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 |
|
|
571595 |
2m87   |
19231 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
remarks for PmrAc103 remarks L 2.00 0.20 0.50; M 2.00 0.20 1.50; S 2.00 0.20 2.50 ; VS 2.00 0.20.3.00 remarks Original input reference distance: 1.80 remarks Current input reference distance: 1.80 remarks Distance cut-off : 5.00 set echo=false end set wrnlev=0 end remarks Gln2 assign (resid 2 and name HN )(resid 1 and name HA ) 2.00 0.20 1.50 assign (resid 2 and name HN )(resid 1 and name HB* ) 2.00 0.20 3.50 assign (resid 2 and name HN )(resid 2 and name HA ) 2.00 0.20 3.00 assign (resid 2 and name HN )(resid 2 and name HB* ) 2.00 0.20 3.50 assign (resid 2 and name HN )(resid 2 and name HG* ) 2.00 0.20 4.50 remarks Gly3 assign (resid 3 and name HN )(resid 1 and name HA ) 2.00 0.20 2.00 assign (resid 3 and name HN )(resid 1 and name HB* ) 2.00 0.20 4.50 assign (resid 3 and name HN )(resid 2 and name HA ) 2.00 0.20 0.80 assign (resid 3 and name HN )(resid 2 and name HB* ) 2.00 0.20 3.00 assign (resid 3 and name HN )(resid 2 and name HG* ) 2.00 0.20 4.00 assign (resid 3 and name HN )(resid 3 and name HA* ) 2.00 0.20 1.50 assign (resid 3 and name HN )(resid 4 and name HN ) 2.00 0.20 3.00 remarks Asp4 assign (resid 4 and name HN )(resid 1 and name HA ) 2.00 0.20 3.00 assign (resid 4 and name HN )(resid 2 and name HA ) 2.00 0.20 2.50 assign (resid 4 and name HN )(resid 3 and name HA* ) 2.00 0.20 2.00 assign (resid 4 and name HN )(resid 4 and name HA ) 2.00 0.20 2.00 assign (resid 4 and name HN )(resid 4 and name HB* ) 2.00 0.20 2.00 remarks Asn5 assign (resid 5 and name HN )(resid 4 and name HA ) 2.00 0.20 1.50 assign (resid 5 and name HN )(resid 4 and name HB* ) 2.00 0.20 2.50 assign (resid 5 and name HN )(resid 5 and name HA ) 2.00 0.20 1.50 assign (resid 5 and name HN )(resid 5 and name HB* ) 2.00 0.20 3.00 assign (resid 5 and name HN )(resid 6 and name HN ) 2.00 0.20 2.00 assign (resid 5 and name HN )(resid 15 and name HA ) 2.00 0.20 3.50 assign (resid 5 and name HN )(resid 16 and name HB ) 2.00 0.20 3.50 assign (resid 5 and name HN )(resid 17 and name HA ) 2.00 0.20 3.00 assign (resid 5 and name HN )(resid 17 and name HG2* ) 2.00 0.20 5.00 remarks Glu6 assign (resid 6 and name HN )(resid 5 and name HA ) 2.00 0.20 0.80 assign (resid 6 and name HN )(resid 5 and name HB* ) 2.00 0.20 2.50 assign (resid 6 and name HN )(resid 6 and name HA ) 2.00 0.20 1.50 assign (resid 6 and name HN )(resid 6 and name HB* ) 2.00 0.20 2.50 assign (resid 6 and name HN )(resid 6 and name HG* ) 2.00 0.20 2.50 assign (resid 6 and name HN )(resid 7 and name HN ) 2.00 0.20 3.00 assign (resid 6 and name HA )(resid 15 and name HA ) 2.00 0.20 2.00 remarks Ile7 assign (resid 7 and name HN )(resid 6 and name HA ) 2.00 0.20 0.80 assign (resid 7 and name HN )(resid 6 and name HB* ) 2.00 0.20 2.50 assign (resid 7 and name HN )(resid 6 and name HG* ) 2.00 0.20 3.00 assign (resid 7 and name HN )(resid 7 and name HA ) 2.00 0.20 2.50 assign (resid 7 and name HN )(resid 7 and name HB ) 2.00 0.20 2.00 assign (resid 7 and name HN )(resid 7 and name HG1* ) 2.00 0.20 2.50 assign (resid 7 and name HN )(resid 7 and name HD1* ) 2.00 0.20 4.50 assign (resid 7 and name HN )(resid 7 and name HG2* ) 2.00 0.20 6.00 assign (resid 7 and name HN )(resid 8 and name HN ) 2.00 0.20 2.50 assign (resid 7 and name HN )(resid 13 and name HA ) 2.00 0.20 3.50 assign (resid 7 and name HN )(resid 14 and name HN ) 2.00 0.20 1.50 assign (resid 7 and name HN )(resid 16 and name HN ) 2.00 0.20 3.50 assign (resid 7 and name HN )(resid 16 and name HG* ) 2.00 0.20 6.00 remarks Ser8 assign (resid 8 and name HN )(resid 7 and name HA ) 2.00 0.20 0.80 assign (resid 8 and name HN )(resid 7 and name HB ) 2.00 0.20 1.50 assign (resid 8 and name HN )(resid 7 and name HG1* ) 2.00 0.20 2.50 assign (resid 8 and name HN )(resid 7 and name HG2* ) 2.00 0.20 3.50 assign (resid 8 and name HN )(resid 8 and name HA ) 2.00 0.20 2.50 assign (resid 8 and name HN )(resid 8 and name HB* ) 2.00 0.20 2.50 assign (resid 8 and name HN )(resid 13 and name HA ) 2.00 0.20 3.50 assign (resid 8 and name HA )(resid 13 and name HA ) 2.00 0.20 1.50 assign (resid 8 and name HB* )(resid 13 and name HA ) 2.00 0.20 3.50 remarks Val9 assign (resid 9 and name HN )(resid 8 and name HA ) 2.00 0.20 0.80 assign (resid 9 and name HN )(resid 8 and name HB* ) 2.00 0.20 2.00 assign (resid 9 and name HN )(resid 9 and name HA ) 2.00 0.20 2.00 assign (resid 9 and name HN )(resid 9 and name HB ) 2.00 0.20 1.50 assign (resid 9 and name HN )(resid 9 and name HG* ) 2.00 0.20 4.50 assign (resid 9 and name HN )(resid 10 and name HN ) 2.00 0.20 3.50 assign (resid 9 and name HN )(resid 12 and name HN ) 2.00 0.20 2.50 assign (resid 9 and name HN )(resid 12 and name HB* ) 2.00 0.20 3.50 assign (resid 9 and name HN )(resid 13 and name HA ) 2.00 0.20 1.80 assign (resid 9 and name HN )(resid 13 and name HB* ) 2.00 0.20 4.00 assign (resid 9 and name HN )(resid 13 and name HG* ) 2.00 0.20 4.50 assign (resid 9 and name HN )(resid 14 and name HN ) 2.00 0.20 3.00 remarks Gly10 assign (resid 10 and name HN )(resid 9 and name HA ) 2.00 0.20 0.80 assign (resid 10 and name HN )(resid 9 and name HB ) 2.00 0.20 3.00 assign (resid 10 and name HN )(resid 9 and name HG* ) 2.00 0.20 5.00 assign (resid 10 and name HN )(resid 10 and name HA* ) 2.00 0.20 1.50 assign (resid 10 and name HN )(resid 11 and name HN ) 2.00 0.20 2.50 assign (resid 10 and name HN )(resid 99 and name HA ) 2.00 0.20 3.50 remarks Asn11 assign (resid 11 and name HN )(resid 10 and name HA* ) 2.00 0.20 1.50 assign (resid 11 and name HN )(resid 11 and name HA ) 2.00 0.20 2.50 assign (resid 11 and name HN )(resid 11 and name HB* ) 2.00 0.20 2.50 assign (resid 11 and name HN )(resid 12 and name HN ) 2.00 0.20 1.50 assign (resid 11 and name HN )(resid 12 and name HB* ) 2.00 0.20 3.50 assign (resid 11 and name HN )(resid 12 and name HD* ) 2.00 0.20 6.00 assign (resid 11 and name HN )(resid 99 and name HA ) 2.00 0.20 3.50 remarks Leu12 assign (resid 12 and name HN )(resid 8 and name HA ) 2.00 0.20 3.00 assign (resid 12 and name HN )(resid 9 and name HA ) 2.00 0.20 3.50 assign (resid 12 and name HN )(resid 10 and name HA* ) 2.00 0.20 2.50 assign (resid 12 and name HN )(resid 11 and name HA ) 2.00 0.20 1.50 assign (resid 12 and name HN )(resid 11 and name HB* ) 2.00 0.20 3.00 assign (resid 12 and name HN )(resid 12 and name HA ) 2.00 0.20 1.50 assign (resid 12 and name HN )(resid 12 and name HB* ) 2.00 0.20 1.50 assign (resid 12 and name HN )(resid 12 and name HG ) 2.00 0.20 2.00 assign (resid 12 and name HN )(resid 12 and name HD* ) 2.00 0.20 4.50 assign (resid 12 and name HA )(resid 23 and name HA ) 2.00 0.20 2.00 remarks Arg13 assign (resid 13 and name HN )(resid 12 and name HA ) 2.00 0.20 0.80 assign (resid 13 and name HN )(resid 12 and name HB* ) 2.00 0.20 2.00 assign (resid 13 and name HN )(resid 12 and name HD* ) 2.00 0.20 4.50 assign (resid 13 and name HN )(resid 13 and name HA ) 2.00 0.20 1.50 assign (resid 13 and name HN )(resid 13 and name HB* ) 2.00 0.20 1.50 assign (resid 13 and name HN )(resid 13 and name HG* ) 2.00 0.20 4.50 assign (resid 13 and name HN )(resid 13 and name HD* ) 2.00 0.20 3.50 assign (resid 13 and name HN )(resid 22 and name HB* ) 2.00 0.20 3.00 assign (resid 13 and name HN )(resid 22 and name HN ) 2.00 0.20 1.50 assign (resid 13 and name HN )(resid 23 and name HA ) 2.00 0.20 2.50 remarks Leu14 assign (resid 14 and name HN )(resid 8 and name HA ) 2.00 0.20 1.50 assign (resid 14 and name HN )(resid 8 and name HB* ) 2.00 0.20 4.50 assign (resid 14 and name HN )(resid 13 and name HA ) 2.00 0.20 0.80 assign (resid 14 and name HN )(resid 13 and name HB* ) 2.00 0.20 2.50 assign (resid 14 and name HN )(resid 13 and name HG* ) 2.00 0.20 4.00 assign (resid 14 and name HN )(resid 14 and name HA ) 2.00 0.20 1.50 assign (resid 14 and name HN )(resid 14 and name HB* ) 2.00 0.20 1.50 assign (resid 14 and name HN )(resid 14 and name HG ) 2.00 0.20 2.50 assign (resid 14 and name HN )(resid 14 and name HD* ) 2.00 0.20 4.50 assign (resid 14 and name HA )(resid 21 and name HA ) 2.00 0.20 2.50 remarks Asn15 assign (resid 15 and name HN )(resid 14 and name HA ) 2.00 0.20 0.80 assign (resid 15 and name HN )(resid 14 and name HB* ) 2.00 0.20 2.50 assign (resid 15 and name HN )(resid 14 and name HG ) 2.00 0.20 2.00 assign (resid 15 and name HN )(resid 14 and name HD* ) 2.00 0.20 5.00 assign (resid 15 and name HN )(resid 15 and name HA ) 2.00 0.20 1.50 assign (resid 15 and name HN )(resid 15 and name HB* ) 2.00 0.20 1.50 assign (resid 15 and name HN )(resid 16 and name HN ) 2.00 0.20 3.50 assign (resid 15 and name HN )(resid 16 and name HG* ) 2.00 0.20 5.50 assign (resid 15 and name HN )(resid 20 and name HN ) 2.00 0.20 1.50 assign (resid 15 and name HN )(resid 21 and name HA ) 2.00 0.20 1.50 remarks Val16 assign (resid 16 and name HN )(resid 6 and name HB* ) 2.00 0.20 3.00 assign (resid 16 and name HN )(resid 14 and name HB* ) 2.00 0.20 4.50 assign (resid 16 and name HN )(resid 15 and name HA ) 2.00 0.20 0.80 assign (resid 16 and name HN )(resid 15 and name HB* ) 2.00 0.20 3.50 assign (resid 16 and name HN )(resid 16 and name HA ) 2.00 0.20 1.50 assign (resid 16 and name HN )(resid 16 and name HB ) 2.00 0.20 0.80 assign (resid 16 and name HN )(resid 16 and name HG* ) 2.00 0.20 4.50 assign (resid 16 and name HN )(resid 17 and name HN ) 2.00 0.20 0.80 assign (resid 16 and name HN )(resid 18 and name HN ) 2.00 0.20 2.50 remarks Thr17 assign (resid 17 and name HN )(resid 5 and name HB* ) 2.00 0.20 3.50 assign (resid 17 and name HN )(resid 5 and name HN ) 2.00 0.20 3.00 assign (resid 17 and name HN )(resid 15 and name HA ) 2.00 0.20 1.50 assign (resid 17 and name HN )(resid 16 and name HA ) 2.00 0.20 1.50 assign (resid 17 and name HN )(resid 16 and name HB ) 2.00 0.20 0.80 assign (resid 17 and name HN )(resid 16 and name HG* ) 2.00 0.20 4.00 assign (resid 17 and name HN )(resid 17 and name HA ) 2.00 0.20 0.80 assign (resid 17 and name HN )(resid 17 and name HB ) 2.00 0.20 1.50 assign (resid 17 and name HN )(resid 17 and name HG2* ) 2.00 0.20 3.50 assign (resid 17 and name HN )(resid 19 and name HA ) 2.00 0.20 3.00 remarks Arg18 assign (resid 18 and name HN )(resid 15 and name HA ) 2.00 0.20 3.50 assign (resid 18 and name HN )(resid 16 and name HG* ) 2.00 0.20 5.50 assign (resid 18 and name HN )(resid 17 and name HA ) 2.00 0.20 2.00 assign (resid 18 and name HN )(resid 17 and name HB ) 2.00 0.20 2.00 assign (resid 18 and name HN )(resid 17 and name HG2* ) 2.00 0.20 4.00 assign (resid 18 and name HN )(resid 18 and name HA ) 2.00 0.20 1.50 assign (resid 18 and name HN )(resid 18 and name HB* ) 2.00 0.20 1.20 assign (resid 18 and name HN )(resid 18 and name HG* ) 2.00 0.20 1.50 assign (resid 18 and name HN )(resid 18 and name HD* ) 2.00 0.20 4.00 assign (resid 18 and name HN )(resid 19 and name HN ) 2.00 0.20 0.80 assign (resid 18 and name HN )(resid 19 and name HA ) 2.00 0.20 3.00 assign (resid 18 and name HN )(resid 19 and name HB* ) 2.00 0.20 4.00 assign (resid 18 and name HN )(resid 20 and name HN ) 2.00 0.20 3.00 remarks Arg19 assign (resid 19 and name HN )(resid 16 and name HA ) 2.00 0.20 2.50 assign (resid 19 and name HN )(resid 16 and name HG* ) 2.00 0.20 5.50 assign (resid 19 and name HN )(resid 17 and name HA ) 2.00 0.20 3.00 assign (resid 19 and name HN )(resid 17 and name HG2* ) 2.00 0.20 4.00 assign (resid 19 and name HN )(resid 18 and name HA ) 2.00 0.20 2.00 assign (resid 19 and name HN )(resid 18 and name HB* ) 2.00 0.20 2.00 assign (resid 19 and name HN )(resid 18 and name HG* ) 2.00 0.20 2.50 assign (resid 19 and name HN )(resid 19 and name HA ) 2.00 0.20 0.80 assign (resid 19 and name HN )(resid 19 and name HB* ) 2.00 0.20 2.00 assign (resid 19 and name HN )(resid 19 and name HG* ) 2.00 0.20 3.00 assign (resid 19 and name HN )(resid 19 and name HD* ) 2.00 0.20 4.00 assign (resid 19 and name HN )(resid 20 and name HN ) 2.00 0.20 1.50 assign (resid 19 and name HN )(resid 35 and name HD* ) 2.00 0.20 6.00 assign (resid 19 and name HN )(resid 35 and name HE* ) 2.00 0.20 4.50 remarks Leu20 assign (resid 20 and name HN )(resid 14 and name HA ) 2.00 0.20 3.00 assign (resid 20 and name HN )(resid 18 and name HB* ) 2.00 0.20 5.50 assign (resid 20 and name HN )(resid 18 and name HG* ) 2.00 0.20 5.50 assign (resid 20 and name HN )(resid 19 and name HA ) 2.00 0.20 0.80 assign (resid 20 and name HN )(resid 19 and name HD* ) 2.00 0.20 3.50 assign (resid 20 and name HN )(resid 20 and name HA ) 2.00 0.20 0.80 assign (resid 20 and name HN )(resid 20 and name HB* ) 2.00 0.20 2.00 assign (resid 20 and name HN )(resid 20 and name HG ) 2.00 0.20 2.50 assign (resid 20 and name HN )(resid 20 and name HD* ) 2.00 0.20 4.00 assign (resid 20 and name HN )(resid 21 and name HN ) 2.00 0.20 2.50 assign (resid 20 and name HN )(resid 35 and name HD* ) 2.00 0.20 5.00 assign (resid 20 and name HN )(resid 35 and name HE* ) 2.00 0.20 4.00 remarks Val21 assign (resid 21 and name HN )(resid 20 and name HA ) 2.00 0.20 0.80 assign (resid 21 and name HN )(resid 20 and name HB* ) 2.00 0.20 2.50 assign (resid 21 and name HN )(resid 20 and name HG ) 2.00 0.20 3.00 assign (resid 21 and name HN )(resid 20 and name HD* ) 2.00 0.20 5.00 assign (resid 21 and name HN )(resid 21 and name HA ) 2.00 0.20 1.50 assign (resid 21 and name HN )(resid 21 and name HB ) 2.00 0.20 0.80 assign (resid 21 and name HN )(resid 21 and name HG* ) 2.00 0.20 3.50 assign (resid 21 and name HN )(resid 22 and name HN ) 2.00 0.20 4.00 assign (resid 21 and name HN )(resid 35 and name HD* ) 2.00 0.20 6.00 remarks Trp22 assign (resid 22 and name HN )(resid 13 and name HB* ) 2.00 0.20 2.50 assign (resid 22 and name HN )(resid 13 and name HG* ) 2.00 0.20 3.50 assign (resid 22 and name HN )(resid 14 and name HA ) 2.00 0.20 2.50 assign (resid 22 and name HN )(resid 15 and name HN ) 2.00 0.20 3.50 assign (resid 22 and name HN )(resid 21 and name HA ) 2.00 0.20 0.80 assign (resid 22 and name HN )(resid 21 and name HG* ) 2.00 0.20 4.00 assign (resid 22 and name HN )(resid 22 and name HA ) 2.00 0.20 1.50 assign (resid 22 and name HN )(resid 22 and name HB* ) 2.00 0.20 2.50 assign (resid 22 and name HN )(resid 23 and name HN ) 2.00 0.20 3.00 assign (resid 22 and name HA )(resid 27 and name HA ) 2.00 0.20 1.50 assign (resid 22 and name HD1 )(resid 27 and name HA ) 2.00 0.20 2.00 ! assign (resid 22 and name HE1 )(resid 22 and name HB* ) 2.00 0.20 4.50 assign (resid 22 and name HE1 )(resid 27 and name HA ) 2.00 0.20 3.50 assign (resid 22 and name HE1 )(resid 27 and name HB* ) 2.00 0.20 3.50 assign (resid 22 and name HE3 )(resid 13 and name HA ) 2.00 0.20 2.50 ! assign (resid 22 and name HZ2 )(resid 20 and name HB* ) 2.00 0.20 4.00 ! assign (resid 22 and name HZ2 )(resid 20 and name HG ) 2.00 0.20 3.50 ! assign (resid 22 and name HZ2 )(resid 20 and name HD* ) 2.00 0.20 5.00 ! remarks Leu23 assign (resid 23 and name HN )(resid 12 and name HA ) 2.00 0.20 3.50 assign (resid 23 and name HN )(resid 22 and name HA ) 2.00 0.20 0.80 assign (resid 23 and name HN )(resid 22 and name HB* ) 2.00 0.20 2.50 assign (resid 23 and name HN )(resid 23 and name HA ) 2.00 0.20 1.50 assign (resid 23 and name HN )(resid 23 and name HB* ) 2.00 0.20 1.50 assign (resid 23 and name HN )(resid 23 and name HD* ) 2.00 0.20 4.00 assign (resid 23 and name HN )(resid 24 and name HN ) 2.00 0.20 3.00 assign (resid 23 and name HN )(resid 26 and name HA ) 2.00 0.20 2.50 assign (resid 23 and name HN )(resid 26 and name HN ) 2.00 0.20 2.00 assign (resid 23 and name HN )(resid 27 and name HA ) 2.00 0.20 2.00 assign (resid 23 and name HN )(resid 28 and name HN ) 2.00 0.20 3.50 remarks Gly24 assign (resid 24 and name HN )(resid 11 and name HA ) 2.00 0.20 3.50 assign (resid 24 and name HN )(resid 11 and name HB* ) 2.00 0.20 2.00 assign (resid 24 and name HN )(resid 11 and name HD2* ) 2.00 0.20 3.50 assign (resid 24 and name HN )(resid 12 and name HA ) 2.00 0.20 2.50 assign (resid 24 and name HN )(resid 23 and name HA ) 2.00 0.20 0.80 assign (resid 24 and name HN )(resid 23 and name HB* ) 2.00 0.20 2.50 assign (resid 24 and name HN )(resid 23 and name HG ) 2.00 0.20 2.00 assign (resid 24 and name HN )(resid 23 and name HD* ) 2.00 0.20 4.50 assign (resid 24 and name HN )(resid 24 and name HA* ) 2.00 0.20 0.80 assign (resid 24 and name HN )(resid 25 and name HN ) 2.00 0.20 3.00 assign (resid 24 and name HN )(resid 26 and name HN ) 2.00 0.20 3.50 remarks Glu25 assign (resid 25 and name HN )(resid 24 and name HA* ) 2.00 0.20 1.50 assign (resid 25 and name HN )(resid 24 and name HN ) 2.00 0.20 3.00 assign (resid 25 and name HN )(resid 25 and name HA ) 2.00 0.20 1.50 assign (resid 25 and name HN )(resid 25 and name HB* ) 2.00 0.20 2.00 assign (resid 25 and name HN )(resid 25 and name HG* ) 2.00 0.20 2.50 assign (resid 25 and name HN )(resid 26 and name HN ) 2.00 0.20 0.80 remarks Thr26 assign (resid 26 and name HN )(resid 22 and name HA ) 2.00 0.20 3.50 assign (resid 26 and name HN )(resid 22 and name HB* ) 2.00 0.20 3.00 assign (resid 26 and name HN )(resid 23 and name HG ) 2.00 0.20 3.00 assign (resid 26 and name HN )(resid 24 and name HA* ) 2.00 0.20 2.50 assign (resid 26 and name HN )(resid 25 and name HA ) 2.00 0.20 1.50 assign (resid 26 and name HN )(resid 25 and name HB* ) 2.00 0.20 2.00 assign (resid 26 and name HN )(resid 25 and name HG* ) 2.00 0.20 3.50 assign (resid 26 and name HN )(resid 26 and name HA ) 2.00 0.20 1.50 assign (resid 26 and name HN )(resid 26 and name HB ) 2.00 0.20 2.00 assign (resid 26 and name HN )(resid 26 and name HG2* ) 2.00 0.20 3.50 assign (resid 26 and name HN )(resid 27 and name HN ) 2.00 0.20 3.00 remarks Ala27 assign (resid 27 and name HN )(resid 22 and name HA ) 2.00 0.20 3.50 assign (resid 27 and name HN )(resid 22 and name HB* ) 2.00 0.20 5.00 assign (resid 27 and name HN )(resid 22 and name HD1 ) 2.00 0.20 2.50 assign (resid 27 and name HN )(resid 22 and name HE1 ) 2.00 0.20 3.50 assign (resid 27 and name HN )(resid 23 and name HB* ) 2.00 0.20 5.50 assign (resid 27 and name HN )(resid 26 and name HA ) 2.00 0.20 2.00 assign (resid 27 and name HN )(resid 26 and name HB ) 2.00 0.20 1.00 assign (resid 27 and name HN )(resid 26 and name HG2* ) 2.00 0.20 4.00 assign (resid 27 and name HN )(resid 27 and name HA ) 2.00 0.20 2.00 assign (resid 27 and name HN )(resid 27 and name HB* ) 2.00 0.20 3.00 assign (resid 27 and name HN )(resid 28 and name HN ) 2.00 0.20 3.50 remarks Leu28 assign (resid 28 and name HN )(resid 22 and name HA ) 2.00 0.20 0.80 assign (resid 28 and name HN )(resid 22 and name HB* ) 2.00 0.20 4.00 assign (resid 27 and name HN )(resid 22 and name HD1 ) 2.00 0.20 3.50 assign (resid 28 and name HN )(resid 23 and name HB* ) 2.00 0.20 4.50 assign (resid 28 and name HN )(resid 27 and name HA ) 2.00 0.20 0.80 assign (resid 28 and name HN )(resid 27 and name HB* ) 2.00 0.20 3.50 assign (resid 28 and name HN )(resid 28 and name HA ) 2.00 0.20 1.50 assign (resid 28 and name HN )(resid 28 and name HB* ) 2.00 0.20 2.50 assign (resid 28 and name HN )(resid 28 and name HG ) 2.00 0.20 2.50 assign (resid 28 and name HN )(resid 28 and name HD* ) 2.00 0.20 4.00 remarks Asp29 assign (resid 29 and name HN )(resid 28 and name HA ) 2.00 0.20 0.80 assign (resid 29 and name HN )(resid 28 and name HB* ) 2.00 0.20 3.00 assign (resid 29 and name HN )(resid 28 and name HG ) 2.00 0.20 1.50 assign (resid 29 and name HN )(resid 28 and name HD* ) 2.00 0.20 4.50 assign (resid 29 and name HN )(resid 29 and name HA ) 2.00 0.20 2.50 assign (resid 29 and name HN )(resid 29 and name HB* ) 2.00 0.20 1.50 assign (resid 29 and name HN )(resid 30 and name HN ) 2.00 0.20 2.50 remarks Leu30 assign (resid 30 and name HN )(resid 28 and name HG ) 2.00 0.20 3.50 assign (resid 30 and name HN )(resid 29 and name HA ) 2.00 0.20 0.80 assign (resid 30 and name HN )(resid 29 and name HB* ) 2.00 0.20 2.00 assign (resid 30 and name HN )(resid 30 and name HA ) 2.00 0.20 2.00 assign (resid 30 and name HN )(resid 30 and name HB* ) 2.00 0.20 2.50 assign (resid 30 and name HN )(resid 30 and name HG ) 2.00 0.20 1.50 assign (resid 30 and name HN )(resid 30 and name HD* ) 2.00 0.20 4.50 assign (resid 30 and name HN )(resid 35 and name HB* ) 2.00 0.20 5.00 assign (resid 30 and name HN )(resid 31 and name HN ) 2.00 0.20 3.00 remarks Thr31 assign (resid 31 and name HN )(resid 30 and name HA ) 2.00 0.20 1.00 assign (resid 31 and name HN )(resid 30 and name HB* ) 2.00 0.20 3.00 assign (resid 31 and name HN )(resid 30 and name HG ) 2.00 0.20 2.50 assign (resid 31 and name HN )(resid 30 and name HD* ) 2.00 0.20 4.50 assign (resid 31 and name HN )(resid 31 and name HA ) 2.00 0.20 2.50 assign (resid 31 and name HN )(resid 31 and name HB ) 2.00 0.20 2.50 assign (resid 31 and name HN )(resid 31 and name HG2* ) 2.00 0.20 4.00 assign (resid 31 and name HN )(resid 34 and name HN ) 2.00 0.20 2.50 assign (resid 31 and name HN )(resid 34 and name HB* ) 2.00 0.20 3.00 assign (resid 31 and name HN )(resid 35 and name HB* ) 2.00 0.20 5.00 assign (resid 31 and name HN )(resid 77 and name HA ) 2.00 0.20 3.50 remarks Pro32 remarks Lys33 assign (resid 33 and name HN )(resid 32 and name HA ) 2.00 0.20 3.00 assign (resid 33 and name HN )(resid 32 and name HB* ) 2.00 0.20 3.50 assign (resid 33 and name HN )(resid 33 and name HA ) 2.00 0.20 1.50 assign (resid 33 and name HN )(resid 33 and name HB* ) 2.00 0.20 2.50 assign (resid 33 and name HN )(resid 33 and name HG* ) 2.00 0.20 3.50 assign (resid 33 and name HN )(resid 33 and name HD* ) 2.00 0.20 3.50 assign (resid 33 and name HN )(resid 33 and name HE* ) 2.00 0.20 4.00 assign (resid 33 and name HN )(resid 34 and name HN ) 2.00 0.20 2.00 assign (resid 33 and name HN )(resid 35 and name HB* ) 2.00 0.20 4.00 remarks Glu34 assign (resid 34 and name HN )(resid 33 and name HA ) 2.00 0.20 3.00 assign (resid 34 and name HN )(resid 33 and name HB* ) 2.00 0.20 4.50 assign (resid 34 and name HN )(resid 33 and name HG* ) 2.00 0.20 4.50 assign (resid 34 and name HN )(resid 34 and name HA ) 2.00 0.20 2.50 assign (resid 34 and name HN )(resid 34 and name HB* ) 2.00 0.20 3.50 assign (resid 34 and name HN )(resid 34 and name HG* ) 2.00 0.20 3.50 assign (resid 34 and name HN )(resid 35 and name HN ) 2.00 0.20 2.50 assign (resid 34 and name HN )(resid 36 and name HN ) 2.00 0.20 3.50 assign (resid 34 and name HN )(resid 77 and name HD* ) 2.00 0.20 6.00 remarks Tyr35 assign (resid 35 and name HN )(resid 30 and name HD* ) 2.00 0.20 4.50 assign (resid 35 and name HN )(resid 32 and name HA ) 2.00 0.20 2.50 assign (resid 35 and name HN )(resid 33 and name HA ) 2.00 0.20 3.50 assign (resid 35 and name HE* )(resid 15 and name HA ) 2.00 0.20 5.00 assign (resid 35 and name HN )(resid 34 and name HA ) 2.00 0.20 2.50 assign (resid 35 and name HN )(resid 34 and name HB* ) 2.00 0.20 3.50 assign (resid 35 and name HN )(resid 35 and name HA ) 2.00 0.20 1.50 assign (resid 35 and name HN )(resid 35 and name HB* ) 2.00 0.20 0.80 assign (resid 35 and name HN )(resid 35 and name HD* ) 2.00 0.20 3.50 assign (resid 35 and name HN )(resid 36 and name HN ) 2.00 0.20 0.80 assign (resid 35 and name HN )(resid 37 and name HN ) 2.00 0.20 3.50 assign (resid 35 and name HD* )(resid 16 and name HA ) 2.00 0.20 3.50 assign (resid 35 and name HD* )(resid 21 and name HG* ) 2.00 0.20 5.00 assign (resid 35 and name HE* )(resid 16 and name HA ) 2.00 0.20 5.00 assign (resid 35 and name HE* )(resid 16 and name HG* ) 2.00 0.20 6.00 assign (resid 35 and name HE* )(resid 17 and name HG2* ) 2.00 0.20 6.00 assign (resid 35 and name HE* )(resid 19 and name HA ) 2.00 0.20 3.50 assign (resid 35 and name HE* )(resid 20 and name HA ) 2.00 0.20 4.50 assign (resid 35 and name HE* )(resid 21 and name HG* ) 2.00 0.20 4.00 remarks Ala36 assign (resid 36 and name HN )(resid 32 and name HA ) 2.00 0.20 3.50 assign (resid 36 and name HN )(resid 33 and name HA ) 2.00 0.20 1.50 assign (resid 36 and name HN )(resid 35 and name HB* ) 2.00 0.20 3.00 assign (resid 36 and name HN )(resid 35 and name HD* ) 2.00 0.20 4.00 assign (resid 36 and name HN )(resid 36 and name HA ) 2.00 0.20 1.50 assign (resid 36 and name HN )(resid 36 and name HB* ) 2.00 0.20 2.50 assign (resid 36 and name HN )(resid 37 and name HN ) 2.00 0.20 0.80 assign (resid 36 and name HN )(resid 38 and name HN ) 2.00 0.20 2.00 assign (resid 36 and name HN )(resid 38 and name HD* ) 2.00 0.20 5.50 assign (resid 36 and name HN )(resid 58 and name HD1* ) 2.00 0.20 6.00 assign (resid 36 and name HN )(resid 58 and name HG2* ) 2.00 0.20 6.00 remarks Leu37 assign (resid 37 and name HN )(resid 34 and name HA ) 2.00 0.20 2.50 assign (resid 37 and name HN )(resid 36 and name HA ) 2.00 0.20 2.50 assign (resid 37 and name HN )(resid 36 and name HB* ) 2.00 0.20 3.50 assign (resid 37 and name HN )(resid 37 and name HA ) 2.00 0.20 1.50 assign (resid 37 and name HN )(resid 37 and name HB* ) 2.00 0.20 2.50 assign (resid 37 and name HN )(resid 37 and name HG ) 2.00 0.20 2.50 assign (resid 37 and name HN )(resid 37 and name HD* ) 2.00 0.20 3.50 assign (resid 37 and name HN )(resid 38 and name HN ) 2.00 0.20 1.50 assign (resid 37 and name HN )(resid 39 and name HN ) 2.00 0.20 3.00 assign (resid 37 and name HN )(resid 57 and name HB* ) 2.00 0.20 3.50 assign (resid 37 and name HN )(resid 77 and name HD* ) 2.00 0.20 5.50 remarks Leu38 assign (resid 38 and name HN )(resid 35 and name HA ) 2.00 0.20 2.00 assign (resid 38 and name HN )(resid 37 and name HA ) 2.00 0.20 2.50 assign (resid 38 and name HN )(resid 37 and name HB* ) 2.00 0.20 2.50 assign (resid 38 and name HN )(resid 37 and name HD* ) 2.00 0.20 5.50 assign (resid 38 and name HN )(resid 38 and name HA ) 2.00 0.20 1.50 assign (resid 38 and name HN )(resid 38 and name HB* ) 2.00 0.20 2.50 assign (resid 38 and name HN )(resid 38 and name HG ) 2.00 0.20 2.50 assign (resid 38 and name HN )(resid 38 and name HD* ) 2.00 0.20 3.50 remarks Ser39 assign (resid 39 and name HN )(resid 38 and name HA ) 2.00 0.20 2.50 assign (resid 39 and name HN )(resid 38 and name HB* ) 2.00 0.20 2.00 assign (resid 39 and name HN )(resid 38 and name HG ) 2.00 0.20 3.00 assign (resid 39 and name HN )(resid 38 and name HD* ) 2.00 0.20 3.50 assign (resid 39 and name HN )(resid 39 and name HA ) 2.00 0.20 1.50 assign (resid 39 and name HN )(resid 39 and name HB* ) 2.00 0.20 2.00 assign (resid 39 and name HN )(resid 40 and name HN ) 2.00 0.20 1.50 assign (resid 39 and name HN )(resid 40 and name HB* ) 2.00 0.20 3.50 assign (resid 39 and name HN )(resid 41 and name HN ) 2.00 0.20 3.50 remarks Arg40 assign (resid 40 and name HN )(resid 38 and name HA ) 2.00 0.20 2.50 assign (resid 40 and name HN )(resid 38 and name HD* ) 2.00 0.20 5.00 assign (resid 40 and name HN )(resid 39 and name HA ) 2.00 0.20 2.50 assign (resid 40 and name HN )(resid 39 and name HB* ) 2.00 0.20 2.00 assign (resid 40 and name HN )(resid 40 and name HA ) 2.00 0.20 1.50 assign (resid 40 and name HN )(resid 40 and name HB* ) 2.00 0.20 1.50 assign (resid 40 and name HN )(resid 40 and name HG* ) 2.00 0.20 3.50 assign (resid 40 and name HN )(resid 40 and name HD* ) 2.00 0.20 4.50 assign (resid 40 and name HN )(resid 41 and name HN ) 2.00 0.20 1.50 assign (resid 40 and name HN )(resid 42 and name HN ) 2.00 0.20 3.00 assign (resid 40 and name HN )(resid 54 and name HA ) 2.00 0.20 3.50 assign (resid 40 and name HN )(resid 54 and name HD* ) 2.00 0.20 6.00 assign (resid 40 and name HN )(resid 57 and name HB* ) 2.00 0.20 4.50 remarks Leu41 assign (resid 41 and name HN )(resid 38 and name HA ) 2.00 0.20 2.50 assign (resid 41 and name HN )(resid 39 and name HA ) 2.00 0.20 3.50 assign (resid 41 and name HN )(resid 40 and name HA ) 2.00 0.20 2.00 assign (resid 41 and name HN )(resid 40 and name HB* ) 2.00 0.20 1.50 assign (resid 41 and name HN )(resid 40 and name HG* ) 2.00 0.20 3.50 assign (resid 41 and name HN )(resid 41 and name HA ) 2.00 0.20 2.00 assign (resid 41 and name HN )(resid 41 and name HB* ) 2.00 0.20 2.00 assign (resid 41 and name HN )(resid 41 and name HG* ) 2.00 0.20 3.50 assign (resid 41 and name HN )(resid 41 and name HD* ) 2.00 0.20 3.00 assign (resid 41 and name HN )(resid 43 and name HN ) 2.00 0.20 3.50 assign (resid 41 and name HN )(resid 54 and name HD* ) 2.00 0.20 5.50 remarks Met42 assign (resid 42 and name HN )(resid 39 and name HA ) 2.00 0.20 2.50 assign (resid 42 and name HN )(resid 40 and name HB* ) 2.00 0.20 3.50 assign (resid 42 and name HN )(resid 41 and name HA ) 2.00 0.20 2.50 assign (resid 42 and name HN )(resid 41 and name HB* ) 2.00 0.20 2.50 assign (resid 42 and name HN )(resid 41 and name HG* ) 2.00 0.20 4.50 assign (resid 42 and name HN )(resid 41 and name HD* ) 2.00 0.20 3.50 assign (resid 42 and name HN )(resid 42 and name HA ) 2.00 0.20 1.50 assign (resid 42 and name HN )(resid 42 and name HB* ) 2.00 0.20 1.50 assign (resid 42 and name HN )(resid 43 and name HN ) 2.00 0.20 1.00 assign (resid 42 and name HN )(resid 44 and name HN ) 2.00 0.20 2.50 remarks Met43 assign (resid 43 and name HN )(resid 7 and name HD1* ) 2.00 0.20 5.00 assign (resid 43 and name HN )(resid 40 and name HA ) 2.00 0.20 2.50 assign (resid 43 and name HN )(resid 41 and name HA ) 2.00 0.20 2.50 assign (resid 43 and name HN )(resid 42 and name HA ) 2.00 0.20 1.50 assign (resid 43 and name HN )(resid 42 and name HB* ) 2.00 0.20 2.50 assign (resid 43 and name HN )(resid 43 and name HA ) 2.00 0.20 0.80 assign (resid 43 and name HN )(resid 43 and name HB* ) 2.00 0.20 2.50 assign (resid 43 and name HN )(resid 43 and name HG* ) 2.00 0.20 2.50 assign (resid 43 and name HN )(resid 44 and name HA ) 2.00 0.20 3.50 assign (resid 43 and name HN )(resid 44 and name HB* ) 2.00 0.20 3.50 assign (resid 43 and name HN )(resid 44 and name HN ) 2.00 0.20 1.00 assign (resid 43 and name HN )(resid 45 and name HN ) 2.00 0.20 3.00 remarks Lys44 assign (resid 44 and name HN )(resid 7 and name HD1* ) 2.00 0.20 5.50 assign (resid 44 and name HN )(resid 40 and name HA ) 2.00 0.20 2.50 assign (resid 44 and name HN )(resid 42 and name HB* ) 2.00 0.20 5.50 assign (resid 44 and name HN )(resid 43 and name HA ) 2.00 0.20 1.50 assign (resid 44 and name HN )(resid 43 and name HB* ) 2.00 0.20 3.50 assign (resid 44 and name HN )(resid 43 and name HG* ) 2.00 0.20 3.50 assign (resid 44 and name HN )(resid 44 and name HA ) 2.00 0.20 1.50 assign (resid 44 and name HN )(resid 44 and name HB* ) 2.00 0.20 2.50 assign (resid 44 and name HN )(resid 44 and name HG* ) 2.00 0.20 2.50 assign (resid 44 and name HN )(resid 44 and name HD* ) 2.00 0.20 3.50 assign (resid 44 and name HN )(resid 45 and name HA ) 2.00 0.20 3.50 assign (resid 44 and name HN )(resid 45 and name HN ) 2.00 0.20 1.50 assign (resid 44 and name HN )(resid 49 and name HG* ) 2.00 0.20 5.00 remarks Ala45 assign (resid 45 and name HN )(resid 7 and name HD1* ) 2.00 0.20 4.50 assign (resid 45 and name HN )(resid 42 and name HA ) 2.00 0.20 1.80 assign (resid 45 and name HN )(resid 42 and name HB* ) 2.00 0.20 3.50 assign (resid 45 and name HN )(resid 43 and name HA ) 2.00 0.20 2.50 assign (resid 45 and name HN )(resid 44 and name HA ) 2.00 0.20 1.50 assign (resid 45 and name HN )(resid 44 and name HB* ) 2.00 0.20 3.50 assign (resid 45 and name HN )(resid 44 and name HG* ) 2.00 0.20 3.50 assign (resid 45 and name HN )(resid 45 and name HA ) 2.00 0.20 0.80 assign (resid 45 and name HN )(resid 45 and name HB* ) 2.00 0.20 3.00 assign (resid 45 and name HN )(resid 46 and name HN ) 2.00 0.20 3.00 assign (resid 45 and name HN )(resid 47 and name HN ) 2.00 0.20 3.50 assign (resid 45 and name HN )(resid 96 and name HB* ) 2.00 0.20 4.00 remarks Gly46 assign (resid 46 and name HN )(resid 44 and name HB* ) 2.00 0.20 4.50 assign (resid 46 and name HN )(resid 45 and name HA ) 2.00 0.20 1.50 assign (resid 46 and name HN )(resid 45 and name HB* ) 2.00 0.20 4.00 assign (resid 46 and name HN )(resid 46 and name HA* ) 2.00 0.20 1.50 assign (resid 46 and name HN )(resid 47 and name HN ) 2.00 0.20 1.50 assign (resid 46 and name HN )(resid 95 and name HG* ) 2.00 0.20 5.50 assign (resid 46 and name HN )(resid 96 and name HN ) 2.00 0.20 3.50 assign (resid 46 and name HN )(resid 96 and name HB* ) 2.00 0.20 5.50 assign (resid 46 and name HN )(resid 96 and name HD* ) 2.00 0.20 5.50 remarks Ser47 assign (resid 47 and name HN )(resid 45 and name HB* ) 2.00 0.20 4.50 assign (resid 47 and name HN )(resid 46 and name HA* ) 2.00 0.20 2.00 assign (resid 47 and name HN )(resid 47 and name HA ) 2.00 0.20 1.50 assign (resid 47 and name HN )(resid 47 and name HB* ) 2.00 0.20 2.50 assign (resid 47 and name HN )(resid 95 and name HA ) 2.00 0.20 2.50 assign (resid 47 and name HN )(resid 95 and name HB* ) 2.00 0.20 3.50 assign (resid 47 and name HN )(resid 95 and name HG* ) 2.00 0.20 4.00 assign (resid 47 and name HN )(resid 96 and name HD* ) 2.00 0.20 6.00 remarks Pro48 remarks Val49 assign (resid 49 and name HN )(resid 48 and name HA ) 2.00 0.20 2.50 assign (resid 49 and name HN )(resid 48 and name HB* ) 2.00 0.20 3.00 assign (resid 49 and name HN )(resid 49 and name HA ) 2.00 0.20 0.80 assign (resid 49 and name HN )(resid 49 and name HB ) 2.00 0.20 1.50 assign (resid 49 and name HN )(resid 49 and name HG* ) 2.00 0.20 4.50 assign (resid 49 and name HN )(resid 50 and name HN ) 2.00 0.20 3.50 assign (resid 49 and name HN )(resid 92 and name HE* ) 2.00 0.20 6.00 assign (resid 49 and name HN )(resid 94 and name HN ) 2.00 0.20 1.50 assign (resid 49 and name HN )(resid 95 and name HA ) 2.00 0.20 3.00 assign (resid 49 and name HN )(resid 95 and name HB* ) 2.00 0.20 2.50 assign (resid 49 and name HN )(resid 96 and name HN ) 2.00 0.20 3.80 assign (resid 49 and name HN )(resid 96 and name HD* ) 2.00 0.20 6.00 remarks His50 assign (resid 50 and name HN )(resid 49 and name HA ) 2.00 0.20 1.50 assign (resid 50 and name HN )(resid 49 and name HB ) 2.00 0.20 2.50 assign (resid 50 and name HN )(resid 49 and name HG* ) 2.00 0.20 3.50 assign (resid 50 and name HN )(resid 50 and name HA ) 2.00 0.20 2.50 assign (resid 50 and name HN )(resid 50 and name HB* ) 2.00 0.20 2.00 assign (resid 50 and name HN )(resid 52 and name HN ) 2.00 0.20 3.50 assign (resid 50 and name HN )(resid 51 and name HN ) 2.00 0.20 3.50 assign (resid 50 and name HN )(resid 53 and name HN ) 2.00 0.20 3.50 assign (resid 50 and name HN )(resid 53 and name HB ) 2.00 0.20 2.50 assign (resid 50 and name HN )(resid 53 and name HG1* ) 2.00 0.20 3.50 assign (resid 50 and name HN )(resid 53 and name HD1* ) 2.00 0.20 3.50 assign (resid 50 and name HN )(resid 92 and name HE* ) 2.00 0.20 4.50 ! assign (resid 50 and name HN )(resid 92 and name HZ ) 2.00 0.20 3.50 ! assign (resid 50 and name HD2 )(resid 50 and name HA ) 2.00 0.20 2.50 ! assign (resid 50 and name HD2 )(resid 50 and name HB* ) 2.00 0.20 3.00 ! assign (resid 50 and name HD2 )(resid 92 and name HA ) 2.00 0.20 3.00 ! assign (resid 50 and name HD2 )(resid 92 and name HD* ) 2.00 0.20 4.50 ! assign (resid 50 and name HD2 )(resid 92 and name HE* ) 2.00 0.20 4.00 ! assign (resid 50 and name HD2 )(resid 92 and name HZ ) 2.00 0.20 3.50 ! remarks Arg51 assign (resid 51 and name HN )(resid 49 and name HG* ) 2.00 0.20 4.50 assign (resid 51 and name HN )(resid 50 and name HA ) 2.00 0.20 1.50 assign (resid 51 and name HN )(resid 50 and name HB* ) 2.00 0.20 3.50 assign (resid 51 and name HN )(resid 51 and name HA ) 2.00 0.20 2.00 assign (resid 51 and name HN )(resid 51 and name HB* ) 2.00 0.20 1.50 assign (resid 51 and name HN )(resid 51 and name HG* ) 2.00 0.20 3.00 assign (resid 51 and name HN )(resid 51 and name HD* ) 2.00 0.20 4.50 assign (resid 51 and name HN )(resid 52 and name HB* ) 2.00 0.20 4.50 assign (resid 51 and name HN )(resid 52 and name HG* ) 2.00 0.20 5.00 assign (resid 51 and name HN )(resid 52 and name HN ) 2.00 0.20 2.00 assign (resid 51 and name HN )(resid 53 and name HN ) 2.00 0.20 3.00 assign (resid 51 and name HN )(resid 56 and name HD2* ) 2.00 0.20 6.00 assign (resid 51 and name HN )(resid 92 and name HD* ) 2.00 0.20 5.00 assign (resid 51 and name HN )(resid 93 and name HA* ) 2.00 0.20 2.00 remarks Glu52 assign (resid 52 and name HN )(resid 50 and name HB* ) 2.00 0.20 4.50 assign (resid 52 and name HN )(resid 51 and name HA ) 2.00 0.20 3.50 assign (resid 52 and name HN )(resid 51 and name HB* ) 2.00 0.20 3.50 assign (resid 52 and name HN )(resid 51 and name HG* ) 2.00 0.20 3.50 assign (resid 52 and name HN )(resid 52 and name HA ) 2.00 0.20 1.50 assign (resid 52 and name HN )(resid 52 and name HB* ) 2.00 0.20 2.50 assign (resid 52 and name HN )(resid 52 and name HG* ) 2.00 0.20 3.50 assign (resid 52 and name HN )(resid 53 and name HN ) 2.00 0.20 1.50 remarks Ile53 assign (resid 53 and name HN )(resid 50 and name HB* ) 2.00 0.20 2.50 assign (resid 53 and name HN )(resid 52 and name HA ) 2.00 0.20 2.00 assign (resid 53 and name HN )(resid 52 and name HB* ) 2.00 0.20 2.50 assign (resid 53 and name HN )(resid 52 and name HG* ) 2.00 0.20 4.50 assign (resid 53 and name HN )(resid 53 and name HA ) 2.00 0.20 1.50 assign (resid 53 and name HN )(resid 53 and name HB ) 2.00 0.20 1.50 assign (resid 53 and name HN )(resid 53 and name HG1* ) 2.00 0.20 1.50 assign (resid 53 and name HN )(resid 53 and name HG2* ) 2.00 0.20 3.50 assign (resid 53 and name HN )(resid 53 and name HD1* ) 2.00 0.20 3.50 assign (resid 53 and name HN )(resid 54 and name HG ) 2.00 0.20 3.50 assign (resid 53 and name HN )(resid 55 and name HB* ) 2.00 0.20 5.00 remarks Leu54 assign (resid 54 and name HN )(resid 53 and name HA ) 2.00 0.20 2.00 assign (resid 54 and name HN )(resid 53 and name HB ) 2.00 0.20 1.50 assign (resid 54 and name HN )(resid 53 and name HG1* ) 2.00 0.20 4.00 assign (resid 54 and name HN )(resid 53 and name HG2* ) 2.00 0.20 4.00 assign (resid 54 and name HN )(resid 54 and name HA ) 2.00 0.20 1.50 assign (resid 54 and name HN )(resid 54 and name HB* ) 2.00 0.20 1.50 assign (resid 54 and name HN )(resid 54 and name HG ) 2.00 0.20 1.50 assign (resid 54 and name HN )(resid 54 and name HD* ) 2.00 0.20 4.50 assign (resid 54 and name HN )(resid 55 and name HB* ) 2.00 0.20 4.50 assign (resid 54 and name HN )(resid 55 and name HN ) 2.00 0.20 2.00 remarks Tyr55 assign (resid 55 and name HN )(resid 53 and name HA ) 2.00 0.20 2.50 assign (resid 55 and name HN )(resid 53 and name HB ) 2.00 0.20 3.50 assign (resid 55 and name HN )(resid 53 and name HG2* ) 2.00 0.20 4.50 assign (resid 55 and name HN )(resid 53 and name HD1* ) 2.00 0.20 6.00 assign (resid 55 and name HN )(resid 54 and name HA ) 2.00 0.20 1.50 assign (resid 55 and name HN )(resid 54 and name HB* ) 2.00 0.20 2.50 assign (resid 55 and name HN )(resid 54 and name HG ) 2.00 0.20 2.50 assign (resid 55 and name HN )(resid 54 and name HD* ) 2.00 0.20 5.00 assign (resid 55 and name HN )(resid 55 and name HA ) 2.00 0.20 1.50 assign (resid 55 and name HN )(resid 55 and name HB* ) 2.00 0.20 2.50 assign (resid 55 and name HN )(resid 55 and name HD* ) 2.00 0.20 4.50 assign (resid 55 and name HN )(resid 55 and name HE* ) 2.00 0.20 5.50 assign (resid 55 and name HN )(resid 56 and name HN ) 2.00 0.20 1.50 assign (resid 55 and name HN )(resid 57 and name HN ) 2.00 0.20 3.00 assign (resid 55 and name HD* )(resid 70 and name HD* ) 2.00 0.20 6.50 assign (resid 55 and name HE* )(resid 55 and name HA ) 2.00 0.20 4.50 assign (resid 55 and name HE* )(resid 55 and name HB* ) 2.00 0.20 5.00 assign (resid 55 and name HE* )(resid 70 and name HD* ) 2.00 0.20 5.50 remarks Asn56 assign (resid 56 and name HN )(resid 53 and name HA ) 2.00 0.20 2.50 assign (resid 56 and name HN )(resid 53 and name HG2* ) 2.00 0.20 5.50 assign (resid 56 and name HN )(resid 53 and name HD1* ) 2.00 0.20 6.00 assign (resid 56 and name HN )(resid 53 and name HN ) 2.00 0.20 3.50 assign (resid 56 and name HN )(resid 54 and name HG* ) 2.00 0.20 6.00 assign (resid 56 and name HN )(resid 55 and name HA ) 2.00 0.20 1.50 assign (resid 56 and name HN )(resid 55 and name HB* ) 2.00 0.20 3.00 assign (resid 56 and name HN )(resid 55 and name HD* ) 2.00 0.20 5.00 assign (resid 56 and name HN )(resid 56 and name HA ) 2.00 0.20 0.80 assign (resid 56 and name HN )(resid 56 and name HB* ) 2.00 0.20 2.50 assign (resid 56 and name HN )(resid 57 and name HB* ) 2.00 0.20 3.50 assign (resid 56 and name HD2* )(resid 53 and name HA ) 2.00 0.20 2.50 assign (resid 56 and name HD2* )(resid 53 and name HG2* ) 2.00 0.20 5.50 remarks Asp57 assign (resid 57 and name HN )(resid 36 and name HB* ) 2.00 0.20 4.50 assign (resid 57 and name HN )(resid 37 and name HB* ) 2.00 0.20 4.50 assign (resid 57 and name HN )(resid 37 and name HG ) 2.00 0.20 4.00 assign (resid 57 and name HN )(resid 37 and name HD* ) 2.00 0.20 5.50 assign (resid 57 and name HN )(resid 53 and name HA ) 2.00 0.20 3.50 assign (resid 57 and name HN )(resid 54 and name HA ) 2.00 0.20 1.50 assign (resid 57 and name HN )(resid 54 and name HD* ) 2.00 0.20 5.50 assign (resid 57 and name HN )(resid 56 and name HA ) 2.00 0.20 1.50 assign (resid 57 and name HN )(resid 56 and name HB* ) 2.00 0.20 2.50 assign (resid 57 and name HN )(resid 57 and name HA ) 2.00 0.20 0.80 assign (resid 57 and name HN )(resid 57 and name HB* ) 2.00 0.20 1.50 assign (resid 57 and name HN )(resid 58 and name HB ) 2.00 0.20 3.50 assign (resid 57 and name HN )(resid 58 and name HG1* ) 2.00 0.20 4.00 assign (resid 57 and name HN )(resid 58 and name HN ) 2.00 0.20 2.00 remarks Ile58 assign (resid 58 and name HN )(resid 36 and name HB* ) 2.00 0.20 6.00 assign (resid 58 and name HN )(resid 55 and name HA ) 2.00 0.20 2.00 assign (resid 58 and name HN )(resid 57 and name HA ) 2.00 0.20 1.50 assign (resid 58 and name HN )(resid 57 and name HB* ) 2.00 0.20 1.50 assign (resid 58 and name HN )(resid 58 and name HA ) 2.00 0.20 1.50 assign (resid 58 and name HN )(resid 58 and name HB ) 2.00 0.20 1.50 assign (resid 58 and name HN )(resid 58 and name HG1* ) 2.00 0.20 2.50 assign (resid 58 and name HN )(resid 58 and name HG2* ) 2.00 0.20 4.50 assign (resid 58 and name HN )(resid 58 and name HD1* ) 2.00 0.20 4.50 assign (resid 58 and name HN )(resid 59 and name HB* ) 2.00 0.20 4.00 assign (resid 58 and name HN )(resid 59 and name HN ) 2.00 0.20 2.00 remarks Tyr59 assign (resid 59 and name HN )(resid 56 and name HA ) 2.00 0.20 1.50 assign (resid 59 and name HN )(resid 57 and name HB* ) 2.00 0.20 3.50 assign (resid 59 and name HN )(resid 58 and name HA ) 2.00 0.20 1.50 assign (resid 59 and name HN )(resid 58 and name HB ) 2.00 0.20 2.50 assign (resid 59 and name HN )(resid 58 and name HG1* ) 2.00 0.20 2.50 assign (resid 59 and name HN )(resid 58 and name HG2* ) 2.00 0.20 5.50 assign (resid 59 and name HN )(resid 58 and name HD1* ) 2.00 0.20 5.50 assign (resid 59 and name HN )(resid 59 and name HA ) 2.00 0.20 1.50 assign (resid 59 and name HN )(resid 59 and name HB* ) 2.00 0.20 2.00 assign (resid 59 and name HN )(resid 59 and name HD* ) 2.00 0.20 4.00 assign (resid 59 and name HN )(resid 59 and name HE* ) 2.00 0.20 6.00 assign (resid 59 and name HD* )(resid 55 and name HA ) 2.00 0.20 4.50 assign (resid 59 and name HD* )(resid 55 and name HB* ) 2.00 0.20 5.50 assign (resid 59 and name HD* )(resid 55 and name HD* ) 2.00 0.20 5.00 assign (resid 59 and name HE* )(resid 55 and name HD* ) 2.00 0.20 5.50 assign (resid 59 and name HE* )(resid 55 and name HE* ) 2.00 0.20 5.50 assign (resid 59 and name HD* )(resid 56 and name HA ) 2.00 0.20 4.50 remarks Ser60 assign (resid 60 and name HN )(resid 56 and name HA ) 2.00 0.20 3.50 assign (resid 60 and name HN )(resid 56 and name HB* ) 2.00 0.20 5.00 assign (resid 60 and name HN )(resid 59 and name HA ) 2.00 0.20 1.50 assign (resid 60 and name HN )(resid 59 and name HB* ) 2.00 0.20 3.00 assign (resid 60 and name HN )(resid 59 and name HD* ) 2.00 0.20 4.00 assign (resid 60 and name HN )(resid 60 and name HA ) 2.00 0.20 1.50 assign (resid 60 and name HN )(resid 60 and name HB* ) 2.00 0.20 2.50 assign (resid 60 and name HN )(resid 61 and name HN ) 2.00 0.20 2.50 remarks Trp61 assign (resid 61 and name HN )(resid 59 and name HA ) 2.00 0.20 2.00 assign (resid 61 and name HN )(resid 60 and name HA ) 2.00 0.20 1.50 assign (resid 61 and name HN )(resid 60 and name HB* ) 2.00 0.20 3.50 assign (resid 61 and name HN )(resid 61 and name HA ) 2.00 0.20 1.50 assign (resid 61 and name HN )(resid 61 and name HB* ) 2.00 0.20 2.50 assign (resid 61 and name HN )(resid 61 and name HD1 ) 2.00 0.20 2.50 remarks Asp62 assign (resid 62 and name HN )(resid 60 and name HA ) 2.00 0.20 3.00 assign (resid 62 and name HN )(resid 60 and name HB* ) 2.00 0.20 3.50 assign (resid 62 and name HN )(resid 61 and name HA ) 2.00 0.20 1.50 assign (resid 62 and name HN )(resid 61 and name HB* ) 2.00 0.20 2.50 assign (resid 62 and name HN )(resid 61 and name HD1 ) 2.00 0.20 3.50 assign (resid 62 and name HN )(resid 62 and name HA ) 2.00 0.20 1.50 assign (resid 62 and name HN )(resid 62 and name HB* ) 2.00 0.20 1.50 assign (resid 62 and name HN )(resid 63 and name HN ) 2.00 0.20 2.00 remarks Asn63 assign (resid 63 and name HN )(resid 62 and name HA ) 2.00 0.20 1.50 assign (resid 63 and name HN )(resid 62 and name HB* ) 2.00 0.20 2.00 assign (resid 63 and name HN )(resid 63 and name HA ) 2.00 0.20 1.50 assign (resid 63 and name HN )(resid 63 and name HB* ) 2.00 0.20 2.00 assign (resid 63 and name HN )(resid 63 and name HD2* ) 2.00 0.20 3.50 assign (resid 63 and name HN )(resid 64 and name HN ) 2.00 0.20 2.00 remarks Glu64 assign (resid 64 and name HN )(resid 63 and name HA ) 2.00 0.20 1.50 assign (resid 64 and name HN )(resid 63 and name HB* ) 2.00 0.20 2.50 assign (resid 64 and name HN )(resid 64 and name HA ) 2.00 0.20 1.50 assign (resid 64 and name HN )(resid 64 and name HB* ) 2.00 0.20 1.50 assign (resid 64 and name HN )(resid 64 and name HG* ) 2.00 0.20 3.00 assign (resid 64 and name HN )(resid 65 and name HD* ) 2.00 0.20 3.50 remarks Pro65 remarks Ala66 assign (resid 66 and name HN )(resid 65 and name HA ) 2.00 0.20 1.50 assign (resid 66 and name HN )(resid 65 and name HB* ) 2.00 0.20 2.50 assign (resid 66 and name HN )(resid 65 and name HG* ) 2.00 0.20 3.50 assign (resid 66 and name HN )(resid 66 and name HA ) 2.00 0.20 1.50 assign (resid 66 and name HN )(resid 66 and name HB* ) 2.00 0.20 2.50 remarks Thr67 assign (resid 67 and name HN )(resid 66 and name HN ) 2.00 0.20 3.50 assign (resid 67 and name HN )(resid 66 and name HA ) 2.00 0.20 2.00 assign (resid 67 and name HN )(resid 66 and name HB* ) 2.00 0.20 4.00 assign (resid 67 and name HN )(resid 67 and name HA ) 2.00 0.20 1.50 assign (resid 67 and name HN )(resid 67 and name HB ) 2.00 0.20 2.00 assign (resid 67 and name HN )(resid 67 and name HG2* ) 2.00 0.20 3.50 remarks Asn68 assign (resid 68 and name HN )(resid 67 and name HA ) 2.00 0.20 1.50 assign (resid 68 and name HN )(resid 67 and name HB ) 2.00 0.20 2.00 assign (resid 68 and name HN )(resid 68 and name HA ) 2.00 0.20 1.50 assign (resid 68 and name HN )(resid 68 and name HB* ) 2.00 0.20 2.50 assign (resid 68 and name HN )(resid 69 and name HN ) 2.00 0.20 3.50 remarks Thr69 assign (resid 69 and name HN )(resid 68 and name HA ) 2.00 0.20 0.80 assign (resid 69 and name HN )(resid 68 and name HB* ) 2.00 0.20 4.00 assign (resid 69 and name HN )(resid 68 and name HN ) 2.00 0.20 3.50 assign (resid 69 and name HN )(resid 69 and name HA ) 2.00 0.20 1.50 assign (resid 69 and name HN )(resid 69 and name HB ) 2.00 0.20 2.00 assign (resid 69 and name HN )(resid 69 and name HG2* ) 2.00 0.20 3.00 assign (resid 69 and name HN )(resid 70 and name HN ) 2.00 0.20 2.00 assign (resid 69 and name HN )(resid 72 and name HB ) 2.00 0.20 2.50 assign (resid 69 and name HN )(resid 72 and name HG* ) 2.00 0.20 5.50 remarks Leu70 assign (resid 70 and name HN )(resid 55 and name HE* ) 2.00 0.20 4.00 assign (resid 70 and name HN )(resid 69 and name HA ) 2.00 0.20 1.50 assign (resid 70 and name HN )(resid 69 and name HB ) 2.00 0.20 1.50 assign (resid 70 and name HN )(resid 69 and name HG2* ) 2.00 0.20 4.00 assign (resid 70 and name HN )(resid 70 and name HA ) 2.00 0.20 1.50 assign (resid 70 and name HN )(resid 70 and name HB* ) 2.00 0.20 2.50 assign (resid 70 and name HN )(resid 70 and name HG ) 2.00 0.20 1.50 assign (resid 70 and name HN )(resid 70 and name HD* ) 2.00 0.20 4.50 assign (resid 70 and name HN )(resid 71 and name HN ) 2.00 0.20 1.50 assign (resid 70 and name HN )(resid 72 and name HN ) 2.00 0.20 3.00 remarks Glu71 assign (resid 71 and name HN )(resid 69 and name HA ) 2.00 0.20 3.00 assign (resid 71 and name HN )(resid 69 and name HG2* ) 2.00 0.20 5.00 assign (resid 71 and name HN )(resid 70 and name HA ) 2.00 0.20 3.00 assign (resid 71 and name HN )(resid 70 and name HB* ) 2.00 0.20 3.50 assign (resid 71 and name HN )(resid 70 and name HG ) 2.00 0.20 3.00 assign (resid 71 and name HN )(resid 70 and name HD* ) 2.00 0.20 6.00 assign (resid 71 and name HN )(resid 71 and name HA ) 2.00 0.20 2.20 assign (resid 71 and name HN )(resid 71 and name HB* ) 2.00 0.20 2.00 assign (resid 71 and name HN )(resid 71 and name HG* ) 2.00 0.20 3.00 assign (resid 71 and name HN )(resid 72 and name HD* ) 2.00 0.20 5.50 assign (resid 71 and name HN )(resid 72 and name HN ) 2.00 0.20 2.00 assign (resid 71 and name HN )(resid 73 and name HN ) 2.00 0.20 3.00 remarks Val72 assign (resid 72 and name HN )(resid 69 and name HA ) 2.00 0.20 3.50 assign (resid 72 and name HN )(resid 69 and name HG2* ) 2.00 0.20 4.50 assign (resid 72 and name HN )(resid 71 and name HA ) 2.00 0.20 2.00 assign (resid 72 and name HN )(resid 71 and name HB* ) 2.00 0.20 2.50 assign (resid 72 and name HN )(resid 71 and name HG* ) 2.00 0.20 4.50 assign (resid 72 and name HN )(resid 72 and name HA ) 2.00 0.20 1.50 assign (resid 72 and name HN )(resid 72 and name HB ) 2.00 0.20 2.00 assign (resid 72 and name HN )(resid 72 and name HG* ) 2.00 0.20 3.50 assign (resid 72 and name HN )(resid 73 and name HN ) 2.00 0.20 1.20 assign (resid 72 and name HN )(resid 74 and name HN ) 2.00 0.20 3.00 remarks His73 assign (resid 73 and name HN )(resid 70 and name HA ) 2.00 0.20 2.50 assign (resid 73 and name HN )(resid 71 and name HB* ) 2.00 0.20 4.00 assign (resid 73 and name HN )(resid 72 and name HA ) 2.00 0.20 1.50 assign (resid 73 and name HN )(resid 72 and name HB ) 2.00 0.20 1.50 assign (resid 73 and name HN )(resid 72 and name HG* ) 2.00 0.20 4.00 assign (resid 73 and name HN )(resid 73 and name HA ) 2.00 0.20 1.50 assign (resid 73 and name HN )(resid 73 and name HB* ) 2.00 0.20 1.50 assign (resid 73 and name HN )(resid 74 and name HN ) 2.00 0.20 0.80 assign (resid 73 and name HN )(resid 75 and name HN ) 2.00 0.20 3.00 remarks Ile74 assign (resid 74 and name HN )(resid 70 and name HA ) 2.00 0.20 2.50 assign (resid 74 and name HN )(resid 71 and name HA ) 2.00 0.20 1.50 assign (resid 74 and name HN )(resid 71 and name HB* ) 2.00 0.20 3.50 assign (resid 74 and name HN )(resid 72 and name HA ) 2.00 0.20 2.00 assign (resid 74 and name HN )(resid 72 and name HB ) 2.00 0.20 3.00 assign (resid 74 and name HN )(resid 73 and name HA ) 2.00 0.20 2.50 assign (resid 74 and name HN )(resid 73 and name HB* ) 2.00 0.20 2.50 assign (resid 74 and name HN )(resid 74 and name HA ) 2.00 0.20 1.50 assign (resid 74 and name HN )(resid 74 and name HB ) 2.00 0.20 0.80 assign (resid 74 and name HN )(resid 74 and name HG1* ) 2.00 0.20 1.50 assign (resid 74 and name HN )(resid 74 and name HG2* ) 2.00 0.20 3.50 assign (resid 74 and name HN )(resid 74 and name HD1* ) 2.00 0.20 3.50 assign (resid 74 and name HN )(resid 75 and name HN ) 2.00 0.20 1.50 assign (resid 74 and name HN )(resid 76 and name HN ) 2.00 0.20 2.00 remarks His75 assign (resid 75 and name HN )(resid 71 and name HA ) 2.00 0.20 2.50 assign (resid 75 and name HN )(resid 72 and name HA ) 2.00 0.20 1.50 assign (resid 75 and name HN )(resid 72 and name HB ) 2.00 0.20 3.00 assign (resid 75 and name HN )(resid 72 and name HG* ) 2.00 0.20 5.50 assign (resid 75 and name HN )(resid 73 and name HA ) 2.00 0.20 3.00 assign (resid 75 and name HN )(resid 74 and name HA ) 2.00 0.20 1.50 assign (resid 75 and name HN )(resid 74 and name HB ) 2.00 0.20 1.50 assign (resid 75 and name HN )(resid 74 and name HG1* ) 2.00 0.20 3.00 assign (resid 75 and name HN )(resid 74 and name HG2* ) 2.00 0.20 3.50 assign (resid 75 and name HN )(resid 74 and name HD1* ) 2.00 0.20 4.50 assign (resid 75 and name HN )(resid 75 and name HA ) 2.00 0.20 1.50 assign (resid 75 and name HN )(resid 75 and name HB* ) 2.00 0.20 1.50 assign (resid 75 and name HN )(resid 76 and name HN ) 2.00 0.20 1.50 assign (resid 75 and name HN )(resid 77 and name HN ) 2.00 0.20 2.50 assign (resid 75 and name HN )(resid 78 and name HN ) 2.00 0.20 3.50 remarks Asn76 assign (resid 76 and name HN )(resid 72 and name HA ) 2.00 0.20 2.50 assign (resid 76 and name HN )(resid 72 and name HG* ) 2.00 0.20 4.50 assign (resid 76 and name HN )(resid 73 and name HA ) 2.00 0.20 1.50 assign (resid 76 and name HN )(resid 74 and name HA ) 2.00 0.20 2.50 assign (resid 76 and name HN )(resid 74 and name HB ) 2.00 0.20 3.00 assign (resid 76 and name HN )(resid 74 and name HG1* ) 2.00 0.20 4.50 assign (resid 76 and name HN )(resid 74 and name HG2* ) 2.00 0.20 5.50 assign (resid 76 and name HN )(resid 75 and name HA ) 2.00 0.20 1.80 assign (resid 76 and name HN )(resid 75 and name HB* ) 2.00 0.20 2.00 assign (resid 76 and name HN )(resid 76 and name HA ) 2.00 0.20 1.50 assign (resid 76 and name HN )(resid 76 and name HB* ) 2.00 0.20 1.50 assign (resid 76 and name HN )(resid 77 and name HN ) 2.00 0.20 2.50 assign (resid 76 and name HN )(resid 77 and name HG* ) 2.00 0.20 5.00 assign (resid 76 and name HN )(resid 78 and name HN ) 2.00 0.20 3.00 assign (resid 76 and name HN )(resid 79 and name HG* ) 2.00 0.20 4.50 remarks Leu77 assign (resid 77 and name HN )(resid 73 and name HA ) 2.00 0.20 2.50 assign (resid 77 and name HN )(resid 74 and name HA ) 2.00 0.20 1.50 assign (resid 77 and name HN )(resid 74 and name HG2* ) 2.00 0.20 5.50 assign (resid 77 and name HN )(resid 74 and name HD1* ) 2.00 0.20 5.50 assign (resid 77 and name HN )(resid 75 and name HA ) 2.00 0.20 2.50 assign (resid 77 and name HN )(resid 76 and name HA ) 2.00 0.20 1.50 assign (resid 77 and name HN )(resid 76 and name HB* ) 2.00 0.20 1.50 assign (resid 77 and name HN )(resid 77 and name HA ) 2.00 0.20 1.20 assign (resid 77 and name HN )(resid 77 and name HB* ) 2.00 0.20 1.50 assign (resid 77 and name HN )(resid 77 and name HG ) 2.00 0.20 1.50 assign (resid 77 and name HN )(resid 77 and name HD* ) 2.00 0.20 4.50 assign (resid 77 and name HN )(resid 78 and name HN ) 2.00 0.20 2.50 assign (resid 77 and name HN )(resid 79 and name HN ) 2.00 0.20 3.50 remarks Arg78 assign (resid 78 and name HN )(resid 74 and name HA ) 2.00 0.20 3.00 assign (resid 78 and name HN )(resid 74 and name HG2* ) 2.00 0.20 5.00 assign (resid 78 and name HN )(resid 75 and name HA ) 2.00 0.20 2.50 assign (resid 78 and name HN )(resid 76 and name HA ) 2.00 0.20 3.50 assign (resid 78 and name HN )(resid 77 and name HA ) 2.00 0.20 2.00 assign (resid 78 and name HN )(resid 77 and name HB* ) 2.00 0.20 1.50 assign (resid 78 and name HN )(resid 77 and name HG ) 2.00 0.20 2.50 assign (resid 78 and name HN )(resid 77 and name HD* ) 2.00 0.20 5.50 assign (resid 78 and name HN )(resid 78 and name HA ) 2.00 0.20 1.50 assign (resid 78 and name HN )(resid 78 and name HB* ) 2.00 0.20 3.50 assign (resid 78 and name HN )(resid 78 and name HD* ) 2.00 0.20 3.50 assign (resid 78 and name HN )(resid 79 and name HN ) 2.00 0.20 1.50 assign (resid 78 and name HN )(resid 80 and name HN ) 2.00 0.20 4.00 remarks Glu79 assign (resid 79 and name HN )(resid 75 and name HA ) 2.00 0.20 2.50 assign (resid 79 and name HN )(resid 76 and name HA ) 2.00 0.20 2.00 assign (resid 79 and name HN )(resid 77 and name HA ) 2.00 0.20 2.50 assign (resid 79 and name HN )(resid 77 and name HD* ) 2.00 0.20 6.00 assign (resid 79 and name HN )(resid 78 and name HA ) 2.00 0.20 3.00 assign (resid 79 and name HN )(resid 78 and name HB* ) 2.00 0.20 3.50 assign (resid 79 and name HN )(resid 78 and name HD* ) 2.00 0.20 4.50 assign (resid 79 and name HN )(resid 79 and name HA ) 2.00 0.20 1.50 assign (resid 79 and name HN )(resid 79 and name HB* ) 2.00 0.20 2.00 assign (resid 79 and name HN )(resid 79 and name HG* ) 2.00 0.20 2.50 assign (resid 79 and name HN )(resid 80 and name HN ) 2.00 0.20 1.50 assign (resid 79 and name HN )(resid 81 and name HG2* ) 2.00 0.20 5.50 assign (resid 79 and name HN )(resid 81 and name HD1* ) 2.00 0.20 5.50 remarks Lys80 assign (resid 80 and name HN )(resid 76 and name HA ) 2.00 0.20 3.50 assign (resid 80 and name HN )(resid 77 and name HA ) 2.00 0.20 2.50 assign (resid 80 and name HN )(resid 77 and name HD* ) 2.00 0.20 4.50 assign (resid 80 and name HN )(resid 78 and name HA ) 2.00 0.20 3.50 assign (resid 80 and name HN )(resid 79 and name HA ) 2.00 0.20 1.50 assign (resid 80 and name HN )(resid 79 and name HB* ) 2.00 0.20 3.00 assign (resid 80 and name HN )(resid 79 and name HG* ) 2.00 0.20 4.00 assign (resid 80 and name HN )(resid 80 and name HA ) 2.00 0.20 0.80 assign (resid 80 and name HN )(resid 80 and name HB* ) 2.00 0.20 3.00 assign (resid 80 and name HN )(resid 80 and name HG* ) 2.00 0.20 3.50 assign (resid 80 and name HN )(resid 80 and name HD* ) 2.00 0.20 3.50 assign (resid 80 and name HN )(resid 80 and name HE* ) 2.00 0.20 5.00 assign (resid 80 and name HN )(resid 81 and name HG2* ) 2.00 0.20 4.50 assign (resid 80 and name HN )(resid 81 and name HD1* ) 2.00 0.20 5.00 assign (resid 80 and name HN )(resid 81 and name HN ) 2.00 0.20 1.50 assign (resid 80 and name HN )(resid 78 and name HA ) 2.00 0.20 3.50 assign (resid 80 and name HN )(resid 81 and name HN ) 2.00 0.20 0.80 assign (resid 80 and name HN )(resid 82 and name HN ) 2.00 0.20 2.50 remarks Ile81 assign (resid 81 and name HN )(resid 23 and name HD* ) 2.00 0.20 6.00 assign (resid 81 and name HN )(resid 78 and name HA ) 2.00 0.20 2.00 assign (resid 81 and name HN )(resid 79 and name HA ) 2.00 0.20 3.00 assign (resid 81 and name HN )(resid 80 and name HA ) 2.00 0.20 2.50 assign (resid 81 and name HN )(resid 80 and name HB* ) 2.00 0.20 3.00 assign (resid 81 and name HN )(resid 81 and name HA ) 2.00 0.20 1.50 assign (resid 81 and name HN )(resid 81 and name HB ) 2.00 0.20 2.00 assign (resid 81 and name HN )(resid 81 and name HG1* ) 2.00 0.20 2.00 assign (resid 81 and name HN )(resid 81 and name HG2* ) 2.00 0.20 3.50 assign (resid 81 and name HN )(resid 81 and name HD1* ) 2.00 0.20 4.50 assign (resid 81 and name HN )(resid 82 and name HN ) 2.00 0.20 0.80 remarks Gly82 assign (resid 82 and name HN )(resid 23 and name HD* ) 2.00 0.20 5.50 assign (resid 82 and name HN )(resid 79 and name HA ) 2.00 0.20 2.50 assign (resid 82 and name HN )(resid 80 and name HA ) 2.00 0.20 3.50 assign (resid 82 and name HN )(resid 80 and name HB* ) 2.00 0.20 3.50 assign (resid 82 and name HN )(resid 81 and name HA ) 2.00 0.20 2.50 assign (resid 82 and name HN )(resid 81 and name HB ) 2.00 0.20 2.00 assign (resid 82 and name HN )(resid 81 and name HG1* ) 2.00 0.20 2.50 assign (resid 82 and name HN )(resid 81 and name HG2* ) 2.00 0.20 4.00 assign (resid 82 and name HN )(resid 81 and name HD1* ) 2.00 0.20 4.00 assign (resid 82 and name HN )(resid 82 and name HA* ) 2.00 0.20 0.80 assign (resid 82 and name HN )(resid 83 and name HN ) 2.00 0.20 2.00 remarks Lys83 assign (resid 83 and name HN )(resid 79 and name HA ) 2.00 0.20 3.00 assign (resid 83 and name HN )(resid 81 and name HB ) 2.00 0.20 3.50 assign (resid 83 and name HN )(resid 82 and name HA* ) 2.00 0.20 0.80 assign (resid 83 and name HN )(resid 83 and name HA ) 2.00 0.20 1.50 assign (resid 83 and name HN )(resid 83 and name HB* ) 2.00 0.20 2.50 assign (resid 83 and name HN )(resid 83 and name HG* ) 2.00 0.20 3.00 assign (resid 83 and name HN )(resid 83 and name HD* ) 2.00 0.20 3.00 remarks Ser84 assign (resid 84 and name HN )(resid 81 and name HD1* ) 2.00 0.20 5.50 assign (resid 84 and name HN )(resid 82 and name HA* ) 2.00 0.20 3.50 assign (resid 84 and name HN )(resid 83 and name HA ) 2.00 0.20 2.50 assign (resid 84 and name HN )(resid 83 and name HB* ) 2.00 0.20 3.00 assign (resid 84 and name HN )(resid 83 and name HG* ) 2.00 0.20 3.50 assign (resid 84 and name HN )(resid 83 and name HD* ) 2.00 0.20 4.50 assign (resid 84 and name HN )(resid 84 and name HA ) 2.00 0.20 1.50 assign (resid 84 and name HN )(resid 84 and name HB* ) 2.00 0.20 2.50 assign (resid 84 and name HN )(resid 85 and name HN ) 2.00 0.20 0.80 assign (resid 84 and name HN )(resid 86 and name HN ) 2.00 0.20 3.50 remarks Arg85 assign (resid 85 and name HN )(resid 28 and name HD* ) 2.00 0.20 5.50 assign (resid 85 and name HN )(resid 82 and name HA* ) 2.00 0.20 4.00 assign (resid 85 and name HN )(resid 84 and name HA ) 2.00 0.20 2.50 assign (resid 85 and name HN )(resid 84 and name HB* ) 2.00 0.20 4.50 assign (resid 85 and name HN )(resid 85 and name HA ) 2.00 0.20 2.00 assign (resid 85 and name HN )(resid 85 and name HB* ) 2.00 0.20 2.00 assign (resid 85 and name HN )(resid 85 and name HG* ) 2.00 0.20 2.50 assign (resid 85 and name HN )(resid 85 and name HE* ) 2.00 0.20 4.50 assign (resid 85 and name HN )(resid 86 and name HN ) 2.00 0.20 0.80 remarks Ile86 assign (resid 86 and name HN )(resid 84 and name HA ) 2.00 0.20 2.50 assign (resid 86 and name HN )(resid 85 and name HA ) 2.00 0.20 2.50 assign (resid 86 and name HN )(resid 85 and name HB* ) 2.00 0.20 3.50 assign (resid 86 and name HN )(resid 85 and name HG* ) 2.00 0.20 4.00 assign (resid 86 and name HN )(resid 86 and name HA ) 2.00 0.20 2.00 assign (resid 86 and name HN )(resid 86 and name HB ) 2.00 0.20 1.50 assign (resid 86 and name HN )(resid 86 and name HG2* ) 2.00 0.20 4.50 assign (resid 86 and name HN )(resid 86 and name HD1* ) 2.00 0.20 4.50 remarks Arg87 assign (resid 87 and name HN )(resid 86 and name HA ) 2.00 0.20 2.00 assign (resid 87 and name HN )(resid 86 and name HB ) 2.00 0.20 2.50 assign (resid 87 and name HN )(resid 86 and name HG1* ) 2.00 0.20 3.50 assign (resid 87 and name HN )(resid 86 and name HG2* ) 2.00 0.20 4.00 assign (resid 87 and name HN )(resid 86 and name HD1* ) 2.00 0.20 4.50 assign (resid 87 and name HN )(resid 87 and name HA ) 2.00 0.20 2.50 assign (resid 87 and name HN )(resid 87 and name HB* ) 2.00 0.20 2.00 assign (resid 87 and name HN )(resid 88 and name HN ) 2.00 0.20 3.50 assign (resid 87 and name HN )(resid 95 and name HN ) 2.00 0.20 1.50 assign (resid 87 and name HN )(resid 95 and name HB* ) 2.00 0.20 5.00 assign (resid 87 and name HN )(resid 96 and name HA ) 2.00 0.20 3.00 assign (resid 87 and name HN )(resid 97 and name HN ) 2.00 0.20 2.50 remarks Thr88 assign (resid 88 and name HN )(resid 86 and name HG2* ) 2.00 0.20 6.00 assign (resid 88 and name HN )(resid 87 and name HA ) 2.00 0.20 0.80 assign (resid 88 and name HN )(resid 87 and name HB* ) 2.00 0.20 2.50 assign (resid 88 and name HN )(resid 88 and name HA ) 2.00 0.20 2.50 assign (resid 88 and name HN )(resid 88 and name HB* ) 2.00 0.20 3.00 assign (resid 88 and name HN )(resid 88 and name HG2* ) 2.00 0.20 4.00 assign (resid 88 and name HN )(resid 89 and name HN ) 2.00 0.20 3.00 remarks Val89 assign (resid 89 and name HN )(resid 88 and name HA ) 2.00 0.20 3.00 assign (resid 89 and name HN )(resid 88 and name HB* ) 2.00 0.20 3.50 assign (resid 89 and name HN )(resid 89 and name HA ) 2.00 0.20 2.50 assign (resid 89 and name HN )(resid 89 and name HB ) 2.00 0.20 1.50 assign (resid 89 and name HN )(resid 89 and name HG* ) 2.00 0.20 3.00 assign (resid 89 and name HN )(resid 94 and name HA ) 2.00 0.20 2.00 assign (resid 89 and name HN )(resid 94 and name HE* ) 2.00 0.20 5.00 assign (resid 89 and name HN )(resid 95 and name HN ) 2.00 0.20 3.00 remarks Arg90 remarks Gly91 remarks Phe92 assign (resid 92 and name HN )(resid 91 and name HA* ) 2.00 0.20 2.50 assign (resid 92 and name HN )(resid 92 and name HA ) 2.00 0.20 0.80 assign (resid 92 and name HN )(resid 92 and name HB* ) 2.00 0.20 1.50 assign (resid 92 and name HN )(resid 94 and name HD* ) 2.00 0.20 5.00 assign (resid 92 and name HD* )(resid 50 and name HA ) 2.00 0.20 4.50 assign (resid 92 and name HD* )(resid 92 and name HA ) 2.00 0.20 3.00 assign (resid 92 and name HD* )(resid 92 and name HB* ) 2.00 0.20 2.50 assign (resid 92 and name HE* )(resid 50 and name HA ) 2.00 0.20 4.50 assign (resid 92 and name HE* )(resid 50 and name HB* ) 2.00 0.20 5.00 assign (resid 92 and name HZ )(resid 50 and name HB* ) 2.00 0.20 4.50 remarks Gly93 assign (resid 93 and name HN )(resid 89 and name HA ) 2.00 0.20 3.50 assign (resid 93 and name HN )(resid 92 and name HA ) 2.00 0.20 3.00 assign (resid 93 and name HN )(resid 92 and name HB* ) 2.00 0.20 2.50 assign (resid 93 and name HN )(resid 93 and name HA* ) 2.00 0.20 3.00 assign (resid 93 and name HN )(resid 94 and name HD* ) 2.00 0.20 5.00 remarks Tyr94 assign (resid 94 and name HN )(resid 48 and name HA ) 2.00 0.20 1.50 assign (resid 94 and name HN )(resid 49 and name HB ) 2.00 0.20 2.00 assign (resid 94 and name HN )(resid 93 and name HA* ) 2.00 0.20 1.50 assign (resid 94 and name HN )(resid 94 and name HA ) 2.00 0.20 2.50 assign (resid 94 and name HN )(resid 94 and name HB* ) 2.00 0.20 2.00 assign (resid 94 and name HN )(resid 94 and name HD* ) 2.00 0.20 6.00 assign (resid 94 and name HN )(resid 94 and name HE* ) 2.00 0.20 4.50 assign (resid 94 and name HD* )(resid 88 and name HA ) 2.00 0.20 2.50 assign (resid 94 and name HD* )(resid 88 and name HB ) 2.00 0.20 2.50 assign (resid 94 and name HD* )(resid 88 and name HG2* ) 2.00 0.20 3.50 assign (resid 94 and name HD* )(resid 94 and name HA ) 2.00 0.20 3.00 assign (resid 94 and name HD* )(resid 94 and name HB* ) 2.00 0.20 3.00 assign (resid 94 and name HE* )(resid 74 and name HD1* ) 2.00 0.20 5.00 assign (resid 94 and name HE* )(resid 74 and name HG1* ) 2.00 0.20 5.50 assign (resid 94 and name HE* )(resid 74 and name HG2* ) 2.00 0.20 4.50 remarks Met95 assign (resid 95 and name HN )(resid 86 and name HG2* ) 2.00 0.20 4.00 assign (resid 95 and name HN )(resid 88 and name HA ) 2.00 0.20 3.50 assign (resid 95 and name HN )(resid 88 and name HG2* ) 2.00 0.20 5.50 assign (resid 95 and name HN )(resid 94 and name HA ) 2.00 0.20 0.80 assign (resid 95 and name HN )(resid 94 and name HB* ) 2.00 0.20 2.50 assign (resid 95 and name HN )(resid 94 and name HE* ) 2.00 0.20 4.00 assign (resid 95 and name HN )(resid 95 and name HA ) 2.00 0.20 2.50 assign (resid 95 and name HN )(resid 95 and name HB* ) 2.00 0.20 2.50 assign (resid 95 and name HN )(resid 95 and name HG* ) 2.00 0.20 3.50 remarks Leu96 assign (resid 96 and name HN )(resid 45 and name HA ) 2.00 0.20 3.00 assign (resid 96 and name HN )(resid 95 and name HA ) 2.00 0.20 1.50 assign (resid 96 and name HN )(resid 95 and name HB* ) 2.00 0.20 2.50 assign (resid 96 and name HN )(resid 95 and name HG* ) 2.00 0.20 3.00 assign (resid 96 and name HN )(resid 96 and name HA ) 2.00 0.20 3.50 assign (resid 96 and name HN )(resid 96 and name HB* ) 2.00 0.20 2.50 assign (resid 96 and name HN )(resid 96 and name HD* ) 2.00 0.20 5.00 remarks Ala97 assign (resid 97 and name HN )(resid 85 and name HA ) 2.00 0.20 3.50 assign (resid 97 and name HN )(resid 86 and name HA ) 2.00 0.20 3.00 assign (resid 97 and name HN )(resid 87 and name HB* ) 2.00 0.20 4.00 assign (resid 97 and name HN )(resid 86 and name HG2* ) 2.00 0.20 4.50 assign (resid 97 and name HN )(resid 96 and name HA ) 2.00 0.20 0.80 assign (resid 97 and name HN )(resid 96 and name HB* ) 2.00 0.20 3.00 assign (resid 97 and name HN )(resid 96 and name HG ) 2.00 0.20 2.50 assign (resid 97 and name HN )(resid 96 and name HD* ) 2.00 0.20 5.50 assign (resid 97 and name HN )(resid 97 and name HA ) 2.00 0.20 2.50 assign (resid 97 and name HN )(resid 97 and name HB* ) 2.00 0.20 3.50 remarks Asn98 assign (resid 98 and name HN )(resid 9 and name HG* ) 2.00 0.20 6.00 assign (resid 98 and name HN )(resid 46 and name HA* ) 2.00 0.20 3.50 assign (resid 98 and name HN )(resid 46 and name HN ) 2.00 0.20 3.50 assign (resid 98 and name HN )(resid 87 and name HB* ) 2.00 0.20 5.50 assign (resid 98 and name HN )(resid 97 and name HA ) 2.00 0.20 0.80 assign (resid 98 and name HN )(resid 97 and name HB* ) 2.00 0.20 3.50 assign (resid 98 and name HN )(resid 98 and name HA ) 2.00 0.20 1.50 assign (resid 98 and name HN )(resid 98 and name HB* ) 2.00 0.20 1.50 assign (resid 98 and name HD2* )(resid 45 and name HB* ) 2.00 0.20 4.50 assign (resid 98 and name HD2* )(resid 46 and name HA* ) 2.00 0.20 3.00 assign (resid 98 and name HD2* )(resid 98 and name HA ) 2.00 0.20 3.50 assign (resid 98 and name HD2* )(resid 98 and name HB* ) 2.00 0.20 1.50 remarks Asn99 assign (resid 99 and name HN )(resid 97 and name HB* ) 2.00 0.20 4.00 assign (resid 99 and name HN )(resid 98 and name HA ) 2.00 0.20 1.50 assign (resid 99 and name HN )(resid 98 and name HB* ) 2.00 0.20 2.50 assign (resid 99 and name HN )(resid 99 and name HA ) 2.00 0.20 1.50 assign (resid 99 and name HN )(resid 99 and name HB* ) 2.00 0.20 2.50 remarks Ile100 assign (resid 100 and name HN )(resid 99 and name HA ) 2.00 0.20 0.80 assign (resid 100 and name HN )(resid 99 and name HB* ) 2.00 0.20 2.50 assign (resid 100 and name HN )(resid 100 and name HA ) 2.00 0.20 1.50 assign (resid 100 and name HN )(resid 100 and name HB ) 2.00 0.20 1.50 assign (resid 100 and name HN )(resid 100 and name HG1* ) 2.00 0.20 2.50 assign (resid 100 and name HN )(resid 100 and name HG2* ) 2.00 0.20 4.50 assign (resid 100 and name HN )(resid 100 and name HD1* ) 2.00 0.20 4.50 remarks Asp101 assign (resid 101 and name HN )(resid 99 and name HA ) 2.00 0.20 1.50 assign (resid 101 and name HN )(resid 100 and name HA ) 2.00 0.20 1.20 assign (resid 101 and name HN )(resid 100 and name HB ) 2.00 0.20 1.50 assign (resid 101 and name HN )(resid 100 and name HG1* ) 2.00 0.20 2.50 assign (resid 101 and name HN )(resid 100 and name HG2* ) 2.00 0.20 4.50 assign (resid 101 and name HN )(resid 101 and name HA ) 2.00 0.20 1.50 assign (resid 101 and name HN )(resid 101 and name HB* ) 2.00 0.20 2.00 remarks Thr102 assign (resid 102 and name HN )(resid 99 and name HA ) 2.00 0.20 2.50 assign (resid 102 and name HN )(resid 100 and name HB ) 2.00 0.20 3.50 assign (resid 102 and name HN )(resid 100 and name HG1* ) 2.00 0.20 4.50 assign (resid 102 and name HN )(resid 100 and name HG2* ) 2.00 0.20 5.50 assign (resid 102 and name HN )(resid 101 and name HA ) 2.00 0.20 1.50 assign (resid 102 and name HN )(resid 101 and name HB* ) 2.00 0.20 2.50 assign (resid 102 and name HN )(resid 102 and name HA ) 2.00 0.20 1.50 assign (resid 102 and name HN )(resid 102 and name HB ) 2.00 0.20 2.00 assign (resid 102 and name HN )(resid 102 and name HG2* ) 2.00 0.20 4.00 remarks Glu103 assign (resid 103 and name HN )(resid 102 and name HA ) 2.00 0.20 1.50 assign (resid 103 and name HN )(resid 102 and name HB ) 2.00 0.20 2.50 assign (resid 103 and name HN )(resid 102 and name HG2* ) 2.00 0.20 4.50 assign (resid 103 and name HN )(resid 103 and name HA ) 2.00 0.20 1.50 assign (resid 103 and name HN )(resid 103 and name HB* ) 2.00 0.20 2.00 assign (resid 103 and name HN )(resid 103 and name HG* ) 2.00 0.20 3.50
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