resid 79 and name HA )(resid 80 and name HN ) 4.0 2.2 1.0 assign (resid 79 and name HB# )(resid 80 and name HN ) 4.0 2.2 1.0 assign (resid 79 and name HG# )(resid 80 and name HN ) 4.0 2.2 1.0 assign (resid 79 and name HN )(resid 80 and name HN ) 4.0 2.2 1.0 assign (resid 79 and name HN )(resid 81 and name HN ) 4.0 2.2 1.0 assign (resid 80 and name HA )(resid 80 and name HN ) 3.0 1.2 0.5 assign (resid 80 and name HB1 )(resid 80 and name HN ) 4.0 2.2 1.0 assign (resid 80 and name HB2 )(resid 80 and name HN ) 4.0 2.2 1.0 assign (resid 80 and name HA )(resid 81 and name HN ) 4.0 2.2 1.0 assign (resid 80 and name HB1 )(resid 81 and name HN ) 4.0 2.2 1.0 assign (resid 80 and name HB2 )(resid 81 and name HN ) 4.0 2.2 1.0 assign (resid 80 and name HN )(resid 81 and name HN ) 4.0 2.2 1.0 assign (resid 81 and name HN )(resid 68 and name HD1 ) 4.0 2.2 1.0 assign (resid 81 and name HN )(resid 68 and name HE1 ) 4.0 2.2 1.0 assign (resid 81 and name HN )(resid 72 and name HN ) 4.0 2.2 1.0 assign (resid 81 and name HN )(resid 81 and name HA ) 4.0 2.2 1.0 assign (resid 81 and name HN )(resid 81 and name HB1 ) 4.0 2.2 1.0 assign (resid 81 and name HN )(resid 81 and name HB2 ) 4.0 2.2 1.0 assign (resid 81 and name HA )(resid 81 and name HB1 ) 4.0 2.2 1.0 assign (resid 81 and name HA )(resid 81 and name HB2 ) 4.0 2.2 1.0 assign (resid 81 and name HA )(resid 82 and name HN ) 4.0 2.2 1.0 assign (resid 82 and name HN )(resid 83 and name HN ) 4.0 2.2 1.0 assign (resid 82 and name HA )(resid 11 and name HD1# ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 68 and name HB# ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 68 and name HD2 ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 68 and name HE1 ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 68 and name HN ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 70 and name HB2 ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 70 and name HG# ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 70 and name HN ) 4.0 2.2 1.0 assign (resid 82 and name HD1# )(resid 71 and name HA ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 71 and name HA ) 4.0 2.2 1.0 assign (resid 82 and name HD1# )(resid 71 and name HN ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 71 and name HN ) 4.0 2.2 1.0 assign (resid 82 and name HD1# )(resid 71 and name HE21 ) 4.0 2.2 1.0 assign (resid 82 and name HD1# )(resid 71 and name HE22 ) 4.0 2.2 1.0 assign (resid 82 and name HA )(resid 82 and name HG ) 4.0 2.2 1.0 assign (resid 82 and name HA )(resid 82 and name HN ) 4.0 2.2 1.0 assign (resid 82 and name HA )(resid 82 and name HD2# ) 3.0 1.2 1.0 assign (resid 82 and name HA )(resid 83 and name HN ) 3.0 1.2 0.5 assign (resid 82 and name HB# )(resid 83 and name HN ) 4.0 2.2 1.0 assign (resid 82 and name HD2# )(resid 83 and name HN ) 4.0 2.2 1.0 assign (resid 83 and name HA )(resid 83 and name HN ) 3.0 1.2 0.5 assign (resid 83 and name HA )(resid 84 and name HN ) 2.5 0.7 0.2 assign (resid 83 and name HB1 )(resid 84 and name HN ) 4.0 2.2 1.0 assign (resid 83 and name HB2 )(resid 84 and name HN ) 4.0 2.2 1.0 assign (resid 83 and name HG# )(resid 85 and name HD# ) 4.0 2.2 1.0 assign (resid 83 and name HD# )(resid 85 and name HD# ) 4.0 2.2 1.0 assign (resid 84 and name HA )(resid 84 and name HN ) 3.0 1.2 0.5 assign (resid 84 and name HA )(resid 84 and name HB# ) 3.0 1.2 0.5 assign (resid 84 and name HA )(resid 85 and name HN ) 4.0 2.2 1.0 assign (resid 84 and name HB# )(resid 85 and name HN ) 4.0 2.2 1.0 assign (resid 85 and name HD# )(resid 85 and name HE# ) 3.0 1.2 0.5 assign (resid 85 and name HE# )(resid 85 and name HB1 ) 4.0 2.2 1.0 assign (resid 85 and name HE# )(resid 85 and name HB2 ) 4.0 2.2 1.0 assign (resid 85 and name HD# )(resid 85 and name HA ) 4.0 2.2 1.0 assign (resid 85 and name HD# )(resid 85 and name HB1 ) 3.0 1.2 0.5 assign (resid 85 and name HD# )(resid 85 and name HB2 ) 3.0 1.2 0.5 assign (resid 85 and name HD# )(resid 85 and name HN ) 4.0 2.2 1.0 assign (resid 85 and name HA )(resid 86 and name HD# ) 4.0 2.2 1.0 assign (resid 86 and name HA )(resid 86 and name HB1 ) 4.0 2.2 1.0 assign (resid 86 and name HA )(resid 86 and name HB2 ) 4.0 2.2 1.0 assign (resid 86 and name HA )(resid 87 and name HN ) 4.0 2.2 1.0 assign (resid 86 and name HB1 )(resid 87 and name HN ) 4.0 2.2 1.0 assign (resid 86 and name HB2 )(resid 87 and name HN ) 4.0 2.2 1.0 assign (resid 86 and name HD# )(resid 87 and name HN ) 4.0 2.2 1.0 assign (resid 87 and name HA )(resid 87 and name HN ) 3.0 1.2 0.5
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