NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
180118 |
2khz   |
16258 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
!Intramolecular NOEs (restraints for 201-363 are redundant)
!SER4
assign ( resid 4 and name HA ) ( resid 5 and name HN ) 3.50 1.70 0.00 !hnoe5
!GLY5
assign ((resid 5 and name HA1 ) or
( resid 5 and name HA2 )) ( resid 6 and name HN ) 2.70 0.90 0.00 !hnoe6,b
!GLU6
assign ( resid 6 and name HA ) ( resid 7 and name HN ) 2.70 0.90 0.00 !hnoe7
assign ((resid 6 and name HB1 ) or
( resid 6 and name HB2 )) ( resid 8 and name HB# ) 6.00 4.20 0.50 !ccnoe,b
!GLN7
assign ( resid 7 and name HA ) ( resid 8 and name HN ) 3.50 1.70 0.00 !hnoe8
assign ( resid 7 and name HB1 ) ( resid 8 and name HN ) 3.50 1.70 0.00 !hnoe8
assign ( resid 7 and name HB2 ) ( resid 8 and name HN ) 3.50 1.70 0.00 !hnoe8
assign ((resid 7 and name HG1 ) or
( resid 7 and name HG2 )) ( resid 8 and name HN ) 3.50 1.70 0.00 !hnoe8
!ALA8
assign ( resid 8 and name HN )
((resid 9 and name HD1 ) or ( resid 9 and name HD2 )) 5.00 3.20 0.00 !hnoe8
assign ( resid 8 and name HA ) ( resid 9 and name HD1 ) 2.70 0.90 0.00 !cnoe8ha
assign ( resid 8 and name HA ) ( resid 9 and name HD2 ) 2.70 0.90 0.00 !cnoe8ha
assign ( resid 8 and name HB# ) ( resid 10 and name HA ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 8 and name HA )
((resid 40 and name HE1 ) or ( resid 40 and name HE2 )) 6.00 4.20 0.00 !ccnoe40
assign ( resid 8 and name HB# )
((resid 40 and name HE1 ) or ( resid 40 and name HE2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 8 and name HB# )
((resid 40 and name HB1 ) or ( resid 40 and name HB2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 8 and name HB# )
((resid 40 and name HG1 ) or ( resid 40 and name HG2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 8 and name HB# )
((resid 40 and name HD1 ) or ( resid 40 and name HD2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 8 and name HB# )
((resid 154 and name HE1 ) or ( resid 154 and name HE2 )) 5.00 3.20 0.50 !ccnoe,b
!PRO9
assign ( resid 9 and name HA ) ( resid 10 and name HN ) 2.70 0.90 0.00 !hnoe10
assign ( resid 9 and name HA )
((resid 40 and name HE1 ) or ( resid 40 and name HE2 )) 6.00 4.20 0.00 !ccnoe,b
assign ( resid 9 and name HA ) ( resid 151 and name HD1# ) 6.00 4.20 0.50 !ccnoe,b
assign ( resid 9 and name HA ) ( resid 151 and name HD2# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 9 and name HA )
((resid 154 and name HE1 ) or ( resid 154 and name HE2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 9 and name HB1 ) or
( resid 9 and name HB2 )) ( resid 10 and name HN ) 3.50 1.70 0.00 !hnoe10
assign ((resid 9 and name HB1 ) or ( resid 9 and name HB2 ))
((resid 39 and name HA1 ) or ( resid 39 and name HA2 )) 5.00 3.20 0.00 !ccnoe9
assign ((resid 9 and name HB1 ) or ( resid 9 and name HB2 ))
((resid 40 and name HE1 ) or ( resid 40 and name HE2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 9 and name HB1 ) or
( resid 9 and name HB2 )) ( resid 151 and name HD1# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 9 and name HB1 ) or
( resid 9 and name HB2 )) ( resid 151 and name HD2# ) 6.00 4.20 0.50 !ccnoe,b
assign ((resid 9 and name HG1 ) or ( resid 9 and name HG2 ))
((resid 40 and name HE1 ) or ( resid 40 and name HE2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 9 and name HD1 ) or
( resid 9 and name HD2 )) ( resid 10 and name HN ) 5.00 3.20 0.00 !hnoe10
assign ((resid 9 and name HD1 ) or
( resid 9 and name HD2 )) ( resid 40 and name HN ) 5.00 3.20 0.00 !hnoe10
assign ((resid 9 and name HD1 ) or ( resid 9 and name HD2 ))
((resid 40 and name HE1 ) or ( resid 40 and name HE2 )) 5.00 3.20 0.00 !ccnoe,b
!CYS10
assign ( resid 10 and name HN ) ( resid 39 and name HN ) 5.00 3.20 0.00 !hnoe10,b
assign ( resid 10 and name HN )
((resid 39 and name HA1 ) or ( resid 39 and name HA2 )) 5.00 3.20 0.00 !hnoe10
assign ( resid 10 and name HN ) ( resid 40 and name HN ) 5.00 3.20 0.00 !hnoe10,b
assign ( resid 10 and name HA ) ( resid 11 and name HN ) 2.70 0.90 0.00 !hnoe11
assign ( resid 10 and name HA )
((resid 77 and name HB1 ) or ( resid 77 and name HB2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 10 and name HA ) ( resid 78 and name HG2# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 10 and name HA )
((resid 154 and name HE1 ) or ( resid 154 and name HE2 )) 3.50 1.70 0.00 !ccnoe,b
assign ((resid 10 and name HB1 ) or ( resid 10 and name HB2 ))
((resid 39 and name HA1 ) or ( resid 39 and name HA2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 10 and name HB1 ) or
( resid 10 and name HB2 )) ( resid 77 and name HA ) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 10 and name HB1 ) or
( resid 10 and name HB2 )) ( resid 78 and name HG2# ) 3.50 1.70 0.50 !ccnoe,b
assign ((resid 10 and name HB1 ) or
( resid 10 and name HB2 )) ( resid 78 and name HG1# ) 6.00 4.20 0.50 !ccnoe,b
assign ((resid 10 and name HB1 ) or
( resid 10 and name HB2 )) ( resid 151 and name HD2# ) 3.50 1.70 0.50 !ccnoe,b
assign ((resid 10 and name HB1 ) or
( resid 10 and name HB2 )) ( resid 151 and name HD1# ) 6.00 4.20 0.50 !ccnoe,b
assign ((resid 10 and name HB1 ) or ( resid 10 and name HB2 ))
((resid 154 and name HE1 ) or ( resid 154 and name HE2 )) 5.00 3.20 0.00 !ccnoe
!SER11
assign ( resid 11 and name HN ) ( resid 77 and name HN ) 5.00 3.20 0.00 !hnoe11,b
assign ( resid 11 and name HN ) ( resid 78 and name HN ) 3.50 1.70 0.00 !hnoe11,b
assign ( resid 11 and name HN ) ( resid 78 and name HG2# ) 6.00 4.20 0.50 !hnoe11
assign ( resid 11 and name HA ) ( resid 12 and name HN ) 2.70 0.90 0.00 !hnoe12
assign ( resid 11 and name HA ) ( resid 39 and name HN ) 5.00 3.20 0.00 !hnoe39
assign ( resid 11 and name HA ) ( resid 40 and name HN ) 3.50 1.70 0.00 !hnoe40
assign ( resid 11 and name HA )
((resid 40 and name HB1 ) or ( resid 40 and name HB2 )) 3.50 1.70 0.00 !ccnoe11
assign ( resid 11 and name HA )
((resid 40 and name HG1 ) or ( resid 40 and name HG2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 11 and name HA )
((resid 40 and name HD1 ) or ( resid 40 and name HD2 )) 5.00 3.20 0.00 !ccnoe11
assign ( resid 11 and name HA )
((resid 40 and name HE1 ) or ( resid 40 and name HE2 )) 6.00 4.20 0.00 !ccnoe11
assign ( resid 11 and name HA ) ( resid 42 and name HD2# ) 6.00 4.20 0.50 !cnoe42d2,2dnoe,ccnoe
assign ( resid 11 and name HA ) ( resid 42 and name HD1# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 11 and name HA ) ( resid 77 and name HN ) 5.00 3.20 0.00 !hnoe77
assign ((resid 11 and name HB1 ) or
( resid 11 and name HB2 )) ( resid 40 and name HN ) 5.00 3.20 0.00 !hnoe40
assign ((resid 11 and name HB1 ) or ( resid 11 and name HB2 ))
((resid 40 and name HB1 ) or ( resid 40 and name HB2 )) 5.00 3.20 0.00 !ccnoe11
assign ((resid 11 and name HB1 ) or ( resid 11 and name HB2 ))
((resid 40 and name HE1 ) or ( resid 40 and name HE2 )) 5.00 3.20 0.00 !ccnoe40he
assign ((resid 11 and name HB1 ) or ( resid 11 and name HB2 ))
((resid 40 and name HD1 ) or ( resid 40 and name HD2 )) 6.00 4.20 0.00 !ccnoe11
assign ((resid 11 and name HB1 ) or
( resid 11 and name HB2 )) ( resid 42 and name HG ) 5.00 3.20 0.00 !cnoe11
assign ((resid 11 and name HB1 ) or
( resid 11 and name HB2 )) ( resid 42 and name HD2# ) 5.00 3.20 0.50 !cnoe,b,ccnoe,b
assign ((resid 11 and name HB1 ) or
( resid 11 and name HB2 )) ( resid 42 and name HD1# ) 3.50 1.70 0.50 !cnoe,b,ccnoe,b
assign ((resid 11 and name HB1 ) or
( resid 11 and name HB2 )) ( resid 76 and name HA ) 5.00 3.20 0.00 !cnoe,b,ccnoe,b
assign ((resid 11 and name HB1 ) or
( resid 11 and name HB2 )) ( resid 76 and name HB# ) 3.50 1.70 0.50 !cnoe,b,ccnoe,b
!VAL12
assign ( resid 12 and name HN ) ( resid 12 and name HG2# ) 2.70 0.90 0.50 !ch3noe12,x1=180
assign ( resid 12 and name HN ) ( resid 40 and name HN ) 5.00 3.20 0.00 !hnoe12,b,SD
assign ( resid 12 and name HN ) ( resid 41 and name HA ) 5.00 3.20 0.00 !hnoe12
assign ( resid 12 and name HN ) ( resid 41 and name HG1# ) 5.00 3.20 0.50 !ch3noe
assign ( resid 12 and name HN )
((resid 79 and name HG1# ) or ( resid 79 and name HG2# )) 5.00 3.20 0.50 !hnoe12
assign ( resid 12 and name HA ) ( resid 13 and name HN ) 2.70 0.90 0.00 !hnoe13
assign ( resid 12 and name HA ) ( resid 76 and name HB# ) 5.00 3.20 0.50 !ccnoe76,cnoe,b
assign ( resid 12 and name HA ) ( resid 78 and name HN ) 3.50 1.70 0.00 !cnoe12
assign ( resid 12 and name HA ) ( resid 78 and name HB ) 5.00 3.20 0.00 !cnoe78
assign ( resid 12 and name HB ) ( resid 41 and name HG1# ) 5.00 3.20 0.50 !ccnoe41
assign ( resid 12 and name HB ) ( resid 41 and name HG2# ) 5.00 3.20 0.50 !ccnoe41
assign ( resid 12 and name HG1# ) ( resid 13 and name HN ) 3.50 1.70 0.50 !ch3noe12
assign ( resid 12 and name HG2# ) ( resid 35 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 12 and name HG2# ) ( resid 35 and name HD2# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 12 and name HG2# ) ( resid 35 and name HA ) 6.00 4.20 0.50 !ccnoe35a
assign ( resid 12 and name HG1# ) ( resid 35 and name HD1# ) 3.50 1.70 1.00 !ch3noe12,b
assign ( resid 12 and name HG1# ) ( resid 35 and name HD2# ) 5.00 3.20 1.00 !ch3noe12,b
assign ( resid 12 and name HG2# ) ( resid 39 and name HN ) 3.50 1.70 0.50 !hnoe39
assign ( resid 12 and name HG1# ) ( resid 39 and name HN ) 5.00 3.20 0.50 !hnoe39
assign ( resid 12 and name HG2# ) ( resid 40 and name HN ) 5.00 3.20 0.50 !hnoe40
assign ( resid 12 and name HG1# ) ( resid 41 and name HG2# ) 6.00 4.20 1.00 !ch3noech3
assign ( resid 12 and name HG2# ) ( resid 41 and name HG2# ) 6.00 4.20 1.00 !ch3noech3
assign ( resid 12 and name HG1# ) ( resid 78 and name HG1# ) 3.50 1.70 1.00 !ccnoe78
assign ( resid 12 and name HG2# ) ( resid 78 and name HN ) 5.00 3.20 0.50 !ch3noe12
assign ( resid 12 and name HG2# ) ( resid 78 and name HB ) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 12 and name HG1# ) ( resid 80 and name HN ) 5.00 3.20 0.50 !ch3noe,cnoe12
assign ( resid 12 and name HG1# ) ( resid 147 and name HZ ) 3.50 1.70 0.50 !cnoe12
assign ( resid 12 and name HG1# )
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 3.50 1.70 0.50 !cnoe12
assign ( resid 12 and name HG1# )
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 5.00 3.20 0.50 !cnoe12
assign ( resid 12 and name HG2# ) ( resid 147 and name HZ ) 3.50 1.70 0.50 !cnoe12
assign ( resid 12 and name HG2# )
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 3.50 1.70 0.50 !cnoe12
assign ( resid 12 and name HG2# )
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 5.00 3.20 0.50 !cnoe12
!TYR13
assign ( resid 13 and name HN ) ( resid 76 and name HB# ) 3.50 1.70 0.50 !hnoe13,cnoe76
assign ( resid 13 and name HN ) ( resid 78 and name HN ) 5.00 3.20 0.00 !hnoe13,b
assign ( resid 13 and name HN ) ( resid 79 and name HA ) 3.50 1.70 0.00 !hnoe13
assign ( resid 13 and name HN ) ( resid 78 and name HG2# ) 5.00 3.20 0.50 !cnoe78
assign ( resid 13 and name HN ) ( resid 78 and name HG1# ) 5.00 3.20 0.50 !cnoe78
assign ( resid 13 and name HN ) ( resid 79 and name HG2# ) 5.00 3.20 0.50 !hnoe13,ch3noe
assign ( resid 13 and name HN ) ( resid 80 and name HN ) 5.00 3.20 0.00 !hnoe13,b
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 15 and name HG ) 5.00 3.20 0.00 !ulfilter
assign ((resid 13 and name HB1 ) or
( resid 13 and name HB2 )) ( resid 76 and name HB# ) 3.50 1.70 0.50 !cnoe76,ccnoe76
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 42 and name HD1# ) 3.50 1.70 0.50 !cnoe42
assign ((resid 13 and name HE1 ) or
( resid 13 and name HE2 )) ( resid 42 and name HD1# ) 3.50 1.70 0.50 !cnoe42
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 42 and name HD2# ) 5.00 3.20 0.50 !cnoe42
assign ((resid 13 and name HE1 ) or
( resid 13 and name HE2 )) ( resid 69 and name HA ) 6.00 4.20 0.00 !cnoe69
assign ((resid 13 and name HE1 ) or
( resid 13 and name HE2 )) ( resid 72 and name HN ) 5.00 3.20 0.00 !hnoe72
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 72 and name HE3 ) 6.00 4.20 0.00 !2dd2o
assign ((resid 13 and name HE1 ) or
( resid 13 and name HE2 )) ( resid 72 and name HE3 ) 5.00 3.20 0.00 !2dd2o
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 73 and name HA ) 3.50 1.70 0.00 !cnoe73
assign ((resid 13 and name HE1 ) or
( resid 13 and name HE2 )) ( resid 73 and name HA ) 5.00 3.20 0.00 !cnoe73
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 73 and name HD1# ) 3.50 1.70 0.50 !cnoe73
assign ((resid 13 and name HE1 ) or
( resid 13 and name HE2 )) ( resid 73 and name HD1# ) 5.00 3.20 0.50 !cnoe73
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 75 and name HN ) 5.00 3.20 0.00 !hnoe75
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 76 and name HN ) 5.00 3.20 0.00 !hnoe76
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 76 and name HB# ) 3.50 1.70 0.50 !cnoe76
assign ((resid 13 and name HE1 ) or
( resid 13 and name HE2 )) ( resid 76 and name HB# ) 5.00 3.20 0.50 !cnoe76
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 79 and name HG1# ) 3.50 1.70 0.50 !cnoe79
assign ((resid 13 and name HE1 ) or
( resid 13 and name HE2 )) ( resid 79 and name HG1# ) 5.00 3.20 0.50 !cnoe79
assign ((resid 13 and name HD1 ) or
( resid 13 and name HD2 )) ( resid 81 and name HB# ) 5.00 3.20 0.50 !cnoe81
assign ((resid 13 and name HE1 ) or
( resid 13 and name HE2 )) ( resid 81 and name HB# ) 5.00 3.20 0.50 !cnoe81
!PHE14
assign ( resid 14 and name HA ) ( resid 15 and name HN ) 2.70 0.90 0.00 !hnoe15
assign ( resid 14 and name HA ) ( resid 35 and name HD1# ) 5.00 3.20 0.50 !2dd2o
assign ( resid 14 and name HA ) ( resid 41 and name HG1# ) 5.00 3.20 0.50 !cnoe41
assign ( resid 14 and name HA ) ( resid 79 and name HA ) 6.00 4.20 0.00 !2dd2o
assign ( resid 14 and name HA ) ( resid 79 and name HG1# ) 6.00 4.20 0.50 !cnoe79
assign ( resid 14 and name HA ) ( resid 80 and name HN ) 5.00 3.20 0.00 !2dd2o,hnoe80
assign ( resid 14 and name HA ) ( resid 80 and name HB ) 5.00 3.20 0.00 !2dd2o
assign ( resid 14 and name HA ) ( resid 80 and name HG2# ) 5.00 3.20 0.50 !cnoe80
assign ( resid 14 and name HA ) ( resid 80 and name HG1# ) 5.00 3.20 0.50 !cnoe80,in
assign ( resid 14 and name HA ) ( resid 81 and name HA ) 6.00 4.20 0.00 !2dd2o
assign ((resid 14 and name HB1 ) or
( resid 14 and name HB2 )) ( resid 41 and name HG1# ) 3.50 1.70 0.50 !cnoe41
assign ( resid 14 and name HZ ) ( resid 18 and name HD1# ) 6.00 4.20 0.50 !cnoe18
assign ( resid 14 and name HZ )
((resid 28 and name HE1 ) or ( resid 28 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ( resid 14 and name HZ )
((resid 28 and name HD1 ) or ( resid 28 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 14 and name HE1 ) or ( resid 14 and name HE2 ))
((resid 28 and name HD1 ) or ( resid 28 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 31 and name HG2# ) 3.50 1.70 0.50 !cnoe31,2dd2o
assign ((resid 14 and name HE1 ) or
( resid 14 and name HE2 )) ( resid 31 and name HG2# ) 3.50 1.70 0.50 !cnoe31,2dd2o
assign ( resid 14 and name HZ ) ( resid 31 and name HG2# ) 5.00 3.20 0.50 !cnoe31,2dd2o
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 31 and name HD1# ) 5.00 3.20 0.50 !cnoe31
assign ((resid 14 and name HE1 ) or
( resid 14 and name HE2 )) ( resid 31 and name HD1# ) 5.00 3.20 0.50 !cnoe31
assign ( resid 14 and name HZ ) ( resid 31 and name HD1# ) 5.00 3.20 0.50 !cnoe31
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 32 and name HN ) 5.00 3.20 0.00 !hnoe32
assign ((resid 14 and name HE1 ) or
( resid 14 and name HE2 )) ( resid 32 and name HN ) 5.00 3.20 0.00 !hnoe32
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 32 and name HA ) 5.00 3.20 0.00 !2dd2o
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 32 and name HG2# ) 3.50 1.70 0.50 !cnoe32
assign ((resid 14 and name HE1 ) or
( resid 14 and name HE2 )) ( resid 32 and name HG2# ) 3.50 1.70 0.50 !cnoe32
assign ( resid 14 and name HZ ) ( resid 32 and name HG2# ) 6.00 4.20 0.50 !cnoe32
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 35 and name HD1# ) 5.00 3.20 0.50 !cnoe35
assign ((resid 14 and name HE1 ) or
( resid 14 and name HE2 )) ( resid 35 and name HD1# ) 5.00 3.20 0.50 !cnoe35
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 41 and name HG1# ) 5.00 3.20 0.50 !cnoe41
assign ((resid 14 and name HE1 ) or
( resid 14 and name HE2 )) ( resid 41 and name HG1# ) 5.00 3.20 0.50 !cnoe41
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 41 and name HG2# ) 5.00 3.20 0.50 !cnoe41
assign ((resid 14 and name HE1 ) or
( resid 14 and name HE2 )) ( resid 41 and name HG2# ) 5.00 3.20 0.50 !cnoe41
assign ( resid 14 and name HZ ) ( resid 46 and name HG1# ) 6.00 4.20 0.50 !cnoe46
assign ((resid 14 and name HE1 ) or
( resid 14 and name HE2 )) ( resid 46 and name HG1# ) 5.00 3.20 0.50 !cnoe46
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 46 and name HG1# ) 5.00 3.20 0.50 !cnoe46
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 46 and name HG2# ) 5.00 3.20 0.50 !cnoe46
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 80 and name HN ) 6.00 4.20 0.00 !hnoe80
assign ((resid 14 and name HD1 ) or
( resid 14 and name HD2 )) ( resid 81 and name HA ) 5.00 3.20 0.00 !2dd2o
assign ((resid 14 and name HE1 ) or
( resid 14 and name HE2 )) ( resid 81 and name HA ) 5.00 3.20 0.00 !2dd2o
!CYS15
assign ( resid 15 and name HN ) ( resid 80 and name HG1# ) 5.00 3.20 0.50 !hnoe15
assign ( resid 15 and name HN ) ( resid 81 and name HA ) 5.00 3.20 0.00 !hnoe15
assign ((resid 15 and name HB1 ) or
( resid 15 and name HB2 )) ( resid 90 and name HG2# ) 5.00 3.20 0.50 !ccnoe90
!GLY16
assign ((resid 16 and name HA1 ) or
( resid 16 and name HA2 )) ( resid 17 and name HN ) 2.70 0.90 0.00 !hnoe17
assign ((resid 16 and name HA1 ) or
( resid 16 and name HA2 )) ( resid 90 and name HG2# ) 3.50 1.70 0.50 !ccnoe90,cnoe
!SER17
assign ( resid 17 and name HN ) ( resid 90 and name HG2# ) 3.50 1.70 0.50 !hnoe17
!ILE18
assign ( resid 18 and name HA ) ( resid 20 and name HN ) 5.00 3.20 0.00 !hnoe20
assign ( resid 18 and name HA )
((resid 22 and name HD1 ) or ( resid 22 and name HD2 )) 5.00 3.20 0.00 !ccnoe,b,cnoe,b
assign ( resid 18 and name HA )
((resid 28 and name HD1 ) or ( resid 28 and name HD2 )) 5.00 3.20 0.00 !cnoe18
assign ( resid 18 and name HA )
((resid 28 and name HE1 ) or ( resid 28 and name HE2 )) 5.00 3.20 0.00 !cnoe18
assign ( resid 18 and name HG2# ) ( resid 21 and name HN ) 5.00 3.20 0.50 !hnoe21
assign ( resid 18 and name HG2# ) ( resid 19 and name HA ) 5.00 3.20 0.50 !ccnoe18
assign ( resid 18 and name HG2# )
((resid 22 and name HD1 ) or ( resid 22 and name HD2 )) 3.50 1.70 0.50 !ccnoe,b,cnoe,b
assign ( resid 18 and name HD1# )
((resid 22 and name HD1 ) or ( resid 22 and name HD2 )) 5.00 3.20 0.50 !ccnoe,b,cnoe,b
assign ( resid 18 and name HD1# ) ( resid 25 and name HA ) 6.00 4.20 0.50 !ccnoe,b
assign ( resid 18 and name HG2# ) ( resid 25 and name HA ) 6.00 4.20 0.50 !ccnoe,b
assign ( resid 18 and name HG2# )
((resid 25 and name HG1 ) or ( resid 25 and name HG2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 18 and name HD1# )
((resid 25 and name HG1 ) or ( resid 25 and name HG2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 18 and name HG2# )
((resid 25 and name HE21 ) or ( resid 25 and name HE22 )) 3.50 1.70 0.50 !nxfnoe
assign ( resid 18 and name HD1# )
((resid 25 and name HE21 ) or ( resid 25 and name HE22 )) 5.00 3.20 0.50 !nxfnoe,ch3noe
assign ( resid 18 and name HD1# )
((resid 28 and name HD1 ) or ( resid 28 and name HD2 )) 5.00 3.20 0.50 !cnoe18
assign ( resid 18 and name HD1# )
((resid 28 and name HE1 ) or ( resid 28 and name HE2 )) 5.00 3.20 0.50 !cnoe18
assign ( resid 18 and name HG2# )
((resid 28 and name HE1 ) or ( resid 28 and name HE2 )) 3.50 1.70 0.50 !cnoe18mg2
assign ( resid 18 and name HG2# )
((resid 28 and name HD1 ) or ( resid 28 and name HD2 )) 5.00 3.20 0.50 !cnoe18mg2
assign ( resid 18 and name HD1# ) ( resid 29 and name HB# ) 6.00 4.20 1.00 !ccnoe29
assign ( resid 18 and name HG2# ) ( resid 45 and name HE1 ) 3.50 1.70 0.50 !cnoe18,2dfil
assign ( resid 18 and name HD1# ) ( resid 45 and name HE1 ) 5.00 3.20 0.50 !cnoe18,2dfil
assign ( resid 18 and name HD1# ) ( resid 46 and name HG1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 18 and name HD1# ) ( resid 46 and name HG2# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 18 and name HG2# ) ( resid 47 and name HA ) 5.00 3.20 0.50 !ccnoe18
assign ( resid 18 and name HD1# ) ( resid 47 and name HA ) 6.00 4.20 0.50 !ccnoe47,b
assign ( resid 18 and name HD1# ) ( resid 47 and name HB# ) 5.00 3.20 1.00 !ccnoe47
assign ( resid 18 and name HG2# ) ( resid 49 and name HA ) 5.00 3.20 0.50 !ccnoe18
assign ( resid 18 and name HD1# ) ( resid 49 and name HA ) 6.00 4.20 0.50 !ccnoe49,b
assign ( resid 18 and name HD1# ) ( resid 49 and name HB# ) 5.00 3.20 1.00 !ccnoe49
assign ( resid 18 and name HG2# ) ( resid 49 and name HB# ) 5.00 3.20 1.00 !ccnoe18
assign ( resid 18 and name HD1# ) ( resid 54 and name HG ) 6.00 4.20 0.50 !ccnoe54
assign ( resid 18 and name HD1# ) ( resid 54 and name HD1# ) 5.00 3.20 1.00 !ccnoe
assign ( resid 18 and name HD1# ) ( resid 54 and name HD2# ) 6.00 4.20 1.00 !ccnoe
assign ( resid 18 and name HG2# )
((resid 56 and name HG1 ) or ( resid 56 and name HG2 )) 5.00 3.20 0.50 !ccnoe18,
assign ( resid 18 and name HG2# ) ( resid 65 and name HD1# ) 6.00 4.20 1.00 !ccnoe18
assign ( resid 18 and name HG2# )
((resid 65 and name HG11 ) or ( resid 65 and name HG12 )) 5.00 3.20 0.50 !ccnoe18
assign ((resid 18 and name HG11 ) or
( resid 18 and name HG12 )) ( resid 65 and name HD1# ) 5.00 3.20 0.50 !ccnoe65
!ARG19
assign ( resid 19 and name HA ) ( resid 20 and name HN ) 3.50 1.70 0.00 !hnoe20
assign ((resid 19 and name HD1 ) or
( resid 19 and name HD2 )) ( resid 65 and name HD1# ) 6.00 4.20 0.50 !ccnoe19
!GLY21
assign ( resid 21 and name HN ) ( resid 22 and name HN ) 5.00 3.20 0.00 !hnoe21,b
!ARG22
assign ( resid 22 and name HA )
((resid 25 and name HB1 ) or ( resid 25 and name HB2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 22 and name HA )
((resid 25 and name HG1 ) or ( resid 25 and name HG2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 22 and name HD1 ) or ( resid 22 and name HD2 ))
((resid 25 and name HB1 ) or ( resid 25 and name HB2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 22 and name HD1 ) or ( resid 22 and name HD2 ))
((resid 25 and name HG1 ) or ( resid 25 and name HG2 )) 5.00 3.20 0.00 !ccnoe,b
!GLU23
assign ( resid 23 and name HN ) ( resid 24 and name HN ) 3.50 1.70 0.00 !hnoe,b
assign ( resid 23 and name HA ) ( resid 26 and name HB# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 23 and name HG1 ) or
( resid 23 and name HG2 )) ( resid 26 and name HB# ) 5.00 3.20 0.50 !ccnoe,b
!ASP24
assign ( resid 24 and name HN ) ( resid 25 and name HN ) 3.50 1.70 0.00 !hnoe,b
assign ( resid 24 and name HA ) ( resid 27 and name HN ) 3.50 1.70 0.00 !hnoe27
assign ( resid 24 and name HA )
((resid 27 and name HB1 ) or ( resid 27 and name HB2 )) 5.00 3.20 0.00 !ccnoe24
assign ( resid 24 and name HA ) ( resid 27 and name HD2# ) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 24 and name HA ) ( resid 28 and name HN ) 6.00 4.20 0.00 !hnoe28
!GLN25
assign ( resid 25 and name HN ) ( resid 26 and name HN ) 2.70 0.90 0.00 !hnoe25,b
assign ( resid 25 and name HA )
((resid 25 and name HG1 ) or ( resid 25 and name HG2 )) 2.70 0.90 0.00 !ccnoe
assign ( resid 25 and name HA ) ( resid 28 and name HN ) 5.00 3.20 0.00 !hnoe28
assign ( resid 25 and name HA ) ( resid 29 and name HN ) 6.00 4.20 0.00 !hnoe29
assign ((resid 25 and name HG1 ) or
( resid 25 and name HG2 )) ( resid 29 and name HB# ) 5.00 3.20 0.50 !ccnoe29
assign ((resid 25 and name HE21 ) or
( resid 25 and name HE22 )) ( resid 29 and name HB# ) 5.00 3.20 0.50 !nxfnoe25
assign ((resid 25 and name HG1 ) or
( resid 25 and name HG2 )) ( resid 49 and name HA ) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 25 and name HG1 ) or
( resid 25 and name HG2 )) ( resid 49 and name HB# ) 3.50 1.70 0.50 !ccnoe,b
assign ((resid 25 and name HE21 ) or
( resid 25 and name HE22 )) ( resid 49 and name HA ) 5.00 3.20 0.00 !nxfnoe25
assign ((resid 25 and name HE21 ) or
( resid 25 and name HE22 )) ( resid 49 and name HB# ) 5.00 3.20 0.50 !nxfnoe25
!ALA26
assign ( resid 26 and name HN ) ( resid 27 and name HN ) 2.70 0.90 0.00 !hnoe27,b
assign ( resid 26 and name HB# ) ( resid 27 and name HN ) 3.50 1.70 0.50 !hnoe27
assign ( resid 26 and name HB# )
((resid 30 and name HD1 ) or ( resid 30 and name HD2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 26 and name HB# )
((resid 50 and name HG1 ) or ( resid 50 and name HG2 )) 5.00 3.20 0.50 !ccnoe26
!LEU27
assign ( resid 27 and name HN ) ( resid 28 and name HN ) 2.70 0.90 0.00 !hnoe27,b
assign ( resid 27 and name HA ) ( resid 30 and name HN ) 3.50 1.70 0.00 !hnoe30
assign ( resid 27 and name HA )
((resid 30 and name HB1 ) or ( resid 30 and name HB2 )) 6.00 4.20 0.00 !ccnoe27
assign ( resid 27 and name HA )
((resid 30 and name HD1 ) or ( resid 30 and name HD2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 27 and name HD2# )
((resid 28 and name HD1 ) or ( resid 28 and name HD2 )) 3.50 1.70 0.50 !cnoe27
assign ( resid 27 and name HD2# )
((resid 28 and name HE1 ) or ( resid 28 and name HE2 )) 5.00 3.20 0.50 !cnoe27,ov
assign ( resid 27 and name HD1# )
((resid 28 and name HD1 ) or ( resid 28 and name HD2 )) 5.00 3.20 0.50 !cnoe27
assign ( resid 27 and name HD1# )
((resid 28 and name HE1 ) or ( resid 28 and name HE2 )) 5.00 3.20 0.50 !cnoe27
assign ( resid 27 and name HD1# )
((resid 30 and name HD1 ) or ( resid 30 and name HD2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 27 and name HD1# )
((resid 30 and name HG1 ) or ( resid 30 and name HG2 )) 5.00 3.20 0.50 !ccnoe27
assign ( resid 27 and name HD1# )
((resid 30 and name HB1 ) or ( resid 30 and name HB2 )) 5.00 3.20 0.50 !ccnoe27
assign ( resid 27 and name HD1# ) ( resid 30 and name HN ) 5.00 3.20 0.50 !hnoe30
assign ( resid 27 and name HD1# ) ( resid 31 and name HN ) 5.00 3.20 0.50 !hnoe31
assign ( resid 27 and name HD1# ) ( resid 31 and name HD1# ) 3.50 1.70 1.00 !ch3,ccnoe,b
assign ( resid 27 and name HD2# ) ( resid 31 and name HD1# ) 3.50 1.70 1.00 !ch3,ccnoe,b
assign ( resid 27 and name HD1# ) ( resid 31 and name HG2# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 27 and name HD1# ) ( resid 107 and name HD1# ) 6.00 4.20 1.00 !ch3noe27,b
assign ( resid 27 and name HD1# )
((resid 109 and name HD1 ) or ( resid 109 and name HD2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 27 and name HD2# )
((resid 109 and name HD1 ) or ( resid 109 and name HD2 )) 6.00 4.20 0.50 !ccnoe,b
assign ( resid 27 and name HD2# )
((resid 134 and name HD1 ) or ( resid 134 and name HD2 )) 6.00 4.20 0.50 !c13noe
assign ( resid 27 and name HD2# )
((resid 134 and name HE1 ) or ( resid 134 and name HE2 )) 5.00 3.20 0.50 !c13noe
assign ( resid 27 and name HD2# ) ( resid 134 and name HH ) 3.50 1.70 0.50 !ch3noech3
assign ( resid 27 and name HD1# )
((resid 134 and name HD1 ) or ( resid 134 and name HD2 )) 5.00 3.20 0.50 !c13noe
assign ( resid 27 and name HD1# )
((resid 134 and name HE1 ) or ( resid 134 and name HE2 )) 3.50 1.70 0.50 !c13noe
assign ( resid 27 and name HD1# ) ( resid 134 and name HH ) 5.00 3.20 0.50 !ch3noech3
assign ( resid 27 and name HD1# ) ( resid 136 and name HN ) 3.50 1.70 0.50 !hnoe136
assign ( resid 27 and name HD1# ) ( resid 136 and name HA ) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 27 and name HD2# ) ( resid 136 and name HA ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 27 and name HD1# )
((resid 136 and name HG1 ) or ( resid 136 and name HG2 )) 2.70 0.90 0.50 !ccnoe,b
assign ( resid 27 and name HD2# )
((resid 136 and name HG1 ) or ( resid 136 and name HG2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 27 and name HD2# )
((resid 136 and name HB1 ) or ( resid 136 and name HB2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 27 and name HD1# )
((resid 136 and name HB1 ) or ( resid 136 and name HB2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 27 and name HD1# ) ( resid 139 and name HN ) 5.00 3.20 0.50 !hnoe139
assign ( resid 27 and name HD2# ) ( resid 139 and name HG2# ) 5.00 3.20 1.00 !ch3,ccnoe139
assign ( resid 27 and name HD2# ) ( resid 139 and name HG1# ) 6.00 4.20 1.00 !ch3,ccnoe139
assign ( resid 27 and name HD1# ) ( resid 139 and name HG2# ) 2.70 0.90 1.00 !ch3noech3,check
assign ( resid 27 and name HD1# ) ( resid 139 and name HG1# ) 3.50 1.70 1.00 !ch3,ccnoe27
!TYR28
assign ( resid 28 and name HN ) ( resid 29 and name HN ) 2.70 0.90 0.00 !hnoe28,b
assign ( resid 28 and name HA ) ( resid 31 and name HN ) 3.50 1.70 0.00 !hnoe30
assign ((resid 28 and name HD1 ) or
( resid 28 and name HD2 )) ( resid 31 and name HD1# ) 3.50 1.70 0.50 !cnoe31
assign ((resid 28 and name HE1 ) or
( resid 28 and name HE2 )) ( resid 31 and name HD1# ) 3.50 1.70 0.50 !cnoe31
assign ((resid 28 and name HD1 ) or
( resid 28 and name HD2 )) ( resid 31 and name HG2# ) 3.50 1.70 0.50 !cnoe31
assign ((resid 28 and name HE1 ) or
( resid 28 and name HE2 )) ( resid 31 and name HG2# ) 5.00 3.20 0.50 !cnoe31
assign ((resid 28 and name HD1 ) or
( resid 28 and name HD2 )) ( resid 32 and name HN ) 5.00 3.20 0.00 !hnoe32
assign ((resid 28 and name HD1 ) or
( resid 28 and name HD2 )) ( resid 32 and name HG2# ) 5.00 3.20 0.50 !cnoe32
assign ((resid 28 and name HE1 ) or
( resid 28 and name HE2 )) ( resid 32 and name HG2# ) 5.00 3.20 0.50 !cnoe32
assign ((resid 28 and name HD1 ) or
( resid 28 and name HD2 )) ( resid 46 and name HG1# ) 5.00 3.20 0.50 !cnoe46
assign ((resid 28 and name HE1 ) or
( resid 28 and name HE2 )) ( resid 46 and name HG1# ) 5.00 3.20 0.50 !cnoe46
assign ((resid 28 and name HD1 ) or
( resid 28 and name HD2 )) ( resid 46 and name HG2# ) 5.00 3.20 0.50 !cnoe46
assign ((resid 28 and name HE1 ) or
( resid 28 and name HE2 )) ( resid 46 and name HG2# ) 5.00 3.20 0.50 !cnoe46
!ALA29
assign ( resid 29 and name HN ) ( resid 30 and name HN ) 2.70 0.90 0.00 !hnoe29,b
assign ( resid 29 and name HA ) ( resid 32 and name HB ) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 29 and name HA ) ( resid 32 and name HG2# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 29 and name HA ) ( resid 32 and name HG1# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 29 and name HA ) ( resid 32 and name HN ) 3.50 1.70 0.00 !hnoe32
assign ( resid 29 and name HB# ) ( resid 32 and name HB ) 5.00 3.20 0.50 !ccnoe29
assign ( resid 29 and name HB# ) ( resid 32 and name HG2# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 29 and name HB# ) ( resid 32 and name HG1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 29 and name HB# )
((resid 33 and name HB1 ) or ( resid 33 and name HB2 )) 6.00 4.20 0.50 !ccnoe,b
assign ( resid 29 and name HA ) ( resid 47 and name HB# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 29 and name HB# ) ( resid 47 and name HB# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 29 and name HB# ) ( resid 47 and name HA ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 29 and name HB# ) ( resid 48 and name HA ) 5.00 3.20 0.50 !ccnoe48
assign ( resid 29 and name HB# )
((resid 48 and name HB1 ) or ( resid 48 and name HB2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 29 and name HB# ) ( resid 49 and name HN ) 6.00 4.20 0.50 !
assign ( resid 29 and name HB# ) ( resid 50 and name HA ) 6.00 4.20 0.50 !
assign ( resid 29 and name HB# )
((resid 50 and name HG1 ) or ( resid 50 and name HG2 )) 5.00 3.20 0.50 !ccnoe29
!ARG30
assign ( resid 30 and name HN ) ( resid 31 and name HN ) 2.70 0.90 0.00 !hnoe30,b
assign ( resid 30 and name HA ) ( resid 31 and name HN ) 3.50 1.70 0.00 !hnoe31
assign ( resid 30 and name HA )
((resid 33 and name HB1 ) or ( resid 33 and name HB2 )) 5.00 3.20 0.00 !ccnoe30,b
assign ((resid 30 and name HD1 ) or
( resid 30 and name HD2 )) ( resid 139 and name HG1# ) 3.50 1.70 0.50 !ccnoe,b
!ILE31
assign ( resid 31 and name HN ) ( resid 32 and name HN ) 2.70 0.90 0.00 !hnoe31,b
assign ( resid 31 and name HA ) ( resid 32 and name HN ) 3.50 1.70 0.00 !hnoe32
assign ( resid 31 and name HA ) ( resid 139 and name HG1# ) 5.00 3.20 0.50 !ccnoe139
assign ( resid 31 and name HA ) ( resid 139 and name HG2# ) 5.00 3.20 0.50 !ccnoe139
assign ( resid 31 and name HA ) ( resid 143 and name HD1# ) 3.50 1.70 0.50 !cnoe143,v
assign ( resid 31 and name HB ) ( resid 32 and name HN ) 3.50 1.70 0.00 !hnoe32
assign ( resid 31 and name HG2# ) ( resid 32 and name HN ) 5.00 3.20 0.50 !hnoe32
assign ( resid 31 and name HG2# ) ( resid 35 and name HN ) 5.00 3.20 0.50 !hnoe35
assign ( resid 31 and name HG2# ) ( resid 35 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 31 and name HG2# ) ( resid 80 and name HG1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 31 and name HG2# ) ( resid 80 and name HG2# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 31 and name HD1# ) ( resid 107 and name HD1# ) 3.50 1.70 1.00 !ch3,ccnoe107
assign ( resid 31 and name HD1# ) ( resid 107 and name HD2# ) 5.00 3.20 1.00 !ch3noe,b,ccnoe107
assign ( resid 31 and name HG2# ) ( resid 107 and name HD1# ) 6.00 4.20 1.00 !ccnoe107
assign ( resid 31 and name HG2# ) ( resid 139 and name HG2# ) 5.00 3.20 1.00 !cnoe139
assign ( resid 31 and name HD1# ) ( resid 139 and name HG2# ) 3.50 1.70 1.00 !ch3noe139,ccnoe,b
assign ( resid 31 and name HD1# ) ( resid 139 and name HG1# ) 5.00 3.20 1.00 !ch3noe139,ccnoe,b
assign ( resid 31 and name HG2# ) ( resid 143 and name HD1# ) 3.50 1.70 1.00 !c13noe143,ccnoe,b
assign ( resid 31 and name HG2# ) ( resid 143 and name HD2# ) 5.00 3.20 1.00 !c13noe143,ccnoe,b
!VAL32
assign ( resid 32 and name HN ) ( resid 33 and name HN ) 2.70 0.90 0.00 !hnoe32,b
assign ( resid 32 and name HN ) ( resid 32 and name HG2# ) 2.70 0.90 0.50 !ch3noe
assign ( resid 32 and name HA ) ( resid 32 and name HG1# ) 2.70 0.90 0.50 !ccnoe32a
assign ( resid 32 and name HA ) ( resid 35 and name HN ) 3.50 1.70 0.00 !hnoe35
assign ( resid 32 and name HA ) ( resid 35 and name HD1# ) 5.00 3.20 0.50 !ccnoe35
assign ( resid 32 and name HA ) ( resid 41 and name HG1# ) 5.00 3.20 0.50 !ccnoe41
assign ( resid 32 and name HA ) ( resid 41 and name HG2# ) 5.00 3.20 0.50 !ccnoe41
assign ( resid 32 and name HB ) ( resid 33 and name HN ) 3.50 1.70 0.00 !hnoe33
assign ( resid 32 and name HG1# )
((resid 33 and name HB1 ) or ( resid 33 and name HB2 )) 5.00 3.20 0.50 !cnnoe,b
assign ( resid 32 and name HG2# ) ( resid 35 and name HD1# ) 5.00 3.20 1.00 !ccnoe35
assign ( resid 32 and name HG1# )
((resid 36 and name HD1 ) or ( resid 36 and name HD2 )) 3.50 1.70 0.50 !ccnoe32
assign ( resid 32 and name HG2# ) ( resid 41 and name HG1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 32 and name HG1# )
((resid 44 and name HB1 ) or ( resid 44 and name HB2 )) 5.00 3.20 0.50 !ccnoe32
assign ( resid 32 and name HG1# )
((resid 44 and name HG1 ) or ( resid 44 and name HG2 )) 5.00 3.20 0.50 !ccnoe32
assign ( resid 32 and name HG1# ) ( resid 47 and name HB# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 32 and name HG2# ) ( resid 47 and name HB# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 32 and name HG1# ) ( resid 47 and name HA ) 5.00 3.20 0.50 !cnoe,b
!SER33
assign ( resid 33 and name HN ) ( resid 34 and name HN ) 2.70 0.90 0.00 !hnoe33,b
assign ( resid 33 and name HA ) ( resid 34 and name HN ) 3.50 1.70 0.00 !hnoe34
assign ( resid 33 and name HA ) ( resid 36 and name HN ) 3.50 1.70 0.00 !hnoe36
assign ( resid 33 and name HA )
((resid 36 and name HD1 ) or ( resid 36 and name HD2 )) 3.50 1.70 0.00 !ccnoe,b
assign ((resid 33 and name HB1 ) or
( resid 33 and name HB2 )) ( resid 34 and name HN ) 3.50 1.70 0.00 !hnoe34
assign ((resid 33 and name HB1 ) or ( resid 33 and name HB2 ))
((resid 36 and name HD1 ) or ( resid 36 and name HD2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 33 and name HB1 ) or ( resid 33 and name HB2 ))
((resid 37 and name HG1 ) or ( resid 37 and name HG2 )) 5.00 3.20 0.00 !ccnoe,b
!ARG34
assign ( resid 34 and name HN ) ( resid 35 and name HN ) 2.70 0.90 0.00 !hnoe34,b
assign ( resid 34 and name HA ) ( resid 35 and name HN ) 3.50 1.70 0.00 !hnoe35
assign ( resid 34 and name HA ) ( resid 37 and name HN ) 3.50 1.70 0.00 !hnoe37
assign ( resid 34 and name HA )
((resid 37 and name HD1 ) or ( resid 37 and name HD2 )) 3.50 1.70 0.00 !cnoe37,ccnoe37
assign ( resid 34 and name HN ) ( resid 143 and name HD1# ) 5.00 3.20 0.50 !ch3noech3
assign ( resid 34 and name HA ) ( resid 143 and name HD1# ) 5.00 3.20 0.50 !cnoe143,ccnoe143
assign ((resid 34 and name HD1 ) or
( resid 34 and name HD2 )) ( resid 140 and name HN ) 5.00 3.20 0.00 !hnoe140
!LEU35
assign ( resid 35 and name HN ) ( resid 36 and name HN ) 2.70 0.90 0.00 !hnoe36,b
assign ( resid 35 and name HA ) ( resid 35 and name HD2# ) 2.70 0.90 0.50 !cnoe35
assign ( resid 35 and name HA ) ( resid 37 and name HN ) 5.00 3.20 0.00 !hnoe37
assign ( resid 35 and name HA ) ( resid 38 and name HN ) 3.50 1.70 0.00 !hnoe38
assign ( resid 35 and name HA )
((resid 38 and name HD1 ) or ( resid 38 and name HD2 )) 5.00 3.20 0.00 !cnoe35
assign ( resid 35 and name HD1# ) ( resid 36 and name HN ) 3.50 1.70 0.50 !hnoe36
assign ( resid 35 and name HD2# ) ( resid 38 and name HN ) 5.00 3.20 0.50 !hnoe38
assign ( resid 35 and name HD2# )
((resid 38 and name HE1 ) or ( resid 38 and name HE2 )) 5.00 3.20 0.50 !cnoe35
assign ( resid 35 and name HD2# )
((resid 38 and name HD1 ) or ( resid 38 and name HD2 )) 5.00 3.20 0.50 !cnoe35,ov
assign ( resid 35 and name HD1# ) ( resid 41 and name HG2# ) 3.50 1.70 1.00 !ch3noe41,ccnoe,b
assign ( resid 35 and name HD1# ) ( resid 41 and name HG1# ) 3.50 1.70 1.00 !ch3noe41
assign ( resid 35 and name HD2# ) ( resid 41 and name HG2# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 35 and name HD2# ) ( resid 41 and name HG1# ) 5.00 3.20 1.00 !ccnoe41
assign ( resid 35 and name HD1# ) ( resid 80 and name HG2# ) 3.50 1.70 1.00 !ch3noe80,rlx
assign ( resid 35 and name HD2# ) ( resid 80 and name HG2# ) 5.00 3.20 1.00 !ccnoe80
assign ( resid 35 and name HD1# ) ( resid 80 and name HG1# ) 5.00 3.20 1.00 !ccnoe35
assign ( resid 35 and name HD2# ) ( resid 80 and name HG1# ) 5.00 3.20 1.00 !ccnoe35
assign ( resid 35 and name HD2# ) ( resid 143 and name HD1# ) 5.00 3.20 1.00 !ccnoe35
assign ( resid 35 and name HD2# ) ( resid 143 and name HD2# ) 3.50 1.70 1.00 !ccnoe143
assign ( resid 35 and name HD2# ) ( resid 147 and name HZ ) 3.50 1.70 0.50 !cnoe35
assign ( resid 35 and name HD2# )
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 5.00 3.20 0.50 !cnoe35
assign ( resid 35 and name HD2# )
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 6.00 4.20 0.50 !cnoe35
!ARG36
assign ( resid 36 and name HN ) ( resid 37 and name HN ) 2.70 0.90 0.00 !hnoe36,b
assign ( resid 36 and name HN ) ( resid 41 and name HG2# ) 3.50 1.70 0.50 !ch3noech3
assign ( resid 36 and name HA ) ( resid 41 and name HG2# ) 3.50 1.70 0.50 !ccnoe,cnoe,b
assign ((resid 36 and name HB1 ) or
( resid 36 and name HB2 )) ( resid 41 and name HG2# ) 5.00 3.20 0.50 !ccnoe41
assign ((resid 36 and name HG1 ) or
( resid 36 and name HG2 )) ( resid 41 and name HG2# ) 5.00 3.20 0.50 !ccnoe41
assign ((resid 36 and name HD1 ) or
( resid 36 and name HD2 )) ( resid 41 and name HN ) 5.00 3.20 0.00 !hnoe41
assign ((resid 36 and name HD1 ) or
( resid 36 and name HD2 )) ( resid 41 and name HG2# ) 3.50 1.70 0.50 !ccnoe41,cnoe41
!ARG37
assign ( resid 37 and name HN ) ( resid 38 and name HN ) 2.70 0.90 0.00 !nnoe37,b
assign ( resid 37 and name HN )
((resid 38 and name HD1 ) or ( resid 38 and name HD2 )) 5.00 3.20 0.00 !hnoe37
assign ( resid 37 and name HN )
((resid 38 and name HE1 ) or ( resid 38 and name HE2 )) 5.00 3.20 0.00 !hnoe37
assign ( resid 37 and name HA ) ( resid 38 and name HN ) 3.50 1.70 0.00 !hnoe38
assign ((resid 37 and name HG1 ) or ( resid 37 and name HG2 ))
((resid 38 and name HD1 ) or ( resid 38 and name HD2 )) 5.00 3.20 0.00 !cnoe37
assign ((resid 37 and name HG1 ) or ( resid 37 and name HG2 ))
((resid 38 and name HE1 ) or ( resid 38 and name HE2 )) 5.00 3.20 0.00 !cnoe37
assign ((resid 37 and name HD1 ) or ( resid 37 and name HD2 ))
((resid 38 and name HE1 ) or ( resid 38 and name HE2 )) 3.50 1.70 0.00 !cnoe37
assign ((resid 37 and name HD1 ) or ( resid 37 and name HD2 ))
((resid 38 and name HD1 ) or ( resid 38 and name HD2 )) 5.00 3.20 0.00 !cnoe37
!TYR38
assign ( resid 38 and name HN ) ( resid 39 and name HN ) 5.00 3.20 0.00 !nnoe38,can
assign ( resid 38 and name HN )
((resid 38 and name HD1 ) or ( resid 38 and name HD2 )) 2.70 0.90 0.00 !hnoe38
assign ((resid 38 and name HD1 ) or
( resid 38 and name HD2 )) ( resid 39 and name HN ) 5.00 3.20 0.00 !hnoe39
assign ((resid 38 and name HD1 ) or
( resid 38 and name HD2 )) ( resid 143 and name HD1# ) 5.00 3.20 0.50 !c13noe
assign ((resid 38 and name HE1 ) or
( resid 38 and name HE2 )) ( resid 143 and name HD1# ) 5.00 3.20 0.50 !c13noe
assign ((resid 38 and name HD1 ) or
( resid 38 and name HD2 )) ( resid 143 and name HD2# ) 5.00 3.20 0.50 !c13noe
assign ((resid 38 and name HE1 ) or
( resid 38 and name HE2 )) ( resid 143 and name HD2# ) 5.00 3.20 0.50 !c13noe
assign ((resid 38 and name HE1 ) or
( resid 38 and name HE2 )) ( resid 144 and name HN ) 5.00 3.20 0.00 !hnoe144
assign ((resid 38 and name HD1 ) or ( resid 38 and name HD2 ))
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 3.50 1.70 0.00 !2dd2o
assign ((resid 38 and name HE1 ) or ( resid 38 and name HE2 ))
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 38 and name HE1 ) or ( resid 38 and name HE2 ))
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 38 and name HE1 ) or
( resid 38 and name HE2 )) ( resid 151 and name HD1# ) 3.50 1.70 0.50 !cnoe151
assign ((resid 38 and name HE1 ) or
( resid 38 and name HE2 )) ( resid 151 and name HD2# ) 5.00 3.20 0.50 !cnoe151
!GLY39
assign ( resid 39 and name HN ) ( resid 40 and name HN ) 5.00 3.20 0.00 !hnoe39,b
assign ((resid 39 and name HA1 ) or
( resid 39 and name HA2 )) ( resid 40 and name HN ) 2.70 0.90 0.00 !hnoe40
!LYS40
assign ( resid 40 and name HA ) ( resid 41 and name HN ) 2.70 0.90 0.00 !hnoe40
assign ((resid 40 and name HE1 ) or
( resid 40 and name HE2 )) ( resid 42 and name HD2# ) 2.70 0.90 0.50 !ccnoe42
assign ((resid 40 and name HD1 ) or
( resid 40 and name HD2 )) ( resid 42 and name HD2# ) 3.50 1.70 0.50 !ccnoe42
assign ((resid 40 and name HG1 ) or
( resid 40 and name HG2 )) ( resid 42 and name HD2# ) 5.00 3.20 0.50 !ccnoe42,b
assign ((resid 40 and name HB1 ) or
( resid 40 and name HB2 )) ( resid 42 and name HD2# ) 5.00 3.20 0.50 !ccnoe42
!VAL41
assign ( resid 41 and name HN ) ( resid 41 and name HG2# ) 2.70 0.90 0.50 !ch3noe,x1=180
assign ( resid 41 and name HA ) ( resid 42 and name HN ) 2.70 0.90 0.00 !hnoe42
assign ( resid 41 and name HG1# ) ( resid 42 and name HN ) 3.50 1.70 0.50 !ch3noe,x1=180
assign ( resid 41 and name HG1# )
((resid 44 and name HB1 ) or ( resid 44 and name HB2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 41 and name HG1# )
((resid 44 and name HG1 ) or ( resid 44 and name HG2 )) 5.00 3.20 0.50 !ccnoe41
!LEU42
assign ( resid 42 and name HA ) ( resid 42 and name HD2# ) 3.50 1.70 0.50 !ccnoe42
assign ( resid 42 and name HD1# ) ( resid 72 and name HA ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 42 and name HD2# ) ( resid 72 and name HE1 ) 2.70 0.90 0.50 !hnoe72he1
assign ( resid 42 and name HD1# ) ( resid 72 and name HE1 ) 3.50 1.70 0.50 !hnoe72he1
assign ( resid 42 and name HD2# ) ( resid 72 and name HD1 ) 3.50 1.70 0.50 !cnoe42,wker
assign ( resid 42 and name HD1# ) ( resid 72 and name HD1 ) 3.50 1.70 0.50 !cnoe42
assign ( resid 42 and name HD2# ) ( resid 72 and name HE3 ) 5.00 3.20 0.50 !cnoe42
assign ( resid 42 and name HD1# ) ( resid 75 and name HN ) 5.00 3.20 0.50 !hnoe75
assign ( resid 42 and name HD1# )
((resid 75 and name HB1 ) or ( resid 75 and name HB2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 42 and name HD1# )
((resid 75 and name HG1 ) or ( resid 75 and name HG2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 42 and name HD2# )
((resid 75 and name HG1 ) or ( resid 75 and name HG2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 42 and name HD1# )
((resid 75 and name HE21 ) or ( resid 75 and name HE22 )) 5.00 3.20 0.50 !nxfnoe75
assign ( resid 42 and name HD2# )
((resid 75 and name HE21 ) or ( resid 75 and name HE22 )) 5.00 3.20 0.50 !nxfnoe75
assign ( resid 42 and name HD1# ) ( resid 76 and name HN ) 5.00 3.20 0.50 !hnoe76,check12mg1
assign ( resid 42 and name HD1# ) ( resid 76 and name HA ) 5.00 3.20 0.50 !cnoe,b,ccnoe42
assign ( resid 42 and name HD1# ) ( resid 76 and name HB# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 42 and name HD2# ) ( resid 76 and name HB# ) 5.00 3.20 1.00 !ccnoe,b
!HIS45
assign ( resid 45 and name HA ) ( resid 46 and name HN ) 3.50 1.70 0.00 !hnoe46
!VAL46
assign ( resid 46 and name HA ) ( resid 47 and name HN ) 3.50 1.70 0.00 !hnoe47
assign ( resid 46 and name HA ) ( resid 49 and name HB# ) 6.00 4.20 0.50 !ccnoe,
assign ( resid 46 and name HG2# ) ( resid 46 and name HN ) 3.50 1.70 0.50 !ch3noe
assign ( resid 46 and name HG1# ) ( resid 47 and name HN ) 3.50 1.70 0.50 !ch3noe
assign ( resid 46 and name HG1# ) ( resid 47 and name HA ) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 46 and name HG1# ) ( resid 49 and name HB# ) 5.00 3.20 1.00 !ccnoe46,
assign ( resid 46 and name HG2# ) ( resid 49 and name HB# ) 3.50 1.70 1.00 !ccnoe46,
assign ( resid 46 and name HG2# ) ( resid 65 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 46 and name HG1# ) ( resid 65 and name HD1# ) 6.00 4.20 1.00 !ccnoe,b
!ALA47
assign ( resid 47 and name HA ) ( resid 48 and name HN ) 3.50 1.70 0.00 !hnoe48
assign ( resid 47 and name HA )
((resid 50 and name HB1 ) or ( resid 50 and name HB2 )) 6.00 4.20 0.00 !ccnoe,b
assign ( resid 47 and name HA )
((resid 50 and name HG1 ) or ( resid 50 and name HG2 )) 3.50 1.70 0.00 !ccnoe,b
assign ( resid 47 and name HA ) ( resid 51 and name HD1# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 47 and name HA ) ( resid 51 and name HD2# ) 6.00 4.20 0.50 !ccnoe,b
!ASP48
assign ( resid 48 and name HA ) ( resid 49 and name HN ) 3.50 1.70 0.00 !hnoe49
assign ( resid 48 and name HA )
((resid 51 and name HB1 ) or ( resid 51 and name HB2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 48 and name HA ) ( resid 51 and name HD1# ) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 48 and name HA ) ( resid 51 and name HD2# ) 5.00 3.20 0.50 !ccnoe48
assign ((resid 48 and name HB1 ) or
( resid 48 and name HB2 )) ( resid 51 and name HD1# ) 5.00 3.20 0.50 !ccnoe48
!ALA49
assign ( resid 49 and name HN ) ( resid 50 and name HN ) 3.50 1.70 0.00 !hnoe50
assign ( resid 49 and name HA )
((resid 52 and name HB1 ) or ( resid 52 and name HB2 )) 6.00 4.20 0.00 !ccnoe52b
assign ( resid 49 and name HB# )
((resid 52 and name HB1 ) or ( resid 52 and name HB2 )) 6.00 4.20 0.50 !ccnoe,b
!GLU50
assign ( resid 50 and name HN ) ( resid 51 and name HN ) 3.50 1.70 0.00 !hnoe,b
assign ( resid 50 and name HA ) ( resid 51 and name HN ) 3.50 1.70 0.00 !hnoe51
assign ( resid 50 and name HA ) ( resid 54 and name HG ) 6.00 4.20 0.00 !ccnoe54,b
assign ( resid 50 and name HA ) ( resid 54 and name HD1# ) 5.00 3.20 0.50 !ccnoe54,b
assign ( resid 50 and name HA ) ( resid 54 and name HD2# ) 5.00 3.20 0.50 !ccnoe54,b
assign ((resid 50 and name HB1 ) or
( resid 50 and name HB2 )) ( resid 54 and name HG ) 5.00 3.20 0.00 !ccnoe54
!LEU51
assign ( resid 51 and name HN ) ( resid 52 and name HN ) 5.00 3.20 0.00 !hnoe,b
assign ( resid 51 and name HA ) ( resid 52 and name HN ) 3.50 1.70 0.00 !hnoe52
assign ( resid 51 and name HD2# ) ( resid 65 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b
!GLU52
assign ( resid 52 and name HA )
((resid 53 and name HD1 ) or ( resid 53 and name HD2 )) 3.50 1.70 0.00 !ccnoe,b
assign ( resid 52 and name HA )
((resid 53 and name HG1 ) or ( resid 53 and name HG2 )) 5.00 3.20 0.00 !ccnoe,b
!PRO53
assign ( resid 53 and name HA ) ( resid 54 and name HN ) 3.50 1.70 0.00 !hnoe54
assign ((resid 53 and name HB1 ) or
( resid 53 and name HB2 )) ( resid 58 and name HA ) 5.00 3.20 0.00 !ccnoe58
assign ((resid 53 and name HG1 ) or
( resid 53 and name HG2 )) ( resid 58 and name HA ) 5.00 3.20 0.00 !ccnoe58
assign ((resid 53 and name HB1 ) or
( resid 53 and name HB2 )) ( resid 58 and name HB# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 53 and name HG1 ) or
( resid 53 and name HG2 )) ( resid 58 and name HB# ) 5.00 3.20 0.50 !ccnoe58
!LEU54
assign ( resid 54 and name HA ) ( resid 55 and name HN ) 3.50 1.70 0.00 !hnoe55
assign ( resid 54 and name HA ) ( resid 58 and name HB# ) 5.00 3.20 0.50 !ccnoe58
assign ((resid 54 and name HB1 ) or
( resid 54 and name HB2 )) ( resid 58 and name HB# ) 3.50 1.70 0.50 !ccnoe58
assign ( resid 54 and name HD1# ) ( resid 58 and name HB# ) 3.50 1.70 1.00 !ccnoe58
assign ( resid 54 and name HD1# ) ( resid 65 and name HD1# ) 5.00 3.20 1.00 !ccnoe54
assign ( resid 54 and name HD2# ) ( resid 65 and name HD1# ) 6.00 4.20 1.00 !ccnoe54
!GLY55
assign ((resid 55 and name HA1 ) or
( resid 55 and name HA2 )) ( resid 56 and name HN ) 2.70 0.90 0.00 !hnoe56
!GLU56
assign ( resid 56 and name HA ) ( resid 57 and name HN ) 3.50 1.70 0.00 !hnoe57
assign ( resid 56 and name HA ) ( resid 65 and name HD1# ) 6.00 4.20 0.50 !ccnoe,b
assign ((resid 56 and name HG1 ) or
( resid 56 and name HG2 )) ( resid 65 and name HD1# ) 5.00 3.20 0.50 !ccnoe,b
!GLU57
assign ( resid 57 and name HA ) ( resid 58 and name HN ) 3.50 1.70 0.00 !hnoe58
!ALA58
assign ( resid 58 and name HA ) ( resid 59 and name HN ) 2.70 0.90 0.00 !hnoe59
!ALA59
assign ( resid 59 and name HA ) ( resid 60 and name HN ) 3.50 1.70 0.00 !hnoe60
!GLY60
assign ((resid 60 and name HA1 ) or
( resid 60 and name HA2 )) ( resid 61 and name HN ) 3.50 1.70 0.00 !hnoe61
assign ((resid 60 and name HA1 ) or
( resid 60 and name HA2 )) ( resid 62 and name HN ) 5.00 3.20 0.00 !hnoe62
assign ((resid 60 and name HA1 ) or ( resid 60 and name HA2 ))
((resid 64 and name HB1 ) or ( resid 64 and name HB2 )) 5.00 3.20 0.00 !cnoe64
assign ((resid 60 and name HA1 ) or
( resid 60 and name HA2 )) ( resid 65 and name HD1# ) 5.00 3.20 0.50 !ccnoe,b
!GLY61
assign ( resid 61 and name HN ) ( resid 62 and name HN ) 2.70 0.90 0.00 !hnoe61,b
assign ( resid 61 and name HN )
((resid 64 and name HD1 ) or ( resid 64 and name HD2 )) 5.00 3.20 0.00 !hnoe61
assign ((resid 61 and name HA1 ) or
( resid 61 and name HA2 )) ( resid 64 and name HN ) 5.00 3.20 0.00 !hnoe64
assign ((resid 61 and name HA1 ) or ( resid 61 and name HA2 ))
((resid 63 and name HB1 ) or ( resid 63 and name HB2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 61 and name HA1 ) or ( resid 61 and name HA2 ))
((resid 63 and name HG1 ) or ( resid 63 and name HG2 )) 5.00 3.20 0.00 !ccnoe63
assign ((resid 61 and name HA1 ) or ( resid 61 and name HA2 ))
((resid 64 and name HB1 ) or ( resid 64 and name HB2 )) 6.00 4.20 0.00 !cnoe64
assign ((resid 61 and name HA1 ) or
( resid 61 and name HA2 )) ( resid 65 and name HD1# ) 5.00 3.20 0.50 !ccnoe,b
!ASP62
assign ( resid 62 and name HN ) ( resid 63 and name HN ) 2.70 0.90 0.00 !hnoe62,b
assign ( resid 62 and name HA ) ( resid 63 and name HN ) 3.50 1.70 0.00 !hnoe63
assign ( resid 62 and name HA ) ( resid 65 and name HN ) 3.50 1.70 0.00 !hnoe65,pov
assign ( resid 62 and name HA ) ( resid 65 and name HB ) 5.00 3.20 0.00 !ccnoe65b
assign ( resid 62 and name HA ) ( resid 65 and name HD1# ) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 62 and name HA ) ( resid 65 and name HG2# ) 5.00 3.20 0.50 !ccnoe,b
!GLN63
assign ( resid 63 and name HN ) ( resid 64 and name HN ) 2.70 0.90 0.00 !hnoe63,b
assign ( resid 63 and name HA ) ( resid 66 and name HN ) 3.50 1.70 0.00 !hnoe66
!PHE64
assign ( resid 64 and name HN ) ( resid 65 and name HN ) 2.70 0.90 0.00 !nnoe64,b
assign ( resid 64 and name HA )
((resid 67 and name HB1 ) or ( resid 67 and name HB2 )) 5.00 3.20 0.00 !ccnoe67,cnoe64a
assign ( resid 64 and name HA )
((resid 67 and name HG1 ) or ( resid 67 and name HG2 )) 3.50 1.70 0.00 !ccnoe67,cnoe64a
!ILE65
assign ( resid 65 and name HN ) ( resid 66 and name HN ) 2.70 0.90 0.00 !hnoe65,b
!HIS66
assign ( resid 66 and name HD2 ) ( resid 70 and name HD1# ) 3.50 1.70 0.50 !cnoe70
assign ( resid 66 and name HE1 ) ( resid 70 and name HD1# ) 3.50 1.70 0.50 !cnoe70
assign ( resid 66 and name HD2 ) ( resid 70 and name HD2# ) 3.50 1.70 0.50 !cnoe70
assign ( resid 66 and name HE1 ) ( resid 70 and name HD2# ) 3.50 1.70 0.50 !cnoe70
!GLU67
assign ( resid 67 and name HA ) ( resid 70 and name HN ) 5.00 3.20 0.00 !hnoe70
assign ( resid 67 and name HA )
((resid 70 and name HB1 ) or ( resid 70 and name HB2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 67 and name HA ) ( resid 70 and name HD2# ) 6.00 4.20 0.50 !ccnoe70
!GLN68
assign ( resid 68 and name HA ) ( resid 71 and name HN ) 5.00 3.20 0.00 !hnoe71
assign ( resid 68 and name HA )
((resid 71 and name HB1 ) or ( resid 71 and name HB2 )) 5.00 3.20 0.00 !ccnoe,b
!ASP69
assign ( resid 69 and name HA ) ( resid 72 and name HN ) 5.00 3.20 0.00 !hnoe72
!LEU70
assign ( resid 70 and name HN ) ( resid 71 and name HN ) 2.70 0.90 0.00 !hnoe71,b
assign ( resid 70 and name HA )
((resid 73 and name HB1 ) or ( resid 73 and name HB2 )) 5.00 3.20 0.00 !ccnoe70a
assign ( resid 70 and name HA ) ( resid 73 and name HD1# ) 5.00 3.20 0.50 !ccnoe73,b
assign ( resid 70 and name HA ) ( resid 73 and name HD2# ) 5.00 3.20 0.50 !ccnoe73,b
assign ( resid 70 and name HD1# )
((resid 73 and name HB1 ) or ( resid 73 and name HB2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 70 and name HD1# ) ( resid 73 and name HD2# ) 2.70 0.90 1.00 !ch3,ccnoe70,cnoe70
assign ( resid 70 and name HD2# ) ( resid 73 and name HD2# ) 3.50 1.70 1.00 !ccnoe73
assign ( resid 70 and name HD1# ) ( resid 73 and name HD1# ) 5.00 3.20 1.00 !ccnoe73
assign ( resid 70 and name HD1# )
((resid 73 and name HB1 ) or ( resid 73 and name HB2 )) 3.50 1.70 0.50 !ccnoe70
assign ( resid 70 and name HD2# )
((resid 73 and name HB1 ) or ( resid 73 and name HB2 )) 5.00 3.20 0.50 !ccnoe70
assign ( resid 70 and name HD1# )
((resid 74 and name HG1 ) or ( resid 74 and name HG2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 70 and name HD2# )
((resid 74 and name HG1 ) or ( resid 74 and name HG2 )) 6.00 4.20 0.50 !ccnoe,b
assign ( resid 70 and name HD1# )
((resid 74 and name HB1 ) or ( resid 74 and name HB2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 70 and name HD1# )
((resid 92 and name HE1 ) or ( resid 92 and name HE2 )) 3.50 1.70 0.50 !cnoe70
assign ( resid 70 and name HD2# )
((resid 92 and name HE1 ) or ( resid 92 and name HE2 )) 3.50 1.70 0.50 !cnoe70
assign ( resid 70 and name HD1# )
((resid 92 and name HD1 ) or ( resid 92 and name HD2 )) 5.00 3.20 0.50 !cnoe70
assign ( resid 70 and name HD2# )
((resid 92 and name HD1 ) or ( resid 92 and name HD2 )) 5.00 3.20 0.50 !cnoe70
!ASN71
assign ( resid 71 and name HN ) ( resid 72 and name HN ) 2.70 0.90 0.00 !hnoe71
assign ( resid 71 and name HA ) ( resid 74 and name HN ) 3.50 1.70 0.00 !hnoe74
assign ( resid 71 and name HA )
((resid 74 and name HB1 ) or ( resid 74 and name HB2 )) 5.00 3.20 0.00 !ccnoe
assign ( resid 71 and name HA )
((resid 74 and name HG1 ) or ( resid 74 and name HG2 )) 5.00 3.20 0.00 !ccnoe
assign ( resid 71 and name HA )
((resid 74 and name HE21 ) or ( resid 74 and name HE22 )) 3.50 1.70 0.00 !nxfnoe
assign ( resid 71 and name HA ) ( resid 75 and name HN ) 5.00 3.20 0.00 !hnoe75
assign ( resid 71 and name HA )
((resid 75 and name HE21 ) or ( resid 75 and name HE22 )) 5.00 3.20 0.00 !nxfnoe
!TRP72
assign ( resid 72 and name HN ) ( resid 73 and name HN ) 2.70 0.90 0.00 !hnoe72
assign ( resid 72 and name HN ) ( resid 72 and name HD1 ) 5.00 3.20 0.00 !hnoe72
assign ( resid 72 and name HA ) ( resid 75 and name HN ) 5.00 3.20 0.00 !hnoe75
assign ( resid 72 and name HA )
((resid 75 and name HB1 ) or ( resid 75 and name HB2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 72 and name HA )
((resid 75 and name HG1 ) or ( resid 75 and name HG2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 72 and name HA )
((resid 75 and name HE21 ) or ( resid 75 and name HE22 )) 5.00 3.20 0.00 !nxfnoe75
assign ( resid 72 and name HE1 )
((resid 75 and name HE21 ) or ( resid 75 and name HE22 )) 5.00 3.20 0.00 !hnoe72
assign ( resid 72 and name HD1 )
((resid 75 and name HE21 ) or ( resid 75 and name HE22 )) 5.00 3.20 0.00 !nxfnoe75
assign ( resid 72 and name HE3 )
((resid 75 and name HE21 ) or ( resid 75 and name HE22 )) 5.00 3.20 0.00 !nxfnoe75
!LEU73
assign ( resid 73 and name HN ) ( resid 74 and name HN ) 2.70 0.90 0.00 !hnoe74
assign ( resid 73 and name HA ) ( resid 76 and name HN ) 3.50 1.70 0.00 !hnoe76
assign ( resid 73 and name HA ) ( resid 76 and name HB# ) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 73 and name HD1# ) ( resid 76 and name HB# ) 3.50 1.70 1.00 !ccnoe76
assign ( resid 73 and name HD1# ) ( resid 79 and name HG2# ) 3.50 1.70 1.00 !ch3,b,ccnoe,b
assign ( resid 73 and name HD1# ) ( resid 79 and name HG1# ) 5.00 3.20 1.00 !ch3,b,ccnoe,b
assign ( resid 73 and name HD2# ) ( resid 79 and name HG2# ) 5.00 3.20 1.00 !ch3,b,ccnoe,b
assign ( resid 73 and name HD1# ) ( resid 93 and name HA ) 6.00 4.20 0.50 !ccnoe73
assign ( resid 73 and name HD2# ) ( resid 93 and name HA ) 6.00 4.20 0.50 !ccnoe73
assign ( resid 73 and name HD2# ) ( resid 96 and name HN ) 5.00 3.20 0.50 !hnoe96
assign ( resid 73 and name HD2# )
((resid 96 and name HD1 ) or ( resid 96 and name HD2 )) 5.00 3.20 0.50 !ccnoe73
assign ( resid 73 and name HD2# ) ( resid 97 and name HN ) 3.50 1.70 0.50 !ch3noe73,hnoe97
assign ( resid 73 and name HD2# ) ( resid 97 and name HB# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 73 and name HD2# ) ( resid 97 and name HA ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 73 and name HD1# ) ( resid 97 and name HB# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 73 and name HD2# ) ( resid 98 and name HN ) 5.00 3.20 0.50 !hnoe98
assign ( resid 73 and name HG ) ( resid 100 and name HD1# ) 3.50 1.70 0.50 !cnoe73
assign ( resid 73 and name HD2# ) ( resid 100 and name HD1# ) 3.50 1.70 1.00 !ch3noech3
!GLN74
assign ( resid 74 and name HN ) ( resid 75 and name HN ) 2.70 0.90 0.00 !hnoe74,b
assign ( resid 74 and name HA ) ( resid 76 and name HN ) 3.50 1.70 0.00 !hnoe76
assign ( resid 74 and name HN ) ( resid 100 and name HD1# ) 3.50 1.70 0.50 !hnoe74
assign ( resid 74 and name HN ) ( resid 100 and name HD2# ) 5.00 3.20 0.50 !hnoe74
assign ( resid 74 and name HA ) ( resid 100 and name HD1# ) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 74 and name HA ) ( resid 100 and name HD2# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 74 and name HB1 ) or
( resid 74 and name HB2 )) ( resid 100 and name HD1# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 74 and name HG1 ) or
( resid 74 and name HG2 )) ( resid 100 and name HD1# ) 3.50 1.70 0.50 !ccnoe,b
assign ((resid 74 and name HB1 ) or
( resid 74 and name HB2 )) ( resid 100 and name HD2# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 74 and name HG1 ) or
( resid 74 and name HG2 )) ( resid 100 and name HD2# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 74 and name HE21 ) or
( resid 74 and name HE22 )) ( resid 100 and name HD2# ) 6.00 4.20 0.50 !ch3noech3
assign ((resid 74 and name HE21 ) or
( resid 74 and name HE22 )) ( resid 100 and name HD1# ) 3.50 1.70 0.50 !nxfnoe
!GLN75
assign ( resid 75 and name HN ) ( resid 76 and name HN ) 2.70 0.90 0.00 !nnoe76,b
!ALA76
assign ( resid 76 and name HA ) ( resid 77 and name HN ) 2.70 0.90 0.00 !hnoe77
assign ( resid 76 and name HA ) ( resid 78 and name HN ) 3.50 1.70 0.00 !hnoe78
assign ( resid 76 and name HB# ) ( resid 78 and name HN ) 3.50 1.70 0.50 !hnoe78
assign ( resid 76 and name HB# ) ( resid 79 and name HG2# ) 3.50 1.70 1.00 !ccnoe76,may
assign ( resid 76 and name HB# )
((resid 102 and name HE1 ) or ( resid 102 and name HE2 )) 6.00 4.20 0.50 !ccnoe102
!ASP77
assign ( resid 77 and name HA ) ( resid 78 and name HN ) 3.50 1.70 0.00 !hnoe78,on
assign ( resid 77 and name HA ) ( resid 78 and name HG2# ) 5.00 3.20 0.50 !ccnoe,b
!VAL78
assign ( resid 78 and name HA ) ( resid 79 and name HN ) 2.70 0.90 0.00 !hnoe79
assign ( resid 78 and name HA )
((resid 103 and name HG1 ) or ( resid 103 and name HG2 )) 6.00 4.20 0.00 !ccnoe,b
assign ( resid 78 and name HG1# ) ( resid 79 and name HN ) 2.70 0.90 0.50 !ch3noe,cnoe
assign ( resid 78 and name HG2# ) ( resid 79 and name HN ) 3.50 1.70 0.50 !ch3noe,x1=60?
assign ( resid 78 and name HG2# ) ( resid 78 and name HA ) 3.50 1.70 0.50 !ccnoe78ab
assign ( resid 78 and name HG2# )
((resid 103 and name HB1 ) or ( resid 103 and name HB2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 78 and name HG2# )
((resid 103 and name HG1 ) or ( resid 103 and name HG2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 78 and name HG1# )
((resid 103 and name HB1 ) or ( resid 103 and name HB2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 78 and name HG1# )
((resid 103 and name HG1 ) or ( resid 103 and name HG2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 78 and name HG2# )
((resid 146 and name HE1 ) or ( resid 146 and name HE2 )) 3.50 1.70 0.50 !cnoe78,ccnoe78
assign ( resid 78 and name HG1# )
((resid 146 and name HE1 ) or ( resid 146 and name HE2 )) 3.50 1.70 0.50 !cnoe78,can
assign ( resid 78 and name HG2# )
((resid 146 and name HD1 ) or ( resid 146 and name HD2 )) 6.00 4.20 0.50 !cnoe78
assign ( resid 78 and name HG1# )
((resid 146 and name HD1 ) or ( resid 146 and name HD2 )) 5.00 3.20 0.50 !cnoe78
assign ( resid 78 and name HG2# )
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 5.00 3.20 0.50 !cnoe78
assign ( resid 78 and name HG2# )
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 5.00 3.20 0.50 !cnoe78
assign ( resid 78 and name HG1# )
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 5.00 3.20 0.50 !cnoe78
assign ( resid 78 and name HG1# )
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 3.50 1.70 0.50 !cnoe78
assign ( resid 78 and name HG1# ) ( resid 147 and name HZ ) 3.50 1.70 0.50 !cnoe78
assign ( resid 78 and name HG2# )
((resid 150 and name HD1 ) or ( resid 150 and name HD2 )) 5.00 3.20 0.50 !cnoe78
assign ( resid 78 and name HG2# )
((resid 150 and name HE1 ) or ( resid 150 and name HE2 )) 3.50 1.70 0.50 !cnoe78
assign ( resid 78 and name HG1# ) ( resid 151 and name HD1# ) 6.00 4.20 1.00 !ccnoe,b
assign ( resid 78 and name HG1# ) ( resid 151 and name HD2# ) 6.00 4.20 1.00 !ccnoe,b
assign ( resid 78 and name HG2# ) ( resid 151 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b,cnoe151(ov,27)
assign ( resid 78 and name HG2# ) ( resid 151 and name HD2# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 78 and name HG2# )
((resid 154 and name HE1 ) or ( resid 154 and name HE2 )) 5.00 3.20 0.50 !ccnoe,b
!VAL79
assign ( resid 79 and name HN )
((resid 103 and name HG1 ) or ( resid 103 and name HG2 )) 6.00 4.20 0.00 !hnoe79
assign ( resid 79 and name HA ) ( resid 80 and name HN ) 2.70 0.90 0.00 !hnoe80
assign ( resid 79 and name HG2# ) ( resid 79 and name HN ) 2.70 0.90 0.50 !ch3noe,x1=180
assign ( resid 79 and name HG1# ) ( resid 80 and name HN ) 2.70 0.90 0.50 !cnoe79,ch3noe
assign ( resid 79 and name HG1# ) ( resid 94 and name HD2# ) 3.50 1.70 1.00 !ccnoe,b,ch3noe,b
assign ( resid 79 and name HG2# ) ( resid 94 and name HD2# ) 5.00 3.20 1.00 !ccnoe,b,ch3noe,b
assign ( resid 79 and name HG1# ) ( resid 104 and name HA ) 6.00 4.20 0.50 !ccnoe,b
assign ( resid 79 and name HG2# ) ( resid 104 and name HA ) 6.00 4.20 0.50 !ccnoe,b
assign ( resid 79 and name HG1# ) ( resid 104 and name HG2# ) 2.70 0.90 1.00 !ccnoe,b
assign ( resid 79 and name HG1# ) ( resid 104 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b,cnoe79
assign ( resid 79 and name HG2# ) ( resid 104 and name HG2# ) 5.00 3.20 1.00 !ccnoe,b,cnoe79
assign ( resid 79 and name HG1# ) ( resid 105 and name HN ) 5.00 3.20 0.50 !cnoe79
!VAL80
assign ( resid 80 and name HA ) ( resid 81 and name HN ) 2.70 0.90 0.00 !hnoe81
assign ( resid 80 and name HA ) ( resid 94 and name HD2# ) 5.00 3.20 0.50 !cnoe94
assign ( resid 80 and name HA ) ( resid 104 and name HG2# ) 6.00 4.20 0.50 !cnoe80
assign ( resid 80 and name HA ) ( resid 105 and name HN ) 3.50 1.70 0.00 !hnoe105
assign ( resid 80 and name HG1# ) ( resid 81 and name HN ) 2.70 0.90 0.50 !ch3noe80,x1=180
assign ( resid 80 and name HG2# ) ( resid 80 and name HN ) 3.50 1.70 0.50 !ch3noe80
assign ( resid 80 and name HG2# ) ( resid 105 and name HN ) 5.00 3.20 0.50 !ch3noe80,cnoe80
assign ( resid 80 and name HG1# ) ( resid 105 and name HN ) 6.00 4.20 0.50 !cnoe80
assign ( resid 80 and name HG1# ) ( resid 105 and name HD2# ) 2.70 0.90 1.00 !ch3,b,cnoe80
assign ( resid 80 and name HG1# ) ( resid 105 and name HD1# ) 5.00 3.20 1.00 !ch3,b,cnoe80
assign ( resid 80 and name HG2# ) ( resid 105 and name HD2# ) 3.50 1.70 1.00 !ch3,b,cnoe80
assign ( resid 80 and name HG1# ) ( resid 107 and name HD1# ) 3.50 1.70 1.00 !ch3noe80mg2
assign ( resid 80 and name HG1# ) ( resid 107 and name HD2# ) 5.00 3.20 1.00 !ch3noe80mg2
assign ( resid 80 and name HG1# ) ( resid 143 and name HD2# ) 5.00 3.20 1.00 !ccnoe143
assign ( resid 80 and name HG2# ) ( resid 143 and name HD1# ) 5.00 3.20 1.00 !ccnoe143
assign ( resid 80 and name HG2# )
((resid 146 and name HE1 ) or ( resid 146 and name HE2 )) 5.00 3.20 0.50 !cnoe80
assign ( resid 80 and name HG2# )
((resid 146 and name HD1 ) or ( resid 146 and name HD2 )) 6.00 4.20 0.50 !cnoe80
assign ( resid 80 and name HG1# ) ( resid 147 and name HZ ) 5.00 3.20 0.50 !cnoe80
assign ( resid 80 and name HG1# )
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 5.00 3.20 0.50 !cnoe80
assign ( resid 80 and name HG2# ) ( resid 147 and name HZ ) 3.50 1.70 0.50 !cnoe80
assign ( resid 80 and name HG2# )
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 3.50 1.70 0.50 !cnoe80
!ALA81
assign ( resid 81 and name HN ) ( resid 105 and name HN ) 5.00 3.20 0.00 !hnoe81,b
assign ( resid 81 and name HN ) ( resid 105 and name HD2# ) 5.00 3.20 0.50 !hnoe81
assign ( resid 81 and name HN ) ( resid 106 and name HA ) 3.50 1.70 0.00 !hnoe81
assign ( resid 81 and name HB# ) ( resid 83 and name HG1# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 81 and name HB# ) ( resid 83 and name HG2# ) 6.00 4.20 1.00 !ccnoe,b
assign ( resid 81 and name HB# ) ( resid 90 and name HG1# ) 5.00 3.20 1.00 !ccnoe90
assign ( resid 81 and name HB# ) ( resid 94 and name HD1# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 81 and name HB# ) ( resid 94 and name HD2# ) 3.50 1.70 1.00 !ccnoe,b,cnoe81
assign ( resid 81 and name HB# ) ( resid 106 and name HA ) 5.00 3.20 0.50 !cnoe81
!GLU82
assign ( resid 82 and name HA ) ( resid 107 and name HN ) 3.50 1.70 0.00 !hnoe107
assign ( resid 82 and name HA ) ( resid 83 and name HN ) 2.70 0.90 0.00 !hnoe83
!VAL83
assign ( resid 83 and name HN ) ( resid 83 and name HG2# ) 2.70 0.90 0.50 !ch3noe,x1=-60
assign ( resid 83 and name HA ) ( resid 83 and name HG1# ) 2.70 0.90 0.50 !ccnoe83ca
assign ( resid 83 and name HN ) ( resid 107 and name HN ) 5.00 3.20 0.00 !hnoe83,b
assign ( resid 83 and name HA ) ( resid 90 and name HG1# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 83 and name HG1# ) ( resid 90 and name HG1# ) 5.00 3.20 1.00 !ccnoe83
assign ( resid 83 and name HG1# ) ( resid 94 and name HD1# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 83 and name HG1# )
((resid 106 and name HB1 ) or ( resid 106 and name HB2 )) 5.00 3.20 0.50 !ccnoe83,cnoe83
assign ( resid 83 and name HG1# ) ( resid 107 and name HN ) 5.00 3.20 0.50 !ch3noech3
assign ( resid 83 and name HG2# ) ( resid 108 and name HN ) 5.00 3.20 0.50 !ch3noech3
assign ( resid 83 and name HG2# ) ( resid 108 and name HA ) 5.00 3.20 0.50 !ccnoe,b,cnoe83
assign ( resid 83 and name HG2# )
((resid 108 and name HD1 ) or ( resid 108 and name HD2 )) 5.00 3.20 0.50 !cnoe83
assign ( resid 83 and name HG1# ) ( resid 116 and name HD2# ) 5.00 3.20 1.00 !ch3,cnoe83
assign ( resid 83 and name HG1# ) ( resid 116 and name HD1# ) 5.00 3.20 1.00 !ch3noech3
assign ( resid 83 and name HG2# ) ( resid 116 and name HD2# ) 3.50 1.70 1.00 !ch3noech3
assign ( resid 83 and name HG2# ) ( resid 116 and name HD1# ) 2.70 0.90 1.00 !ch3noech3
assign ( resid 83 and name HG1# ) ( resid 120 and name HG2# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 83 and name HG1# ) ( resid 120 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 83 and name HG1# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 6.00 4.20 0.50 !cnoe83
assign ( resid 83 and name HG1# ) ( resid 129 and name HZ ) 6.00 4.20 0.50 !cnoe83
assign ( resid 83 and name HG1# ) ( resid 131 and name HG1# ) 5.00 3.20 1.00 !ccnoe131
!THR84
assign ( resid 84 and name HN )
((resid 108 and name HD1 ) or ( resid 108 and name HD2 )) 5.00 3.20 0.00 !hnoe84
assign ( resid 84 and name HN ) ( resid 109 and name HN ) 5.00 3.20 0.00 !hnoe84,b
assign ( resid 84 and name HN ) ( resid 116 and name HD1# ) 5.00 3.20 0.50 !hnoe84
assign ( resid 84 and name HA ) ( resid 85 and name HN ) 5.00 3.20 0.00 !hnoe85,b
assign ( resid 84 and name HA )
((resid 108 and name HD1 ) or ( resid 108 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ( resid 84 and name HA )
((resid 108 and name HE1 ) or ( resid 108 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ( resid 84 and name HA )
((resid 112 and name HB1 ) or ( resid 112 and name HB2 )) 5.00 3.20 0.00 !cnoe84a
assign ( resid 84 and name HG2# )
((resid 108 and name HB1 ) or ( resid 108 and name HB2 )) 5.00 3.20 0.50 !cnoe84
assign ( resid 84 and name HG2# )
((resid 108 and name HD1 ) or ( resid 108 and name HD2 )) 5.00 3.20 0.50 !cnoe84mg2
assign ( resid 84 and name HG2# )
((resid 108 and name HE1 ) or ( resid 108 and name HE2 )) 6.00 4.20 0.50 !cnoe84mg2
assign ( resid 84 and name HG2# ) ( resid 109 and name HN ) 3.50 1.70 0.50 !cnoe,b
assign ( resid 84 and name HG2# )
((resid 109 and name HB1 ) or ( resid 109 and name HB2 )) 3.50 1.70 0.50 !ccnoe84
assign ( resid 84 and name HG2# )
((resid 111 and name HG1 ) or ( resid 111 and name HG2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 84 and name HG2# ) ( resid 112 and name HA ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 84 and name HG2# )
((resid 112 and name HB1 ) or ( resid 112 and name HB2 )) 3.50 1.70 0.50 !ccnoe112,b
assign ( resid 84 and name HG2# ) ( resid 114 and name HN ) 5.00 3.20 0.50 !hnoe114
assign ( resid 84 and name HG2# )
((resid 114 and name HG1 ) or ( resid 114 and name HG2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 84 and name HG2# )
((resid 114 and name HD1 ) or ( resid 114 and name HD2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 84 and name HG2# ) ( resid 116 and name HD1# ) 5.00 3.20 1.00 !cnoe84
assign ( resid 84 and name HG2# )
((resid 134 and name HD1 ) or ( resid 134 and name HD2 )) 5.00 3.20 0.50 !cnoe84
assign ( resid 84 and name HG2# )
((resid 134 and name HE1 ) or ( resid 134 and name HE2 )) 6.00 4.20 0.50 !cnoe84
!GLN85
assign ( resid 85 and name HA )
((resid 86 and name HD1 ) or ( resid 86 and name HD2 )) 5.00 3.20 0.00 !ccnoe85
assign ( resid 85 and name HA )
((resid 114 and name HD1 ) or ( resid 114 and name HD2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 85 and name HG1 ) or ( resid 85 and name HG2 ))
((resid 86 and name HD1 ) or ( resid 86 and name HD2 )) 3.50 1.70 0.00 !ccnoe85
assign ((resid 85 and name HB1 ) or ( resid 85 and name HB2 ))
((resid 87 and name HB1 ) or ( resid 87 and name HB2 )) 6.00 4.20 0.00 !ccnoe,b
assign ((resid 85 and name HG1 ) or ( resid 85 and name HG2 ))
((resid 87 and name HB1 ) or ( resid 87 and name HB2 )) 5.00 3.20 0.00 !ccnoe87
assign ((resid 85 and name HG1 ) or ( resid 85 and name HG2 ))
((resid 114 and name HD1 ) or ( resid 114 and name HD2 )) 5.00 3.20 0.00 !ccnoe,b
!PRO86
assign ((resid 86 and name HD1 ) or ( resid 86 and name HD2 ))
((resid 114 and name HD1 ) or ( resid 114 and name HD2 )) 3.50 1.70 0.00 !ccnoe114
!SER87
assign ( resid 87 and name HN ) ( resid 90 and name HG1# ) 5.00 3.20 0.50 !hnoe87
assign ( resid 87 and name HA ) ( resid 88 and name HN ) 3.50 1.70 0.00 !hnoe88
assign ( resid 87 and name HN ) ( resid 91 and name HN ) 6.00 4.20 0.00 !hnoe91,b
assign ( resid 87 and name HA ) ( resid 91 and name HN ) 5.00 3.20 0.00 !hnoe91
assign ( resid 87 and name HA ) ( resid 90 and name HB ) 5.00 3.20 0.00 !cnoe87a
assign ( resid 87 and name HA ) ( resid 90 and name HG2# ) 3.50 1.70 0.50 !ccnoe,b
assign ((resid 87 and name HB1 ) or
( resid 87 and name HB2 )) ( resid 90 and name HG2# ) 5.00 3.20 0.50 !ccnoe,b
!LEU88
assign ( resid 88 and name HA ) ( resid 91 and name HN ) 3.50 1.70 0.00 !hnoe91
!GLY89
assign ( resid 89 and name HN ) ( resid 90 and name HN ) 2.70 0.90 0.00 !hnoe90
!VAL90
assign ( resid 90 and name HN ) ( resid 91 and name HN ) 2.70 0.90 0.00 !hnoe90,b
assign ( resid 90 and name HB ) ( resid 91 and name HN ) 3.50 1.70 0.00 !hnoe91
assign ( resid 90 and name HG2# ) ( resid 90 and name HN ) 2.70 0.90 0.50 !ch3noe90,x1=180?
assign ( resid 90 and name HG1# ) ( resid 91 and name HN ) 3.50 1.70 0.50 !hnoe91
assign ( resid 90 and name HG1# ) ( resid 94 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b,ch3noe90
assign ( resid 90 and name HG1# ) ( resid 120 and name HD1# ) 5.00 3.20 1.00 !ccnoe90,ch3noe
!GLY91
assign ( resid 91 and name HN ) ( resid 92 and name HN ) 2.70 0.90 0.00 !hnoe91,b
assign ( resid 91 and name HN ) ( resid 120 and name HD1# ) 5.00 3.20 0.50 !hnoe91
assign ((resid 91 and name HA1 ) or
( resid 91 and name HA2 )) ( resid 94 and name HN ) 3.50 1.70 0.00 !hnoe94
assign ((resid 91 and name HA1 ) or
( resid 91 and name HA2 )) ( resid 94 and name HD1# ) 5.00 3.20 0.50 !ccnoe94
assign ((resid 91 and name HA1 ) or
( resid 91 and name HA2 )) ( resid 120 and name HD1# ) 6.00 4.20 0.50 !ccnoe120
!TYR92
assign ( resid 92 and name HN ) ( resid 93 and name HN ) 2.70 0.90 0.00 !hnoe92
assign ( resid 92 and name HN ) ( resid 120 and name HD1# ) 5.00 3.20 0.50 !ch3noe,n15noe
assign ( resid 92 and name HA ) ( resid 95 and name HN ) 3.50 1.70 0.00 !hnoe95
!GLU93
assign ( resid 93 and name HA ) ( resid 96 and name HN ) 5.00 3.20 0.00 !hnoe96,93ha
!LEU94
assign ( resid 94 and name HN ) ( resid 95 and name HN ) 2.70 0.90 0.00 !hnoe94,b
assign ( resid 94 and name HA ) ( resid 97 and name HB# ) 5.00 3.20 0.50 !cnoe94,ccnoe97
assign ( resid 94 and name HD2# ) ( resid 94 and name HA ) 3.50 1.70 0.50 !ccnoe94
assign ( resid 94 and name HD2# ) ( resid 97 and name HN ) 5.00 3.20 0.50 !cnoe94
assign ( resid 94 and name HD2# ) ( resid 98 and name HG2# ) 6.00 4.20 1.00 !ch3noe,b
assign ( resid 94 and name HD2# ) ( resid 104 and name HD1# ) 3.50 1.70 1.00 !ch3,ccnoe,b
assign ( resid 94 and name HD2# ) ( resid 104 and name HG2# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 94 and name HD1# ) ( resid 104 and name HD1# ) 6.00 4.20 1.00 !ccnoe,b
assign ( resid 94 and name HD1# ) ( resid 104 and name HG2# ) 6.00 4.20 1.00 !ccnoe,b
assign ( resid 94 and name HD1# ) ( resid 106 and name HG ) 5.00 3.20 0.50 !ch3noe,xf
assign ( resid 94 and name HD2# ) ( resid 106 and name HG ) 3.50 1.70 0.50 !ch3noe,xf
assign ( resid 94 and name HD1# ) ( resid 120 and name HD1# ) 3.50 1.70 1.00 !ch3,ccnoe,b
assign ( resid 94 and name HD1# ) ( resid 120 and name HG2# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 94 and name HD1# )
((resid 120 and name HG11 ) or ( resid 120 and name HG12 )) 5.00 3.20 0.50 !ccnoe94,cnoe94
assign ( resid 94 and name HD1# ) ( resid 129 and name HZ ) 3.50 1.70 0.50 !cnoe94
assign ( resid 94 and name HD1# )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 5.00 3.20 0.50 !cnoe94
assign ( resid 94 and name HD1# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 5.00 3.20 0.50 !cnoe94
assign ( resid 94 and name HD2# ) ( resid 129 and name HZ ) 5.00 3.20 0.50 !cnoe94
assign ( resid 94 and name HD2# )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 3.50 1.70 0.50 !cnoe94
assign ( resid 94 and name HD2# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 5.00 3.20 0.50 !cnoe94
!GLY95
assign ( resid 95 and name HN ) ( resid 96 and name HN ) 2.70 0.90 0.00 !hnoe95,b
assign ((resid 95 and name HA1 ) or
( resid 95 and name HA2 )) ( resid 98 and name HN ) 5.00 3.20 0.00 !hnoe98
assign ((resid 95 and name HA1 ) or
( resid 95 and name HA2 )) ( resid 98 and name HB ) 6.00 4.20 0.00 !ccnoe98
!ARG96
assign ( resid 96 and name HN ) ( resid 97 and name HN ) 2.70 0.90 0.00 !hnoe96,b
assign ( resid 96 and name HA ) ( resid 99 and name HN ) 3.50 1.70 0.00 !hnoe99
assign ( resid 96 and name HA ) ( resid 99 and name HB# ) 5.00 3.20 0.50 !ccnoe96
!ALA97
assign ( resid 97 and name HN ) ( resid 98 and name HN ) 2.70 0.90 0.00 !hnoe97,b
assign ( resid 97 and name HN ) ( resid 104 and name HD1# ) 5.00 3.20 0.50 !ch3noech3,n15noe
assign ( resid 97 and name HA ) ( resid 100 and name HN ) 3.50 1.70 0.00 !hnoe100
assign ( resid 97 and name HA )
((resid 100 and name HB1 ) or ( resid 100 and name HB2 )) 5.00 3.20 0.00 !cnoe97
assign ( resid 97 and name HA ) ( resid 100 and name HD1# ) 5.00 3.20 0.50 !ccnoe97
assign ( resid 97 and name HA ) ( resid 100 and name HD2# ) 6.00 4.20 0.50 !ccnoe97
assign ( resid 97 and name HA ) ( resid 101 and name HN ) 3.50 1.70 0.00 !hnoe101
assign ( resid 97 and name HA ) ( resid 102 and name HN ) 5.00 3.20 0.00 !hnoe102
assign ( resid 97 and name HB# ) ( resid 98 and name HG2# ) 5.00 3.20 1.00 !ccnoe98
assign ( resid 97 and name HB# ) ( resid 100 and name HD2# ) 5.00 3.20 1.00 !ccnoe100
assign ( resid 97 and name HB# ) ( resid 100 and name HD1# ) 3.50 1.70 1.00 !ccnoe100
assign ( resid 97 and name HB# ) ( resid 101 and name HN ) 5.00 3.20 0.50 !hnoe101
assign ( resid 97 and name HB# )
((resid 101 and name HA1 ) or ( resid 101 and name HA2 )) 5.00 3.20 0.50 !ccnoe97
assign ( resid 97 and name HB# ) ( resid 102 and name HN ) 3.50 1.70 0.50 !hnoe102,canberlx
assign ( resid 97 and name HB# ) ( resid 104 and name HD1# ) 5.00 3.20 1.00 !cnoe97
assign ( resid 97 and name HB# ) ( resid 106 and name HG ) 5.00 3.20 0.50 !xf97
!VAL98
assign ( resid 98 and name HN ) ( resid 98 and name HG2# ) 2.70 0.90 0.50 !ch3noe,x1=180
assign ( resid 98 and name HN ) ( resid 99 and name HN ) 2.70 0.90 0.00 !hnoe98,b
assign ( resid 98 and name HN ) ( resid 104 and name HD1# ) 3.50 1.70 0.50 !ch3noech3,n15noe
assign ( resid 98 and name HA ) ( resid 98 and name HG1# ) 3.50 1.70 0.50 !ccnoe
assign ( resid 98 and name HA ) ( resid 98 and name HG2# ) 3.50 1.70 0.50 !ccnoe,x1=180
assign ( resid 98 and name HA ) ( resid 99 and name HN ) 5.00 3.20 0.00 !hnoe99
assign ( resid 98 and name HA ) ( resid 104 and name HD1# ) 3.50 1.70 0.50 !cnoe98,b
assign ( resid 98 and name HG2# ) ( resid 104 and name HD1# ) 2.70 0.90 1.00 !ch3,ccnoe,b
assign ( resid 98 and name HG1# ) ( resid 104 and name HD1# ) 5.00 3.20 1.00 !ch3,ccnoe,b
assign ( resid 98 and name HG2# ) ( resid 104 and name HG2# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 98 and name HG2# ) ( resid 106 and name HG ) 5.00 3.20 0.50 !xf98
assign ( resid 98 and name HG2# ) ( resid 120 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 98 and name HG2# ) ( resid 123 and name HB# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 98 and name HG1# ) ( resid 123 and name HB# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 98 and name HG2# ) ( resid 124 and name HA ) 6.00 4.20 0.50 !ccnoe98,b
assign ( resid 98 and name HG2# )
((resid 129 and name HB1 ) or ( resid 129 and name HB2 )) 3.50 1.70 0.50 !ccnoe98
assign ( resid 98 and name HG2# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 2.70 0.90 0.50 !cnoe98
assign ( resid 98 and name HG2# ) ( resid 129 and name HZ ) 5.00 3.20 0.50 !cnoe98
assign ( resid 98 and name HG1# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 5.00 3.20 0.50 !cnoe98
!ALA99
assign ( resid 99 and name HN ) ( resid 100 and name HN ) 2.70 0.90 0.00 !nnoe99,b
assign ( resid 99 and name HA ) ( resid 100 and name HN ) 3.50 1.70 0.00 !hnoe100
!LEU100
assign ( resid 100 and name HN ) ( resid 101 and name HN ) 2.70 0.90 0.00 !hnoe100,b
assign ( resid 100 and name HA ) ( resid 102 and name HN ) 6.00 4.20 0.00 !hnoe
assign ( resid 100 and name HA ) ( resid 100 and name HD2# ) 3.50 1.70 0.50 !ccnoe,012508
assign ( resid 100 and name HD1# )
((resid 102 and name HE1 ) or ( resid 102 and name HE2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 100 and name HD2# )
((resid 102 and name HE1 ) or ( resid 102 and name HE2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 100 and name HD1# )
((resid 102 and name HD1 ) or ( resid 102 and name HD2 )) 5.00 3.20 0.50 !ccnoe100
assign ( resid 100 and name HD2# )
((resid 102 and name HD1 ) or ( resid 102 and name HD2 )) 5.00 3.20 0.50 !ccnoe100
!GLY101
assign ( resid 101 and name HN ) ( resid 102 and name HN ) 5.00 3.20 0.00 !hnoe101,b
assign ((resid 101 and name HA1 ) or
( resid 101 and name HA2 )) ( resid 102 and name HN ) 3.50 1.70 0.00 !hnoe101
!LYS102
assign ( resid 102 and name HN ) ( resid 104 and name HD1# ) 5.00 3.20 0.50 !hnoe
!PRO103
assign ( resid 103 and name HA ) ( resid 104 and name HN ) 2.70 0.90 0.00 !hnoe104
assign ( resid 103 and name HA ) ( resid 128 and name HA ) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 103 and name HA )
((resid 128 and name HB1 ) or ( resid 128 and name HB2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 103 and name HA )
((resid 128 and name HG1 ) or ( resid 128 and name HG2 )) 3.50 1.70 0.00 !ccnoe,b
assign ( resid 103 and name HA )
((resid 128 and name HD1 ) or ( resid 128 and name HD2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 103 and name HB1 ) or ( resid 103 and name HB2 ))
((resid 128 and name HD1 ) or ( resid 128 and name HD2 )) 5.00 3.20 0.00 !ccnoe103
assign ((resid 103 and name HG1 ) or ( resid 103 and name HG2 ))
((resid 128 and name HD1 ) or ( resid 128 and name HD2 )) 5.00 3.20 0.00 !ccnoe103
!ILE104
assign ( resid 104 and name HA ) ( resid 105 and name HN ) 2.70 0.90 0.00 !hnoe105
assign ( resid 104 and name HN ) ( resid 128 and name HA ) 5.00 3.20 0.00 !hnoe104
assign ( resid 104 and name HN )
((resid 128 and name HG1 ) or ( resid 128 and name HG2 )) 5.00 3.20 0.00 !hnoe104
assign ( resid 104 and name HN ) ( resid 129 and name HA ) 3.50 1.70 0.00 !hnoe104
assign ( resid 104 and name HN )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 5.00 3.20 0.00 !hnoe104
assign ( resid 104 and name HN ) ( resid 130 and name HN ) 6.00 4.20 0.00 !hnoe130
assign ( resid 104 and name HB ) ( resid 130 and name HN ) 5.00 3.20 0.00 !hnoe130
assign ( resid 104 and name HG2# ) ( resid 106 and name HG ) 3.50 1.70 0.50 !ulfilter
assign ( resid 104 and name HG2# ) ( resid 129 and name HA ) 5.00 3.20 0.50 !ccnoe,b,cnoe104
assign ( resid 104 and name HG2# )
((resid 129 and name HB1 ) or ( resid 129 and name HB2 )) 5.00 3.20 0.50 !ccnoe129
assign ( resid 104 and name HD1# )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 3.50 1.70 0.50 !cnoe104
assign ( resid 104 and name HD1# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 3.50 1.70 0.50 !cnoe104
assign ( resid 104 and name HD1# ) ( resid 129 and name HZ ) 5.00 3.20 0.50 !cnoe104
assign ( resid 104 and name HG2# )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 3.50 1.70 0.50 !cnoe104,2dd2o
assign ( resid 104 and name HG2# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 3.50 1.70 0.50 !cnoe104,2dd2o
assign ( resid 104 and name HG2# ) ( resid 129 and name HZ ) 5.00 3.20 0.50 !cnoe104,2dd2o
assign ( resid 104 and name HG2# ) ( resid 130 and name HN ) 5.00 3.20 0.50 !hnoe130
assign ( resid 104 and name HG2# ) ( resid 131 and name HG2# ) 5.00 3.20 1.00 !cnoe131
!LEU105
assign ( resid 105 and name HA ) ( resid 106 and name HN ) 2.70 0.90 0.00 !hnoe106
assign ( resid 105 and name HA ) ( resid 130 and name HN ) 3.50 1.70 0.00 !hnoe130
assign ( resid 105 and name HA ) ( resid 132 and name HE1 ) 5.00 3.20 0.00 !hnoe132he1
assign ( resid 105 and name HG ) ( resid 106 and name HN ) 3.50 1.70 0.00 !hnoe106
assign ( resid 105 and name HD1# ) ( resid 105 and name HA ) 3.50 1.70 0.50 !ccnoe105
assign ( resid 105 and name HD1# ) ( resid 106 and name HN ) 3.50 1.70 0.50 !hnoe106,ch3noe
assign ( resid 105 and name HD2# ) ( resid 107 and name HD1# ) 5.00 3.20 1.00 !ch3noe,b
assign ( resid 105 and name HD2# ) ( resid 107 and name HD2# ) 3.50 1.70 1.00 !ch3noe,b
assign ( resid 105 and name HD1# ) ( resid 107 and name HD2# ) 3.50 1.70 1.00 !ch3noe,b
assign ( resid 105 and name HD1# ) ( resid 130 and name HN ) 5.00 3.20 0.50 !hnoe130
assign ( resid 105 and name HD1# )
((resid 130 and name HB1 ) or ( resid 130 and name HB2 )) 5.00 3.20 0.50 !ccnoe105
assign ( resid 105 and name HD1# )
((resid 130 and name HG1 ) or ( resid 130 and name HG2 )) 5.00 3.20 0.50 !ccnoe105
assign ( resid 105 and name HD1# ) ( resid 132 and name HN ) 5.00 3.20 0.50 !hnoe132
assign ( resid 105 and name HD2# ) ( resid 132 and name HN ) 6.00 4.20 0.50 !ch3noech3,n15noe
assign ( resid 105 and name HD1# )
((resid 132 and name HB1 ) or ( resid 132 and name HB2 )) 5.00 3.20 0.50 !cnoe105,ccnoe105
assign ( resid 105 and name HD2# ) ( resid 132 and name HE1 ) 5.00 3.20 0.50 !hnoe132,ch3noe105
assign ( resid 105 and name HD1# ) ( resid 132 and name HE1 ) 3.50 1.70 0.50 !ch3noech3,n15noe
assign ( resid 105 and name HD1# ) ( resid 132 and name HD1 ) 3.50 1.70 0.50 !cnoe105
assign ( resid 105 and name HD1# ) ( resid 132 and name HE3 ) 3.50 1.70 0.50 !2dnoe-f
assign ( resid 105 and name HD1# ) ( resid 132 and name HZ2 ) 5.00 3.20 0.50 !2dd2o
assign ( resid 105 and name HD1# ) ( resid 132 and name HZ3 ) 6.00 4.20 0.50 !2dnoe-f
assign ( resid 105 and name HD2# ) ( resid 132 and name HZ3 ) 5.00 3.20 0.50 !2dnoe-f
assign ( resid 105 and name HD1# ) ( resid 132 and name HH2 ) 5.00 3.20 0.50 !2dd2o
assign ( resid 105 and name HD2# ) ( resid 132 and name HH2 ) 5.00 3.20 0.50 !2dd2o
assign ( resid 105 and name HD2# ) ( resid 142 and name HE# ) 6.00 4.20 1.00 !cnoe142,ccnoe105
assign ( resid 105 and name HD1# ) ( resid 142 and name HE# ) 5.00 3.20 1.00 !cnoe142,ccnoe105
assign ( resid 105 and name HD2# ) ( resid 143 and name HD2# ) 3.50 1.70 1.00 !c13noech3
assign ( resid 105 and name HD1# ) ( resid 143 and name HD2# ) 5.00 3.20 1.00 !c13noech3
assign ( resid 105 and name HD2# ) ( resid 143 and name HA ) 6.00 4.20 0.50 !ccnoe105
assign ( resid 105 and name HD2# ) ( resid 146 and name HN ) 5.00 3.20 0.50 !hnoe146
assign ( resid 105 and name HD2# )
((resid 146 and name HB1 ) or ( resid 146 and name HB2 )) 5.00 3.20 0.50 !ccnoe105
assign ( resid 105 and name HD2# )
((resid 146 and name HD1 ) or ( resid 146 and name HD2 )) 3.50 1.70 0.50 !2dnoe-f
assign ( resid 105 and name HD1# )
((resid 146 and name HD1 ) or ( resid 146 and name HD2 )) 5.00 3.20 0.50 !2dnoe-f
assign ( resid 105 and name HD2# )
((resid 146 and name HE1 ) or ( resid 146 and name HE2 )) 3.50 1.70 0.50 !2dnoe-f
assign ( resid 105 and name HD1# )
((resid 146 and name HE1 ) or ( resid 146 and name HE2 )) 2.70 0.90 0.50 !cnoe,2dnoe-f
!CYS106
assign ( resid 106 and name HA ) ( resid 107 and name HN ) 2.70 0.90 0.00 !hnoe107
assign ( resid 106 and name HN )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 6.00 4.20 0.00 !hnoe106
assign ( resid 106 and name HN ) ( resid 129 and name HZ ) 6.00 4.20 0.00 !hnoe106
assign ( resid 106 and name HN ) ( resid 131 and name HA ) 3.50 1.70 0.00 !hnoe106
assign ( resid 106 and name HN ) ( resid 132 and name HN ) 5.00 3.20 0.00 !hnoe106,b
assign ( resid 106 and name HG ) ( resid 106 and name HN ) 3.50 1.70 0.00 !ulfilter
assign ( resid 106 and name HG )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 3.50 1.70 0.00 !ulfilter
assign ( resid 106 and name HG ) ( resid 129 and name HZ ) 5.00 3.20 0.00 !ulfilter
assign ( resid 106 and name HG )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 5.00 3.20 0.00 !ulfilter
assign ( resid 106 and name HG ) ( resid 131 and name HG1# ) 5.00 3.20 0.50 !ch3noe131,xf
assign ( resid 106 and name HG ) ( resid 131 and name HG2# ) 5.00 3.20 0.50 !ch3noe131,xf
!LEU107
assign ( resid 107 and name HA ) ( resid 108 and name HN ) 2.70 0.90 0.00 !hnoe108
assign ( resid 107 and name HA ) ( resid 132 and name HN ) 6.00 4.20 0.00 !hnoe132
assign ( resid 107 and name HA )
((resid 134 and name HD1 ) or ( resid 134 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ( resid 107 and name HA )
((resid 134 and name HE1 ) or ( resid 134 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ( resid 107 and name HD2# ) ( resid 107 and name HA ) 3.50 1.70 0.50 !ccnoe107md
assign ( resid 107 and name HD2# ) ( resid 132 and name HN ) 5.00 3.20 0.50 !ch3noe107
assign ( resid 107 and name HD2# )
((resid 132 and name HB1 ) or ( resid 132 and name HB2 )) 5.00 3.20 0.50 !ccnoe107
assign ( resid 107 and name HD2# ) ( resid 132 and name HE3 ) 3.50 1.70 0.50 !cnoe107,2dd2o
assign ( resid 107 and name HD2# ) ( resid 132 and name HD1 ) 5.00 3.20 0.50 !2dd2o
assign ( resid 107 and name HD2# ) ( resid 133 and name HN ) 5.00 3.20 0.50 !hnoe133
assign ( resid 107 and name HD2# ) ( resid 134 and name HA ) 5.00 3.20 0.50 !cnoe107,ccnoe107
assign ( resid 107 and name HD1# )
((resid 134 and name HD1 ) or ( resid 134 and name HD2 )) 5.00 3.20 0.50 !cnoe107,2dd2o
assign ( resid 107 and name HD1# )
((resid 134 and name HE1 ) or ( resid 134 and name HE2 )) 5.00 3.20 0.50 !cnoe107,2dd2o
assign ( resid 107 and name HD2# )
((resid 134 and name HD1 ) or ( resid 134 and name HD2 )) 3.50 1.70 0.50 !cnoe107,2dd2o
assign ( resid 107 and name HD2# )
((resid 134 and name HE1 ) or ( resid 134 and name HE2 )) 3.50 1.70 0.50 !cnoe107,2dd2o
assign ( resid 107 and name HD1# ) ( resid 139 and name HA ) 6.00 4.20 0.50 !ccnoe107
assign ( resid 107 and name HD1# ) ( resid 139 and name HG2# ) 3.50 1.70 1.00 !ch3noe139
assign ( resid 107 and name HD2# )
((resid 142 and name HB1 ) or ( resid 142 and name HB2 )) 5.00 3.20 0.50 !ccnoe107
assign ( resid 107 and name HD1# ) ( resid 142 and name HE# ) 5.00 3.20 1.00 !cnoe142
assign ( resid 107 and name HD2# ) ( resid 142 and name HE# ) 2.70 0.90 1.00 !cnoe142,ccnoe107
assign ( resid 107 and name HD1# ) ( resid 143 and name HN ) 5.00 3.20 0.50 !hnoe143
assign ( resid 107 and name HD1# ) ( resid 143 and name HD2# ) 3.50 1.70 1.00 !c13noe143
assign ( resid 107 and name HD1# ) ( resid 143 and name HD1# ) 5.00 3.20 1.00 !c13noe143
assign ( resid 107 and name HD2# ) ( resid 143 and name HD2# ) 5.00 3.20 1.00 !c13noech3
!PHE108
assign ( resid 108 and name HN ) ( resid 116 and name HD2# ) 6.00 4.20 0.50 !hnoe108
assign ( resid 108 and name HN ) ( resid 132 and name HN ) 5.00 3.20 0.00 !hnoe108,b
assign ( resid 108 and name HN ) ( resid 133 and name HA ) 5.00 3.20 0.00 !hnoe108
assign ( resid 108 and name HN )
((resid 134 and name HD1 ) or ( resid 134 and name HD2 )) 2.70 0.90 0.00 !hnoe108
assign ( resid 108 and name HN )
((resid 134 and name HE1 ) or ( resid 134 and name HE2 )) 3.50 1.70 0.00 !hnoe108
assign ( resid 108 and name HA ) ( resid 109 and name HN ) 2.70 0.90 0.00 !hnoe109
assign ( resid 108 and name HA )
((resid 134 and name HE1 ) or ( resid 134 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ( resid 108 and name HA )
((resid 134 and name HD1 ) or ( resid 134 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 109 and name HN ) 3.50 1.70 0.00 !hnoe109
assign ((resid 108 and name HD1 ) or ( resid 108 and name HD2 ))
((resid 113 and name HA1 ) or ( resid 113 and name HA2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 108 and name HE1 ) or ( resid 108 and name HE2 ))
((resid 113 and name HA1 ) or ( resid 113 and name HA2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 114 and name HN ) 3.50 1.70 0.00 !hnoe114
assign ((resid 108 and name HE1 ) or
( resid 108 and name HE2 )) ( resid 114 and name HN ) 5.00 3.20 0.00 !hnoe114
assign ((resid 108 and name HD1 ) or ( resid 108 and name HD2 ))
((resid 114 and name HD1 ) or ( resid 114 and name HD2 )) 5.00 3.20 0.00 !cnoe114
assign ((resid 108 and name HE1 ) or ( resid 108 and name HE2 ))
((resid 114 and name HD1 ) or ( resid 114 and name HD2 )) 5.00 3.20 0.00 !cnoe114
assign ((resid 108 and name HE1 ) or ( resid 108 and name HE2 ))
((resid 114 and name HG1 ) or ( resid 114 and name HG2 )) 5.00 3.20 0.00 !cnoe114
assign ((resid 108 and name HD1 ) or ( resid 108 and name HD2 ))
((resid 114 and name HG1 ) or ( resid 114 and name HG2 )) 5.00 3.20 0.00 !cnoe114
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 115 and name HN ) 5.00 3.20 0.00 !hnoe115
assign ((resid 108 and name HE1 ) or
( resid 108 and name HE2 )) ( resid 115 and name HN ) 5.00 3.20 0.00 !hnoe115
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 115 and name HA ) 5.00 3.20 0.00 !cnoe115
assign ((resid 108 and name HE1 ) or
( resid 108 and name HE2 )) ( resid 115 and name HA ) 5.00 3.20 0.00 !cnoe115
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 115 and name HG1# ) 5.00 3.20 0.50 !cnoe115
assign ((resid 108 and name HE1 ) or
( resid 108 and name HE2 )) ( resid 115 and name HG1# ) 5.00 3.20 0.50 !cnoe115
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 115 and name HG2# ) 5.00 3.20 0.50 !cnoe115
assign ((resid 108 and name HE1 ) or
( resid 108 and name HE2 )) ( resid 115 and name HG2# ) 5.00 3.20 0.50 !cnoe115
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 116 and name HN ) 3.50 1.70 0.00 !hnoe116
assign ((resid 108 and name HE1 ) or
( resid 108 and name HE2 )) ( resid 116 and name HN ) 3.50 1.70 0.00 !hnoe116
assign ((resid 108 and name HD1 ) or ( resid 108 and name HD2 ))
((resid 116 and name HB1 ) or ( resid 116 and name HB2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 108 and name HE1 ) or ( resid 108 and name HE2 ))
((resid 116 and name HB1 ) or ( resid 116 and name HB2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 116 and name HD2# ) 3.50 1.70 0.50 !cnoe108,2dd2o
assign ((resid 108 and name HE1 ) or
( resid 108 and name HE2 )) ( resid 116 and name HD2# ) 5.00 3.20 0.50 !cnoe108,2dd2o
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 116 and name HD1# ) 5.00 3.20 0.50 !cnoe108,2dd2o
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 133 and name HA ) 5.00 3.20 0.00 !2dd2o
assign ((resid 108 and name HD1 ) or
( resid 108 and name HD2 )) ( resid 134 and name HN ) 5.00 3.20 0.00 !hnoe134
!ARG109
assign ( resid 109 and name HN )
((resid 134 and name HE1 ) or ( resid 134 and name HE2 )) 5.00 3.20 0.00 !hnoe109
assign ( resid 109 and name HA )
((resid 110 and name HD1 ) or ( resid 110 and name HD2 )) 3.50 1.70 0.00 !ccnoe109
assign ( resid 109 and name HA ) ( resid 134 and name HN ) 3.50 1.70 0.00 !hnoe134
assign ((resid 109 and name HD1 ) or
( resid 109 and name HD2 )) ( resid 135 and name HB# ) 5.00 3.20 0.50 !cnoe135
assign ((resid 109 and name HD1 ) or
( resid 109 and name HD2 )) ( resid 135 and name HN ) 5.00 3.20 0.00 !hnoe135
assign ((resid 109 and name HD1 ) or ( resid 109 and name HD2 ))
((resid 136 and name HG1 ) or ( resid 136 and name HG2 )) 3.50 1.70 0.00 !ccnoe,b
!GLN111
assign ((resid 111 and name HG1 ) or ( resid 111 and name HG2 ))
((resid 114 and name HD1 ) or ( resid 114 and name HD2 )) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 111 and name HB1 ) or
( resid 111 and name HB2 )) ( resid 135 and name HB# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 111 and name HG1 ) or
( resid 111 and name HG2 )) ( resid 135 and name HB# ) 3.50 1.70 0.50 !ccnoe,b
assign ((resid 111 and name HG1 ) or
( resid 111 and name HG2 )) ( resid 135 and name HA ) 5.00 3.20 0.00 !ccnoe,b
!SER112
assign ( resid 112 and name HA ) ( resid 113 and name HN ) 3.50 1.70 0.00 !hnoe113
assign ( resid 112 and name HA )
((resid 114 and name HD1 ) or ( resid 114 and name HD2 )) 5.00 3.20 0.00 !ccnoe,b
assign ( resid 112 and name HA )
((resid 114 and name HG1 ) or ( resid 114 and name HG2 )) 5.00 3.20 0.00 !ccnoe,b
!GLY113
assign ((resid 113 and name HA1 ) or
( resid 113 and name HA2 )) ( resid 114 and name HN ) 2.70 0.90 0.00 !hnoe114
!ARG114
assign ( resid 114 and name HN ) ( resid 115 and name HN ) 5.00 3.20 0.00 !hnoe114,b
assign ( resid 114 and name HA ) ( resid 115 and name HN ) 3.50 1.70 0.00 !hnoe115
!VAL115
assign ( resid 115 and name HN ) ( resid 115 and name HG2# ) 2.70 0.90 0.50 !ch3noe115,x1=180
assign ( resid 115 and name HA ) ( resid 116 and name HN ) 2.70 0.90 0.00 !hnoe116
assign ( resid 115 and name HG1# ) ( resid 116 and name HN ) 2.70 0.90 0.50 !ch3noe115
assign ( resid 115 and name HG1# ) ( resid 118 and name HB# ) 3.50 1.70 1.00 !ccnoe115
assign ( resid 115 and name HG1# ) ( resid 121 and name HE ) 5.00 3.20 0.50 !hnoe121he
!LEU116
assign ( resid 116 and name HA ) ( resid 117 and name HN ) 3.50 1.70 0.00 !hnoe117
assign ( resid 116 and name HD1# ) ( resid 117 and name HN ) 3.50 1.70 0.50 !hnoe117,ch3noe
assign ( resid 116 and name HD1# ) ( resid 120 and name HN ) 5.00 3.20 0.50 !hnoe120
assign ( resid 116 and name HD2# ) ( resid 120 and name HG2# ) 5.00 3.20 1.00 !ccnoe120
assign ( resid 116 and name HD1# ) ( resid 120 and name HG2# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 116 and name HD1# ) ( resid 120 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 116 and name HD1# )
((resid 121 and name HD1 ) or ( resid 121 and name HD2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 116 and name HD2# )
((resid 121 and name HG1 ) or ( resid 121 and name HG2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 116 and name HD2# )
((resid 121 and name HD1 ) or ( resid 121 and name HD2 )) 3.50 1.70 0.50 !ccnoe121
assign ((resid 116 and name HB1 ) or
( resid 116 and name HB2 )) ( resid 121 and name HE ) 5.00 3.20 0.00 !hnoe121he
assign ( resid 116 and name HD2# ) ( resid 121 and name HE ) 5.00 3.20 0.50 !hnoe121he
assign ( resid 116 and name HD2# ) ( resid 131 and name HG2# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 116 and name HD2# ) ( resid 131 and name HG1# ) 3.50 1.70 1.00 !ccnoe,b
!SER117
assign ( resid 117 and name HA ) ( resid 118 and name HN ) 3.50 1.70 0.00 !hnoe118
assign ((resid 117 and name HB1 ) or
( resid 117 and name HB2 )) ( resid 120 and name HG2# ) 5.00 3.20 0.50 !ccnoe120
!ALA118
assign ( resid 118 and name HA ) ( resid 121 and name HN ) 3.50 1.70 0.00 !hnoe121
assign ( resid 118 and name HA ) ( resid 122 and name HN ) 5.00 3.20 0.00 !hnoe122
assign ( resid 118 and name HA )
((resid 121 and name HB1 ) or ( resid 121 and name HB2 )) 5.00 3.20 0.00 !ccnoe118
assign ( resid 118 and name HA )
((resid 121 and name HG1 ) or ( resid 121 and name HG2 )) 5.00 3.20 0.00 !ccnoe118
assign ( resid 118 and name HA )
((resid 121 and name HD1 ) or ( resid 121 and name HD2 )) 5.00 3.20 0.00 !ccnoe118
assign ( resid 118 and name HB# )
((resid 121 and name HB1 ) or ( resid 121 and name HB2 )) 5.00 3.20 0.50 !ccnoe118
!MET119
assign ( resid 119 and name HN ) ( resid 120 and name HN ) 2.70 0.90 0.00 !hnoe120
assign ( resid 119 and name HA ) ( resid 122 and name HN ) 3.50 1.70 0.00 !hnoe122
!ILE120
assign ( resid 120 and name HN ) ( resid 121 and name HN ) 2.70 0.90 0.00 !hnoe120,b
assign ( resid 120 and name HA ) ( resid 121 and name HN ) 3.50 1.70 0.00 !hnoe121
assign ( resid 120 and name HA ) ( resid 123 and name HN ) 3.50 1.70 0.00 !hnoe123
assign ( resid 120 and name HA ) ( resid 123 and name HB# ) 3.50 1.70 0.50 !cnoe123,ccnoe123,b
assign ( resid 120 and name HD1# ) ( resid 123 and name HB# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 120 and name HD1# ) ( resid 124 and name HN ) 6.00 4.20 0.50 !hnoe124
assign ( resid 120 and name HD1# ) ( resid 129 and name HZ ) 3.50 1.70 0.50 !cnoe120
assign ( resid 120 and name HD1# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 5.00 3.20 0.50 !cnoe120
assign ( resid 120 and name HD1# )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 5.00 3.20 0.50 !cnoe120
assign ( resid 120 and name HG2# ) ( resid 129 and name HZ ) 3.50 1.70 0.50 !cnoe120
assign ( resid 120 and name HG2# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 3.50 1.70 0.50 !cnoe120
assign ( resid 120 and name HG2# )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 5.00 3.20 0.50 !cnoe120
assign ( resid 120 and name HG2# ) ( resid 131 and name HG1# ) 3.50 1.70 1.00 !cnoe120
assign ( resid 120 and name HD1# ) ( resid 131 and name HG1# ) 6.00 4.20 1.00 !cnoe120,ccnoe131
assign ( resid 120 and name HD1# ) ( resid 131 and name HG2# ) 6.00 4.20 1.00 !cnoe120,ccnoe131
!ARG121
assign ( resid 121 and name HN ) ( resid 122 and name HN ) 2.70 0.90 0.00 !hnoe121,b
assign ( resid 121 and name HA ) ( resid 124 and name HN ) 5.00 3.20 0.00 !hnoe124
assign ( resid 121 and name HA ) ( resid 124 and name HB# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 121 and name HA ) ( resid 131 and name HG2# ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 121 and name HA ) ( resid 131 and name HG1# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 121 and name HG1 ) or
( resid 121 and name HG2 )) ( resid 131 and name HG1# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 121 and name HD1 ) or
( resid 121 and name HD2 )) ( resid 131 and name HG1# ) 3.50 1.70 0.50 !ccnoe,b
assign ((resid 121 and name HD1 ) or
( resid 121 and name HD2 )) ( resid 131 and name HG2# ) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 121 and name HE ) ( resid 131 and name HG1# ) 3.50 1.70 0.50 !hnoe121he
!GLY122
assign ( resid 122 and name HN ) ( resid 123 and name HN ) 2.70 0.90 0.00 !hnoe122,b
!ALA123
assign ( resid 123 and name HN ) ( resid 124 and name HN ) 3.50 1.70 0.00 !hnoe123,b
assign ( resid 123 and name HB# )
((resid 129 and name HB1 ) or ( resid 129 and name HB2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 123 and name HB# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 2.70 0.90 0.50 !cnoe123
assign ( resid 123 and name HB# )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 2.70 0.90 0.50 !cnoe123
assign ( resid 123 and name HB# ) ( resid 129 and name HZ ) 2.70 0.90 0.50 !cnoe123
!ALA124
assign ( resid 124 and name HA ) ( resid 125 and name HN ) 3.50 1.70 0.00 !hnoe125
assign ( resid 124 and name HN )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 3.50 1.70 0.00 !hnoe124
assign ( resid 124 and name HN )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 5.00 3.20 0.00 !hnoe124
assign ( resid 124 and name HN ) ( resid 131 and name HG2# ) 3.50 1.70 0.50 !hnoe124
assign ( resid 124 and name HA )
((resid 129 and name HB1 ) or ( resid 129 and name HB2 )) 5.00 3.20 0.00 !ccnoe124
assign ( resid 124 and name HA )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 5.00 3.20 0.00 !cnoe124
assign ( resid 124 and name HB# ) ( resid 126 and name HN ) 3.50 1.70 0.50 !hnoe126
assign ( resid 124 and name HB# )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 5.00 3.20 0.50 !cnoe124
assign ( resid 124 and name HB# )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 3.50 1.70 0.50 !cnoe124,2dd2o
assign ( resid 124 and name HB# ) ( resid 130 and name HA ) 3.50 1.70 0.50 !ccnoe130
assign ( resid 124 and name HB# ) ( resid 131 and name HN ) 5.00 3.20 0.50 !hnoe131
assign ( resid 124 and name HB# ) ( resid 131 and name HB ) 5.00 3.20 0.50 !ccnoe124
assign ( resid 124 and name HB# ) ( resid 131 and name HG2# ) 2.70 0.90 1.00 !ccnoe131
!ASP125
assign ( resid 125 and name HN ) ( resid 126 and name HN ) 2.70 0.90 0.00 !hnoe125,b
assign ( resid 125 and name HN )
((resid 129 and name HB1 ) or ( resid 129 and name HB2 )) 5.00 3.20 0.00 !hnoe125
assign ( resid 125 and name HN )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 3.50 1.70 0.00 !hnoe125
assign ( resid 125 and name HN )
((resid 129 and name HE1 ) or ( resid 129 and name HE2 )) 5.00 3.20 0.00 !hnoe125
assign ( resid 125 and name HA ) ( resid 126 and name HN ) 3.50 1.70 0.00 !hnoe126,ovH2O
!GLY126
assign ( resid 126 and name HN ) ( resid 127 and name HN ) 5.00 3.20 0.00 !hnoe126,b
assign ( resid 126 and name HN ) ( resid 129 and name HN ) 5.00 3.20 0.00 !hnoe126,b
assign ( resid 126 and name HN )
((resid 129 and name HD1 ) or ( resid 129 and name HD2 )) 3.50 1.70 0.00 !hnoe126
assign ( resid 126 and name HN ) ( resid 130 and name HA ) 5.00 3.20 0.00 !hnoe126
assign ( resid 126 and name HN )
((resid 130 and name HG1 ) or ( resid 130 and name HG2 )) 3.50 1.70 0.00 !hnoe126
assign ( resid 126 and name HN ) ( resid 131 and name HN ) 6.00 4.20 0.00 !hnoe126,b
assign ((resid 126 and name HA1 ) or
( resid 126 and name HA2 )) ( resid 129 and name HN ) 6.00 4.20 0.00 !hnoe129
assign ((resid 126 and name HA1 ) or ( resid 126 and name HA2 ))
((resid 130 and name HG1 ) or ( resid 130 and name HG2 )) 3.50 1.70 0.00 !ccnoe126,b
assign ((resid 126 and name HA1 ) or
( resid 126 and name HA2 )) ( resid 131 and name HN ) 5.00 3.20 0.00 !hnoe131
assign ((resid 126 and name HA1 ) or
( resid 126 and name HA2 )) ( resid 132 and name HE1 ) 5.00 3.20 0.00 !hnoe132he1,canrlx
!SER127
assign ( resid 127 and name HN ) ( resid 128 and name HN ) 2.70 0.90 0.00 !hnoe127,b
assign ( resid 127 and name HN )
((resid 128 and name HB1 ) or ( resid 128 and name HB2 )) 5.00 3.20 0.00 !hnoe127
assign ( resid 127 and name HN ) ( resid 129 and name HN ) 3.50 1.70 0.00 !hnoe127,b
assign ( resid 127 and name HN )
((resid 130 and name HG1 ) or ( resid 130 and name HG2 )) 5.00 3.20 0.00 !hnoe127
assign ( resid 127 and name HA ) ( resid 128 and name HN ) 5.00 3.20 0.00 !hnoe128
!ARG128
assign ( resid 128 and name HN ) ( resid 129 and name HN ) 2.70 0.90 0.00 !hnoe128,b
!PHE129
assign ( resid 129 and name HA ) ( resid 130 and name HN ) 2.70 0.90 0.00 !hnoe130
assign ((resid 129 and name HD1 ) or
( resid 129 and name HD2 )) ( resid 130 and name HN ) 3.50 1.70 0.00 !hnoe130
assign ((resid 129 and name HD1 ) or
( resid 129 and name HD2 )) ( resid 131 and name HN ) 5.00 3.20 0.00 !hnoe131
assign ((resid 129 and name HE1 ) or
( resid 129 and name HE2 )) ( resid 131 and name HN ) 5.00 3.20 0.00 !hnoe131
assign ( resid 129 and name HZ ) ( resid 131 and name HN ) 6.00 4.20 0.00 !hnoe131
assign ((resid 129 and name HD1 ) or
( resid 129 and name HD2 )) ( resid 131 and name HG2# ) 5.00 3.20 0.50 !cnoe131
assign ((resid 129 and name HE1 ) or
( resid 129 and name HE2 )) ( resid 131 and name HG2# ) 3.50 1.70 0.50 !cnoe131
!GLN130
assign ( resid 130 and name HA ) ( resid 131 and name HN ) 2.70 0.90 0.00 !hnoe131
assign ( resid 130 and name HA ) ( resid 132 and name HD1 ) 5.00 3.20 0.00 !2dd2o
assign ( resid 130 and name HA ) ( resid 132 and name HE1 ) 5.00 3.20 0.00 !hnoe132he1
assign ((resid 130 and name HB1 ) or
( resid 130 and name HB2 )) ( resid 132 and name HE1 ) 3.50 1.70 0.00 !hnoe132he1
assign ((resid 130 and name HG1 ) or
( resid 130 and name HG2 )) ( resid 132 and name HE1 ) 5.00 3.20 0.00 !hnoe132he1
!VAL131
assign ( resid 131 and name HN ) ( resid 131 and name HG2# ) 2.70 0.90 0.50 !ch3noe,x1=180
assign ( resid 131 and name HN ) ( resid 132 and name HE1 ) 5.00 3.20 0.00 !hnoe131,b
assign ( resid 131 and name HN ) ( resid 132 and name HD1 ) 3.50 1.70 0.00 !hnoe131
assign ( resid 131 and name HA ) ( resid 132 and name HN ) 2.70 0.90 0.00 !hnoe132
assign ( resid 131 and name HG1# ) ( resid 132 and name HN ) 2.70 0.90 0.50 !ch3noe,cnoe131
assign ( resid 131 and name HG1# ) ( resid 133 and name HN ) 5.00 3.20 0.50 !hnoe133
!TRP132
assign ( resid 132 and name HA ) ( resid 133 and name HN ) 2.70 0.90 0.00 !hnoe133
assign ( resid 132 and name HE3 ) ( resid 133 and name HN ) 5.00 3.20 0.00 !hnoe133
assign ( resid 132 and name HD1 ) ( resid 133 and name HN ) 5.00 3.20 0.00 !hnoe133
assign ( resid 132 and name HE3 ) ( resid 142 and name HN ) 5.00 3.20 0.00 !hnoe142
assign ( resid 132 and name HZ3 ) ( resid 142 and name HN ) 6.00 4.20 0.00 !hnoe142
assign ( resid 132 and name HE3 ) ( resid 142 and name HA ) 5.00 3.20 0.00 !2dnoe
assign ( resid 132 and name HZ3 ) ( resid 142 and name HA ) 5.00 3.20 0.00 !2dnoe
assign ( resid 132 and name HZ3 ) ( resid 142 and name HE# ) 5.00 3.20 0.50 !cnoe142
assign ( resid 132 and name HE3 ) ( resid 142 and name HE# ) 3.50 1.70 0.50 !cnoe142
assign ( resid 132 and name HZ3 ) ( resid 145 and name HN ) 3.50 1.70 0.00 !hnoe145
assign ( resid 132 and name HE3 ) ( resid 145 and name HN ) 5.00 3.20 0.00 !hnoe145
assign ( resid 132 and name HH2 ) ( resid 145 and name HN ) 5.00 3.20 0.00 !hnoe145
assign ( resid 132 and name HH2 ) ( resid 146 and name HN ) 3.50 1.70 0.00 !hnoe146
assign ( resid 132 and name HH2 ) ( resid 146 and name HA ) 3.50 1.70 0.00 !2dd2o
assign ( resid 132 and name HH2 )
((resid 146 and name HD1 ) or ( resid 146 and name HD2 )) 3.50 1.70 0.00 !2dd2o
assign ( resid 132 and name HH2 )
((resid 146 and name HE1 ) or ( resid 146 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ( resid 132 and name HZ2 ) ( resid 146 and name HA ) 5.00 3.20 0.00 !2dd2o
assign ( resid 132 and name HZ2 )
((resid 146 and name HD1 ) or ( resid 146 and name HD2 )) 3.50 1.70 0.00 !2dd2o
assign ( resid 132 and name HZ2 )
((resid 146 and name HE1 ) or ( resid 146 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ( resid 132 and name HZ2 ) ( resid 146 and name HN ) 5.00 3.20 0.00 !hnoe146
assign ( resid 132 and name HZ3 ) ( resid 146 and name HN ) 3.50 1.70 0.00 !hnoe146
assign ( resid 132 and name HZ3 )
((resid 146 and name HD1 ) or ( resid 146 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ( resid 132 and name HE1 )
((resid 146 and name HD1 ) or ( resid 146 and name HD2 )) 5.00 3.20 0.00 !hnoe132he
assign ( resid 132 and name HE1 )
((resid 146 and name HE1 ) or ( resid 146 and name HE2 )) 5.00 3.20 0.00 !hnoe132he
!ASP133
assign ( resid 133 and name HA ) ( resid 134 and name HN ) 2.70 0.90 0.00 !hnoe134
assign ( resid 133 and name HA )
((resid 134 and name HD1 ) or ( resid 134 and name HD2 )) 3.50 1.70 0.00 !2dd2o
!TYR134
assign ( resid 134 and name HA ) ( resid 135 and name HN ) 2.70 0.90 0.00 !hnoe135
assign ( resid 134 and name HA ) ( resid 142 and name HE# ) 3.50 1.70 0.50 !cnoe142,ccnoe142
assign ((resid 134 and name HB1 ) or
( resid 134 and name HB2 )) ( resid 142 and name HE# ) 5.00 3.20 0.50 !ccnoe142
assign ((resid 134 and name HD1 ) or
( resid 134 and name HD2 )) ( resid 135 and name HN ) 3.50 1.70 0.00 !hnoe135
assign ((resid 134 and name HE1 ) or
( resid 134 and name HE2 )) ( resid 136 and name HA ) 3.50 1.70 0.00 !cnoe136
assign ((resid 134 and name HE1 ) or ( resid 134 and name HE2 ))
((resid 136 and name HG1 ) or ( resid 136 and name HG2 )) 3.50 1.70 0.00 !cnoe136
assign ((resid 134 and name HD1 ) or
( resid 134 and name HD2 )) ( resid 138 and name HN ) 5.00 3.20 0.00 !hnoe138
assign ((resid 134 and name HD1 ) or
( resid 134 and name HD2 )) ( resid 139 and name HN ) 5.00 3.20 0.00 !hnoe139
assign ((resid 134 and name HE1 ) or
( resid 134 and name HE2 )) ( resid 139 and name HN ) 5.00 3.20 0.00 !hnoe139
assign ((resid 134 and name HD1 ) or
( resid 134 and name HD2 )) ( resid 139 and name HA ) 3.50 1.70 0.00 !2dd2o
assign ((resid 134 and name HE1 ) or
( resid 134 and name HE2 )) ( resid 139 and name HA ) 5.00 3.20 0.00 !2dd2o
assign ((resid 134 and name HD1 ) or
( resid 134 and name HD2 )) ( resid 139 and name HG1# ) 3.50 1.70 0.50 !cnoe139mg2
assign ((resid 134 and name HE1 ) or
( resid 134 and name HE2 )) ( resid 139 and name HG1# ) 3.50 1.70 0.50 !cnoe139mg2
assign ((resid 134 and name HD1 ) or
( resid 134 and name HD2 )) ( resid 139 and name HG2# ) 5.00 3.20 0.50 !cnoe139mg1
assign ((resid 134 and name HE1 ) or
( resid 134 and name HE2 )) ( resid 139 and name HG2# ) 5.00 3.20 0.50 !cnoe139mg1
assign ( resid 134 and name HH ) ( resid 139 and name HG2# ) 6.00 4.20 0.50 !2dnoefil
assign ((resid 134 and name HD1 ) or
( resid 134 and name HD2 )) ( resid 142 and name HE# ) 3.50 1.70 0.50 !cnoe142,2dnoe
assign ((resid 134 and name HE1 ) or
( resid 134 and name HE2 )) ( resid 142 and name HE# ) 5.00 3.20 0.50 !cnoe142
!ALA135
assign ( resid 135 and name HA ) ( resid 136 and name HN ) 2.70 0.90 0.00 !hnoe136
assign ( resid 135 and name HA )
((resid 138 and name HG1 ) or ( resid 138 and name HG2 )) 5.00 3.20 0.00 !ccnoe135
assign ( resid 135 and name HN )
((resid 138 and name HG1 ) or ( resid 138 and name HG2 )) 3.50 1.70 0.00 !hnoe135
assign ( resid 135 and name HN ) ( resid 138 and name HN ) 5.00 3.20 0.00 !hnoe135,b
assign ( resid 135 and name HB# ) ( resid 138 and name HN ) 3.50 1.70 0.50 !hnoe138
assign ( resid 135 and name HB# )
((resid 138 and name HG1 ) or ( resid 138 and name HG2 )) 3.50 1.70 0.50 !ccnoe,b
!GLU136
assign ( resid 136 and name HA ) ( resid 139 and name HN ) 5.00 3.20 0.00 !hnoe139
assign ( resid 136 and name HA ) ( resid 139 and name HB ) 6.00 4.20 0.00 !ccnoe139
assign ( resid 136 and name HA ) ( resid 139 and name HG1# ) 5.00 3.20 0.50 !ccnoe139
assign ((resid 136 and name HB1 ) or
( resid 136 and name HB2 )) ( resid 139 and name HG1# ) 5.00 3.20 0.50 !ccnoe139
assign ((resid 136 and name HG1 ) or
( resid 136 and name HG2 )) ( resid 139 and name HG1# ) 5.00 3.20 0.50 !ccnoe139
!GLY137
assign ( resid 137 and name HN ) ( resid 138 and name HN ) 5.00 3.20 0.00 !hnoe137,b
assign ((resid 137 and name HA1 ) or
( resid 137 and name HA2 )) ( resid 138 and name HN ) 3.50 1.70 0.00 !hnoe138
!GLU138
assign ( resid 138 and name HN ) ( resid 139 and name HN ) 2.70 0.90 0.00 !hnoe138,b
assign ( resid 138 and name HA ) ( resid 141 and name HN ) 3.50 1.70 0.00 !hnoe141
assign ( resid 138 and name HA ) ( resid 141 and name HB ) 5.00 3.20 0.00 !ccnoe141
assign ( resid 138 and name HA ) ( resid 141 and name HG2# ) 5.00 3.20 0.50 !cnoe141,b,ccnoe
assign ( resid 138 and name HA ) ( resid 142 and name HE# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 138 and name HG1 ) or
( resid 138 and name HG2 )) ( resid 141 and name HB ) 5.00 3.20 0.00 !ccnoe,b
assign ((resid 138 and name HG1 ) or
( resid 138 and name HG2 )) ( resid 141 and name HG2# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 138 and name HG1 ) or
( resid 138 and name HG2 )) ( resid 142 and name HE# ) 3.50 1.70 0.50 !ccnoe,b
!VAL139
assign ( resid 139 and name HN ) ( resid 140 and name HN ) 2.70 0.90 0.00 !hnoe139,b
assign ( resid 139 and name HA ) ( resid 139 and name HG2# ) 2.70 0.90 0.50 !ccnoe,b
assign ( resid 139 and name HA ) ( resid 142 and name HN ) 3.50 1.70 0.00 !hnoe142
assign ( resid 139 and name HA )
((resid 142 and name HB1 ) or ( resid 142 and name HB2 )) 5.00 3.20 0.00 !cnoe139
assign ( resid 139 and name HA ) ( resid 142 and name HE# ) 3.50 1.70 0.50 !ccnoe142
assign ( resid 139 and name HG1# ) ( resid 139 and name HN ) 2.70 0.90 0.50 !ch3noe,x1=60
assign ( resid 139 and name HG1# ) ( resid 140 and name HN ) 2.70 0.90 0.50 !ch3noe139
assign ( resid 139 and name HG1# )
((resid 140 and name HG1 ) or ( resid 140 and name HG2 )) 5.00 3.20 0.50 !ccnoe139
assign ( resid 139 and name HG2# ) ( resid 142 and name HE# ) 3.50 1.70 1.00 !ccnoe139
assign ( resid 139 and name HG1# ) ( resid 143 and name HD1# ) 5.00 3.20 1.00 !ccnoe,b
assign ( resid 139 and name HG2# ) ( resid 143 and name HD1# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 139 and name HG2# ) ( resid 143 and name HG ) 3.50 1.70 0.50 !ccnoe139
!GLU140
assign ( resid 140 and name HN ) ( resid 141 and name HN ) 2.70 0.90 0.00 !hnoe141,b
assign ( resid 140 and name HA ) ( resid 143 and name HN ) 5.00 3.20 0.00 !hnoe143
assign ( resid 140 and name HA ) ( resid 143 and name HD1# ) 5.00 3.20 0.50 !cnoe140,ccnoe143
!THR141
assign ( resid 141 and name HN ) ( resid 142 and name HN ) 2.70 0.90 0.00 !hnoe141,b
assign ( resid 141 and name HA ) ( resid 144 and name HN ) 3.50 1.70 0.00 !hnoe144
assign ( resid 141 and name HA )
((resid 144 and name HB1 ) or ( resid 144 and name HB2 )) 5.00 3.20 0.00 !ccnoe144
assign ( resid 141 and name HB ) ( resid 142 and name HN ) 3.50 1.70 0.00 !hnoe142
assign ( resid 141 and name HB ) ( resid 142 and name HE# ) 3.50 1.70 0.50 !ccnoe142
assign ( resid 141 and name HG2# ) ( resid 142 and name HA ) 5.00 3.20 0.50 !ccnoe141
assign ( resid 141 and name HG2# ) ( resid 142 and name HE# ) 3.50 1.70 1.00 !ccnoe,b
assign ( resid 141 and name HG2# ) ( resid 144 and name HN ) 3.50 1.70 0.50 !hnoe144
assign ( resid 141 and name HG2# )
((resid 144 and name HB1 ) or ( resid 144 and name HB2 )) 3.50 1.70 0.50 !cnoe141,ccnoe
assign ( resid 141 and name HG2# ) ( resid 145 and name HN ) 5.00 3.20 0.50 !hnoe145
assign ( resid 141 and name HG2# )
((resid 145 and name HG1 ) or ( resid 145 and name HG2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 141 and name HG2# )
((resid 145 and name HD1 ) or ( resid 145 and name HD2 )) 3.50 1.70 0.50 !cnoe141,ccnoe
!MET142
assign ( resid 142 and name HN ) ( resid 143 and name HN ) 2.70 0.90 0.00 !hnoe142,b
assign ( resid 142 and name HA ) ( resid 145 and name HN ) 5.00 3.20 0.00 !hnoe145,partial
assign ( resid 142 and name HA )
((resid 145 and name HB1 ) or ( resid 145 and name HB2 )) 5.00 3.20 0.00 !ccnoe145b
assign ( resid 142 and name HA )
((resid 145 and name HD1 ) or ( resid 145 and name HD2 )) 3.50 1.70 0.00 !ccnoe142,b
assign ( resid 142 and name HE# )
((resid 145 and name HD1 ) or ( resid 145 and name HD2 )) 3.50 1.70 0.50 !ccnoe,b
!LEU143
assign ( resid 143 and name HN ) ( resid 144 and name HN ) 2.70 0.90 0.00 !hnoe143,b
assign ( resid 143 and name HA ) ( resid 143 and name HD2# ) 3.50 1.70 0.50 !ccnoe
assign ( resid 143 and name HD1# )
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 6.00 4.20 0.50 !c13noe
assign ( resid 143 and name HD1# )
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 5.00 3.20 0.50 !c13noe
assign ( resid 143 and name HD1# ) ( resid 147 and name HZ ) 5.00 3.20 0.50 !c13noe
assign ( resid 143 and name HD2# )
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 5.00 3.20 0.50 !c13noe
assign ( resid 143 and name HD2# )
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 3.50 1.70 0.50 !c13noe
assign ( resid 143 and name HD2# ) ( resid 147 and name HZ ) 3.50 1.70 0.50 !c13noe143
!ASP144
assign ( resid 144 and name HN ) ( resid 145 and name HN ) 2.70 0.90 0.00 !hnoe144,b
assign ( resid 144 and name HA )
((resid 148 and name HG1 ) or ( resid 148 and name HG2 )) 5.00 3.20 0.00 !ccnoe,b
!ARG145
assign ( resid 145 and name HN ) ( resid 146 and name HN ) 2.70 0.90 0.00 !hnoe145,b
assign ( resid 145 and name HA ) ( resid 148 and name HN ) 3.50 1.70 0.00 !hnoe148
assign ( resid 145 and name HA ) ( resid 149 and name HB# ) 5.00 3.20 0.50 !ccnoe149
assign ((resid 145 and name HG1 ) or
( resid 145 and name HG2 )) ( resid 149 and name HB# ) 5.00 3.20 0.50 !ccnoe,b
!TYR146
assign ( resid 146 and name HN ) ( resid 147 and name HN ) 2.70 0.90 0.00 !hnoe146,b
assign ( resid 146 and name HA ) ( resid 149 and name HB# ) 5.00 3.20 0.50 !ccnoe149
assign ((resid 146 and name HD1 ) or ( resid 146 and name HD2 ))
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 3.50 1.70 0.00 !2dd2o
assign ((resid 146 and name HD1 ) or ( resid 146 and name HD2 ))
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 146 and name HD1 ) or
( resid 146 and name HD2 )) ( resid 147 and name HZ ) 5.00 3.20 0.00 !2dd2o
assign ((resid 146 and name HE1 ) or ( resid 146 and name HE2 ))
((resid 147 and name HD1 ) or ( resid 147 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 146 and name HE1 ) or ( resid 146 and name HE2 ))
((resid 147 and name HE1 ) or ( resid 147 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 146 and name HE1 ) or
( resid 146 and name HE2 )) ( resid 147 and name HZ ) 5.00 3.20 0.00 !2dd2o
assign ((resid 146 and name HD1 ) or
( resid 146 and name HD2 )) ( resid 149 and name HN ) 5.00 3.20 0.00 !hnoe149
assign ((resid 146 and name HD1 ) or
( resid 146 and name HD2 )) ( resid 149 and name HB# ) 6.00 4.20 0.50 !cnoe149
assign ((resid 146 and name HE1 ) or
( resid 146 and name HE2 )) ( resid 149 and name HB# ) 5.00 3.20 0.50 !cnoe149
assign ((resid 146 and name HD1 ) or ( resid 146 and name HD2 ))
((resid 150 and name HE1 ) or ( resid 150 and name HE2 )) 6.00 4.20 0.00 !2dd2o
assign ((resid 146 and name HE1 ) or ( resid 146 and name HE2 ))
((resid 150 and name HE1 ) or ( resid 150 and name HE2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 146 and name HD1 ) or ( resid 146 and name HD2 ))
((resid 150 and name HD1 ) or ( resid 150 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 146 and name HE1 ) or ( resid 146 and name HE2 ))
((resid 150 and name HD1 ) or ( resid 150 and name HD2 )) 3.50 1.70 0.00 !2dd2o
assign ((resid 146 and name HE1 ) or
( resid 146 and name HE2 )) ( resid 151 and name HD1# ) 5.00 3.20 0.50 !cnoe151,2dnoefil
!PHE147
assign ( resid 147 and name HA ) ( resid 150 and name HN ) 3.50 1.70 0.00 !hnoe150
assign ( resid 147 and name HA )
((resid 150 and name HD1 ) or ( resid 150 and name HD2 )) 5.00 3.20 0.00 !2dd2o
assign ((resid 147 and name HD1 ) or ( resid 147 and name HD2 ))
((resid 150 and name HD1 ) or ( resid 150 and name HD2 )) 3.50 1.70 0.00 !2dd2o
assign ((resid 147 and name HD1 ) or
( resid 147 and name HD2 )) ( resid 151 and name HN ) 5.00 3.20 0.00 !hnoe151
assign ((resid 147 and name HD1 ) or
( resid 147 and name HD2 )) ( resid 151 and name HD1# ) 3.50 1.70 0.50 !cnoe151
assign ((resid 147 and name HD1 ) or
( resid 147 and name HD2 )) ( resid 151 and name HD2# ) 3.50 1.70 0.50 !cnoe151
assign ((resid 147 and name HE1 ) or
( resid 147 and name HE2 )) ( resid 151 and name HD1# ) 5.00 3.20 0.50 !2dd2o
assign ((resid 147 and name HE1 ) or
( resid 147 and name HE2 )) ( resid 151 and name HD2# ) 5.00 3.20 0.50 !2dd2o
assign ( resid 147 and name HZ ) ( resid 151 and name HD1# ) 3.50 1.70 0.50 !2dd2o
!GLU148
assign ( resid 148 and name HN ) ( resid 149 and name HN ) 2.70 0.90 0.00 !hnoe148,b
assign ( resid 148 and name HA ) ( resid 151 and name HN ) 5.00 3.20 0.00 !hnoe151
assign ( resid 148 and name HA ) ( resid 151 and name HD1# ) 5.00 3.20 0.50 !ccnoe,b
assign ((resid 148 and name HG1 ) or
( resid 148 and name HG2 )) ( resid 151 and name HD1# ) 5.00 3.20 0.50 !ccnoe,b
!ALA149
assign ( resid 149 and name HN ) ( resid 150 and name HN ) 2.70 0.90 0.00 !hnoe149,b
assign ( resid 149 and name HB# )
((resid 150 and name HD1 ) or ( resid 150 and name HD2 )) 3.50 1.70 0.50 !cnoe149
assign ( resid 149 and name HB# )
((resid 150 and name HE1 ) or ( resid 150 and name HE2 )) 5.00 3.20 0.50 !cnoe149
!TYR150
assign ( resid 150 and name HN ) ( resid 151 and name HN ) 3.50 1.70 0.00 !nnoe150,b
assign ((resid 150 and name HE1 ) or
( resid 150 and name HE2 )) ( resid 151 and name HD1# ) 5.00 3.20 0.50 !cnoe151
assign ((resid 150 and name HE1 ) or
( resid 150 and name HE2 )) ( resid 151 and name HD2# ) 3.50 1.70 0.50 !cnoe151
assign ((resid 150 and name HD1 ) or
( resid 150 and name HD2 )) ( resid 151 and name HD2# ) 3.50 1.70 0.50 !cnoe151
assign ((resid 150 and name HE1 ) or ( resid 150 and name HE2 ))
((resid 154 and name HD1 ) or ( resid 154 and name HD2 )) 3.50 1.70 0.00 !cnoe154
assign ((resid 150 and name HE1 ) or ( resid 150 and name HE2 ))
((resid 154 and name HE1 ) or ( resid 154 and name HE2 )) 5.00 3.20 0.00 !cnoe154
!LEU151
assign ( resid 151 and name HA )
((resid 152 and name HD1 ) or ( resid 152 and name HD2 )) 3.50 1.70 0.00 !ccnoe,b
assign ( resid 151 and name HD2# )
((resid 152 and name HD1 ) or ( resid 152 and name HD2 )) 3.50 1.70 0.50 !ccnoe,b
assign ( resid 151 and name HD2# )
((resid 154 and name HB1 ) or ( resid 154 and name HB2 )) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 151 and name HD2# )
((resid 154 and name HD1 ) or ( resid 154 and name HD2 )) 5.00 3.20 0.50 !ccnoe,cnoe,b
assign ( resid 151 and name HD2# )
((resid 154 and name HE1 ) or ( resid 154 and name HE2 )) 3.50 1.70 0.50 !ccnoe,cnoe,b
!PRO152
assign ( resid 152 and name HA ) ( resid 153 and name HN ) 3.50 1.70 0.00 !hnoe153
assign ( resid 152 and name HA ) ( resid 155 and name HB ) 5.00 3.20 0.00 !ccnoe155
!LYS154
assign ( resid 154 and name HA )
((resid 157 and name HB1 ) or ( resid 157 and name HB2 )) 5.00 3.20 0.00 !ccnoe154
!HIS160
assign ( resid 160 and name HA ) ( resid 161 and name HD1 ) 2.70 0.90 0.00 !cnoe160
assign ( resid 160 and name HA ) ( resid 161 and name HD2 ) 2.70 0.90 0.00 !cnoe160
!Intermolecular NOE
assign ( resid 18 and name HD1# ) ( resid 318 and name HB# ) 3.50 1.70 1.00 !c13xf18,ccnoe118
assign ( resid 218 and name HD1# ) ( resid 118 and name HB# ) 3.50 1.70 1.00
assign ( resid 18 and name HD1# ) ( resid 319 and name HE# ) 5.00 3.20 1.00 !c13xf18,ccnoe119
assign ( resid 218 and name HD1# ) ( resid 119 and name HE# ) 5.00 3.20 1.00
assign ( resid 62 and name HN ) ( resid 318 and name HB# ) 5.00 3.20 0.50 !hnoe62
assign ( resid 262 and name HN ) ( resid 118 and name HB# ) 5.00 3.20 0.50
assign ( resid 62 and name HA ) ( resid 318 and name HB# ) 3.50 1.70 0.50 !c13xf118
assign ( resid 262 and name HA ) ( resid 118 and name HB# ) 3.50 1.70 0.50
assign ((resid 62 and name HB1 ) or
( resid 62 and name HB2 )) ( resid 318 and name HB# ) 5.00 3.20 0.50 !c13xf118
assign ((resid 262 and name HB1 ) or
( resid 262 and name HB2 )) ( resid 118 and name HB# ) 5.00 3.20 0.50
assign ((resid 62 and name HB1 ) or
( resid 62 and name HB2 )) ( resid 318 and name HA ) 5.00 3.20 0.00 !ccnoe
assign ((resid 262 and name HB1 ) or
( resid 262 and name HB2 )) ( resid 118 and name HA ) 5.00 3.20 0.00
assign ((resid 62 and name HB1 ) or
( resid 62 and name HB2 )) ( resid 322 and name HN ) 5.00 3.20 0.00 !hnoe
assign ((resid 262 and name HB1 ) or
( resid 262 and name HB2 )) ( resid 122 and name HN ) 5.00 3.20 0.00
assign ( resid 63 and name HA ) ( resid 319 and name HE# ) 6.00 4.20 0.50 !xf119,ccnoe119
assign ( resid 263 and name HA ) ( resid 119 and name HE# ) 6.00 4.20 0.50
assign ( resid 63 and name HN )
((resid 322 and name HA1 ) or ( resid 322 and name HA2 )) 5.00 3.20 0.00 !hnoe63
assign ( resid 263 and name HN )
((resid 122 and name HA1 ) or ( resid 122 and name HA2 )) 5.00 3.20 0.00
assign ( resid 63 and name HA )
((resid 322 and name HA1 ) or ( resid 322 and name HA2 )) 5.00 3.20 0.00 !cnoe63,b
assign ( resid 263 and name HA )
((resid 122 and name HA1 ) or ( resid 122 and name HA2 )) 5.00 3.20 0.00
assign ((resid 63 and name HG1 ) or ( resid 63 and name HG2 ))
((resid 322 and name HA1 ) or ( resid 322 and name HA2 )) 3.50 1.70 0.00 !cnoe63,b
assign ((resid 263 and name HG1 ) or ( resid 263 and name HG2 ))
((resid 122 and name HA1 ) or ( resid 122 and name HA2 )) 3.50 1.70 0.00
assign ((resid 63 and name HE21 ) or
( resid 63 and name HE22 )) ( resid 324 and name HB# ) 5.00 3.20 0.50 !hsqcnoe
assign ((resid 263 and name HE21 ) or
( resid 263 and name HE22 )) ( resid 124 and name HB# ) 5.00 3.20 0.50
!I65
assign ( resid 65 and name HN ) ( resid 318 and name HB# ) 6.00 4.20 0.50 !hnoe65
assign ( resid 118 and name HB# ) ( resid 265 and name HN ) 6.00 4.20 0.50
assign ( resid 65 and name HB ) ( resid 318 and name HB# ) 5.00 3.20 0.50 !c13xf118,ccnoe
assign ( resid 118 and name HB# ) ( resid 265 and name HB ) 5.00 3.20 0.50
assign ( resid 65 and name HD1# ) ( resid 318 and name HA ) 5.00 3.20 0.50 !c13xf65
assign ( resid 118 and name HA ) ( resid 265 and name HD1# ) 5.00 3.20 0.50
assign ( resid 65 and name HG2# ) ( resid 318 and name HA ) 5.00 3.20 0.50 !c13xf65
assign ( resid 265 and name HG2# ) ( resid 118 and name HA ) 5.00 3.20 0.50
assign ( resid 65 and name HD1# ) ( resid 318 and name HB# ) 2.70 0.90 1.00 !c13xf65,b
assign ( resid 118 and name HB# ) ( resid 265 and name HD1# ) 2.70 0.90 1.00
assign ( resid 65 and name HG2# ) ( resid 318 and name HB# ) 2.70 0.90 1.00 !c13xf65,b
assign ( resid 118 and name HB# ) ( resid 265 and name HG2# ) 2.70 0.90 1.00
assign ( resid 65 and name HG2# ) ( resid 319 and name HA ) 6.00 4.20 0.50 !c13xf65
assign ( resid 265 and name HG2# ) ( resid 119 and name HA ) 6.00 4.20 0.50
assign ( resid 65 and name HG2# ) ( resid 319 and name HE# ) 3.50 1.70 1.00 !c13xf65,b
assign ( resid 119 and name HE# ) ( resid 265 and name HG2# ) 3.50 1.70 1.00
assign ( resid 65 and name HD1# ) ( resid 319 and name HE# ) 5.00 3.20 1.00 !c13xf65,b
assign ( resid 119 and name HE# ) ( resid 265 and name HD1# ) 5.00 3.20 1.00
!H66
assign ( resid 66 and name HD2 ) ( resid 319 and name HA ) 5.00 3.20 0.00 !2dd2o,cnoe
assign ( resid 266 and name HD2 ) ( resid 119 and name HA ) 5.00 3.20 0.00
assign ( resid 66 and name HD2 ) ( resid 319 and name HE# ) 2.70 0.90 0.50 !xf119
assign ( resid 266 and name HD2 ) ( resid 119 and name HE# ) 2.70 0.90 0.50
assign ( resid 66 and name HD2 ) ( resid 322 and name HN ) 6.00 4.20 0.00 !n15noe
assign ( resid 266 and name HD2 ) ( resid 122 and name HN ) 6.00 4.20 0.00
assign ( resid 66 and name HD2 ) ( resid 323 and name HN ) 5.00 3.20 0.00 !n15noe
assign ( resid 266 and name HD2 ) ( resid 123 and name HN ) 5.00 3.20 0.00
assign ( resid 66 and name HD2 ) ( resid 323 and name HB# ) 3.50 1.70 0.50 !xf123
assign ( resid 266 and name HD2 ) ( resid 123 and name HB# ) 3.50 1.70 0.50
assign ( resid 66 and name HE1 ) ( resid 323 and name HB# ) 5.00 3.20 0.50 !2dnoed2o,cnoe
assign ( resid 266 and name HE1 ) ( resid 123 and name HB# ) 5.00 3.20 0.50
!L70,70-98 not in ch3noe
!assign ( resid 70 and name HD1# ) ( resid 298 and name HG1# ) 3.50 1.70 1.00 !xf70,b,can rlx
!assign ( resid 270 and name HD1# ) ( resid 98 and name HG1# ) 3.50 1.70 1.00
!assign ( resid 70 and name HD2# ) ( resid 298 and name HG1# ) 3.50 1.70 1.00 !xf70,b,can rlx
!assign ( resid 270 and name HD2# ) ( resid 98 and name HG1# ) 3.50 1.70 1.00
!assign ( resid 70 and name HD2# ) ( resid 298 and name HG2# ) 5.00 3.20 1.00 !xf70,b
!assign ( resid 270 and name HD2# ) ( resid 98 and name HG2# ) 5.00 3.20 1.00
assign ( resid 70 and name HD1# ) ( resid 299 and name HB# ) 5.00 3.20 1.00 !xf70,b
assign ( resid 270 and name HD1# ) ( resid 99 and name HB# ) 5.00 3.20 1.00
assign ((resid 70 and name HB1 ) or
( resid 70 and name HB2 )) ( resid 319 and name HE# ) 5.00 3.20 0.50 !xf119.ccnoe119
assign ((resid 270 and name HB1 ) or
( resid 270 and name HB2 )) ( resid 119 and name HE# ) 5.00 3.20 0.50
assign ( resid 70 and name HG ) ( resid 319 and name HE# ) 3.50 1.70 0.50 !xf119.ccnoe119
assign ( resid 270 and name HG ) ( resid 119 and name HE# ) 3.50 1.70 0.50
assign ( resid 70 and name HD2# ) ( resid 319 and name HE# ) 2.70 0.90 1.00 !xf70,b
assign ( resid 119 and name HE# ) ( resid 270 and name HD2# ) 2.70 0.90 1.00
assign ( resid 70 and name HD1# ) ( resid 319 and name HE# ) 5.00 3.20 1.00 !xf70,b
assign ( resid 119 and name HE# ) ( resid 270 and name HD1# ) 5.00 3.20 1.00
assign ( resid 70 and name HD1# ) ( resid 318 and name HB# ) 6.00 4.20 1.00 !ccnoe70
assign ( resid 118 and name HB# ) ( resid 270 and name HD1# ) 6.00 4.20 1.00
assign ( resid 70 and name HD1# ) ( resid 320 and name HD1# ) 6.00 4.20 1.00 !ccnoe70
assign ( resid 120 and name HD1# ) ( resid 270 and name HD1# ) 6.00 4.20 1.00
assign ( resid 70 and name HD1# ) ( resid 323 and name HB# ) 6.00 4.20 1.00 !ccnoe70
assign ( resid 123 and name HB# ) ( resid 270 and name HD1# ) 6.00 4.20 1.00
assign ( resid 70 and name HD1# ) ( resid 324 and name HB# ) 6.00 4.20 1.00 !ccnoe70
assign ( resid 124 and name HB# ) ( resid 270 and name HD1# ) 6.00 4.20 1.00
assign ( resid 73 and name HD1# ) ( resid 319 and name HE# ) 5.00 3.20 1.00 !ccnoe73,xf119
assign ( resid 273 and name HD1# ) ( resid 119 and name HE# ) 5.00 3.20 1.00
assign ( resid 73 and name HD2# ) ( resid 319 and name HE# ) 5.00 3.20 1.00 !ccnoe73,xf119
assign ( resid 273 and name HD2# ) ( resid 119 and name HE# ) 5.00 3.20 1.00
assign ( resid 83 and name HA ) ( resid 288 and name HD2# ) 5.00 3.20 0.50 !c13xf88
assign ( resid 88 and name HD2# ) ( resid 283 and name HA ) 5.00 3.20 0.50
assign ( resid 83 and name HA ) ( resid 288 and name HD1# ) 5.00 3.20 0.50 !c13xf88
assign ( resid 88 and name HD1# ) ( resid 283 and name HA ) 5.00 3.20 0.50
assign ( resid 83 and name HB ) ( resid 288 and name HD1# ) 5.00 3.20 0.50 !c13xf88,ccnoe88
assign ( resid 283 and name HB ) ( resid 88 and name HD1# ) 5.00 3.20 0.50
assign ( resid 83 and name HG1# ) ( resid 288 and name HD1# ) 3.50 1.70 1.00 !c13xf88,b
assign ( resid 88 and name HD1# ) ( resid 283 and name HG1# ) 3.50 1.70 1.00
assign ( resid 83 and name HG1# ) ( resid 288 and name HD2# ) 2.70 0.90 1.00 !c13xf88,b
assign ( resid 88 and name HD2# ) ( resid 283 and name HG1# ) 2.70 0.90 1.00
assign ( resid 83 and name HG2# ) ( resid 288 and name HD1# ) 5.00 3.20 1.00 !c13xf88,b
assign ( resid 88 and name HD1# ) ( resid 283 and name HG2# ) 5.00 3.20 1.00
assign ( resid 83 and name HG2# ) ( resid 288 and name HD2# ) 5.00 3.20 1.00 !c13xf88,b
assign ( resid 88 and name HD2# ) ( resid 283 and name HG2# ) 5.00 3.20 1.00
assign ( resid 86 and name HA ) ( resid 288 and name HD1# ) 5.00 3.20 0.50 !c13xf88,cnoe,b
assign ( resid 88 and name HD1# ) ( resid 286 and name HA ) 5.00 3.20 0.50
assign ( resid 86 and name HA ) ( resid 288 and name HD2# ) 5.00 3.20 0.50 !c13xf88,cnoe,b
assign ( resid 88 and name HD2# ) ( resid 286 and name HA ) 5.00 3.20 0.50
assign ((resid 86 and name HB1 ) or
( resid 86 and name HB2 )) ( resid 288 and name HD1# ) 5.00 3.20 0.50 !ccnoe88
assign ((resid 286 and name HB1 ) or
( resid 286 and name HB2 )) ( resid 88 and name HD1# ) 5.00 3.20 0.50
assign ( resid 87 and name HN ) ( resid 288 and name HD2# ) 3.50 1.70 0.50 !n15xfnoe87, ch3noe!
assign ( resid 88 and name HD2# ) ( resid 287 and name HN ) 3.50 1.70 0.50
assign ( resid 87 and name HA ) ( resid 288 and name HD2# ) 5.00 3.20 0.50 !ccnoeb
assign ( resid 88 and name HD2# ) ( resid 287 and name HA ) 5.00 3.20 0.50
assign ((resid 87 and name HB1 ) or
( resid 87 and name HB2 )) ( resid 288 and name HD2# ) 5.00 3.20 0.50 !ccnoeb
assign ( resid 88 and name HD2# )
((resid 287 and name HB1 ) or ( resid 287 and name HB2 )) 5.00 3.20 0.50
!L88
assign ( resid 88 and name HA ) ( resid 290 and name HG1# ) 6.00 4.20 1.00 !xf90
assign ( resid 288 and name HA ) ( resid 90 and name HG1# ) 6.00 4.20 1.00
assign ( resid 88 and name HD2# ) ( resid 290 and name HB ) 5.00 3.20 0.50 !ccnoe88,xf88
assign ( resid 288 and name HD2# ) ( resid 90 and name HB ) 5.00 3.20 0.50
assign ( resid 88 and name HD1# ) ( resid 290 and name HG1# ) 5.00 3.20 1.00 !xf90
assign ( resid 288 and name HD1# ) ( resid 90 and name HG1# ) 5.00 3.20 1.00
assign ( resid 88 and name HD2# ) ( resid 290 and name HG1# ) 3.50 1.70 1.00 !xf90,ch3noe
assign ( resid 288 and name HD2# ) ( resid 90 and name HG1# ) 3.50 1.70 1.00
assign ( resid 88 and name HD2# ) ( resid 290 and name HG2# ) 5.00 3.20 1.00 !xf90,b,ch3noe
assign ( resid 288 and name HD2# ) ( resid 90 and name HG2# ) 5.00 3.20 1.00
assign ( resid 88 and name HD2# ) ( resid 291 and name HN ) 5.00 3.20 0.50 !n15xfnoe87,n15noe,ch3noe!
assign ( resid 288 and name HD2# ) ( resid 91 and name HN ) 5.00 3.20 0.50
assign ( resid 88 and name HD2# )
((resid 291 and name HA1 ) or ( resid 291 and name HA2 )) 5.00 3.20 0.50 !ccnoe
assign ((resid 91 and name HA1 ) or
( resid 91 and name HA2 )) ( resid 288 and name HD2# ) 5.00 3.20 0.50
assign ( resid 88 and name HD2# ) ( resid 294 and name HD1# ) 5.00 3.20 1.00 !xf94
assign ( resid 288 and name HD2# ) ( resid 94 and name HD1# ) 5.00 3.20 1.00
assign ( resid 88 and name HD1# ) ( resid 316 and name HA ) 5.00 3.20 0.50 !ccnoe,b
assign ( resid 288 and name HD1# ) ( resid 116 and name HA ) 5.00 3.20 0.50
assign ( resid 88 and name HD1# ) ( resid 316 and name HD1# ) 3.50 1.70 1.00 !c13xf116,b
assign ( resid 288 and name HD1# ) ( resid 116 and name HD1# ) 3.50 1.70 1.00
assign ( resid 88 and name HD2# ) ( resid 316 and name HD1# ) 5.00 3.20 1.00 !c13xf88
assign ( resid 288 and name HD2# ) ( resid 116 and name HD1# ) 5.00 3.20 1.00
assign ( resid 88 and name HD1# )
((resid 317 and name HB1 ) or ( resid 317 and name HB2 )) 5.00 3.20 0.50 !ccnoe,not in xf
assign ( resid 288 and name HD1# )
((resid 117 and name HB1 ) or ( resid 117 and name HB2 )) 5.00 3.20 0.50
assign ( resid 88 and name HD1# ) ( resid 317 and name HA ) 6.00 4.20 0.50 !ccnoe
assign ( resid 288 and name HD1# ) ( resid 117 and name HA ) 6.00 4.20 0.50
assign ( resid 88 and name HD1# ) ( resid 320 and name HD1# ) 3.50 1.70 1.00 !c13xf120
assign ( resid 288 and name HD1# ) ( resid 120 and name HD1# ) 3.50 1.70 1.00
assign ( resid 88 and name HD2# ) ( resid 320 and name HD1# ) 3.50 1.70 1.00 !c13xf120
assign ( resid 288 and name HD2# ) ( resid 120 and name HD1# ) 3.50 1.70 1.00
assign ( resid 88 and name HD1# ) ( resid 320 and name HG2# ) 5.00 3.20 1.00 !c13xf120
assign ( resid 288 and name HD1# ) ( resid 120 and name HG2# ) 5.00 3.20 1.00
assign ( resid 88 and name HD2# ) ( resid 320 and name HG2# ) 5.00 3.20 1.00 !ccnoe88
assign ( resid 288 and name HD2# ) ( resid 120 and name HG2# ) 5.00 3.20 1.00
assign ((resid 89 and name HA1 ) or
( resid 89 and name HA2 )) ( resid 319 and name HE# ) 5.00 3.20 0.50 !ccnoe119
assign ((resid 289 and name HA1 ) or
( resid 289 and name HA2 )) ( resid 119 and name HE# ) 5.00 3.20 0.50
assign ( resid 92 and name HN ) ( resid 320 and name HD1# ) 5.00 3.20 0.50 !n15noe,ch3noe,intra+inter
assign ( resid 292 and name HN ) ( resid 120 and name HD1# ) 5.00 3.20 0.50
assign ( resid 92 and name HA ) ( resid 320 and name HD1# ) 6.00 4.20 0.50 !xf120
assign ( resid 292 and name HA ) ( resid 120 and name HD1# ) 6.00 4.20 0.50
assign ((resid 92 and name HD1 ) or
( resid 92 and name HD2 )) ( resid 298 and name HG2# ) 5.00 3.20 0.50 !xf98
assign ( resid 98 and name HG2# )
((resid 292 and name HD1 ) or ( resid 292 and name HD2 )) 5.00 3.20 0.50
assign ((resid 92 and name HE1 ) or
( resid 92 and name HE2 )) ( resid 298 and name HG2# ) 3.50 1.70 0.50 !xf98
assign ( resid 98 and name HG2# )
((resid 292 and name HE1 ) or ( resid 292 and name HE2 )) 3.50 1.70 0.50
assign ((resid 92 and name HE1 ) or
( resid 92 and name HE2 )) ( resid 298 and name HG1# ) 5.00 3.20 0.50 !xf98
assign ( resid 98 and name HG1# )
((resid 292 and name HE1 ) or ( resid 292 and name HE2 )) 5.00 3.20 0.50
assign ((resid 92 and name HD1 ) or
( resid 92 and name HD2 )) ( resid 319 and name HE# ) 2.70 0.90 0.50 !xf119
assign ( resid 119 and name HE# )
((resid 292 and name HD1 ) or ( resid 292 and name HD2 )) 2.70 0.90 0.50
assign ((resid 92 and name HE1 ) or
( resid 92 and name HE2 )) ( resid 319 and name HE# ) 2.70 0.90 0.50 !xf119
assign ( resid 119 and name HE# )
((resid 292 and name HE1 ) or ( resid 292 and name HE2 )) 2.70 0.90 0.50
assign ((resid 92 and name HD1 ) or
( resid 92 and name HD2 )) ( resid 320 and name HD1# ) 5.00 3.20 0.50 !xf120
assign ( resid 120 and name HD1# )
((resid 292 and name HD1 ) or ( resid 292 and name HD2 )) 5.00 3.20 0.50
assign ((resid 92 and name HE1 ) or
( resid 92 and name HE2 )) ( resid 323 and name HB# ) 3.50 1.70 0.50 !xf123, 2dd2o
assign ( resid 123 and name HB# )
((resid 292 and name HE1 ) or ( resid 292 and name HE2 )) 3.50 1.70 0.50
assign ( resid 93 and name HA ) ( resid 319 and name HE# ) 5.00 3.20 0.50 !xf119,ccnoe119
assign ( resid 293 and name HA ) ( resid 119 and name HE# ) 5.00 3.20 0.50
assign ( resid 93 and name HN ) ( resid 320 and name HD1# ) 5.00 3.20 0.50 !hnoe93
assign ( resid 293 and name HN ) ( resid 120 and name HD1# ) 5.00 3.20 0.50
assign ((resid 95 and name HA1 ) or
( resid 95 and name HA2)) ( resid 298 and name HG1# ) 5.00 3.20 0.50 !xf98,ccnoe98,95assign?
assign ((resid 295 and name HA1 ) or
( resid 295 and name HA2)) ( resid 98 and name HG1# ) 5.00 3.20 0.50
assign ( resid 96 and name HA ) ( resid 298 and name HG1# ) 5.00 3.20 0.50 !xf98,ccnoe,b
assign ( resid 296 and name HA ) ( resid 98 and name HG1# ) 5.00 3.20 0.50
assign ( resid 98 and name HG1# ) ( resid 299 and name HA ) 6.00 3.20 0.50 !xf98
assign ( resid 298 and name HG1# ) ( resid 99 and name HA ) 6.00 3.20 0.50
assign ( resid 98 and name HG1# ) ( resid 299 and name HB# ) 3.50 1.70 1.00 !xf98,ccnoe,b
assign ( resid 298 and name HG1# ) ( resid 99 and name HB# ) 3.50 1.70 1.00
assign ( resid 99 and name HN ) ( resid 299 and name HB# ) 5.00 3.20 0.50 !n15xfnoe99
assign ( resid 299 and name HN ) ( resid 99 and name HB# ) 5.00 3.20 0.50
assign ( resid 99 and name HA ) ( resid 299 and name HB# ) 5.00 3.20 0.50 !xf99HB
assign ( resid 299 and name HA ) ( resid 99 and name HB# ) 5.00 3.20 0.50
assign ( resid 99 and name HB# ) ( resid 299 and name HB# ) 3.50 1.70 1.00 !xf99HB
assign ( resid 299 and name HB# ) ( resid 99 and name HB# ) 3.50 1.70 1.00
assign ( resid 99 and name HB# ) ( resid 300 and name HD2# ) 5.00 3.20 1.00 !xf99,b
assign ( resid 299 and name HB# ) ( resid 100 and name HD2# ) 5.00 3.20 1.00
assign ( resid 115 and name HG1# )
((resid 219 and name HD1 ) or ( resid 219 and name HD2 )) 3.50 3.20 0.50 !ccnoe115,b,cnoe115
assign ( resid 315 and name HG1# )
((resid 19 and name HD1 ) or ( resid 19 and name HD2 )) 3.50 3.20 0.50
assign ( resid 115 and name HG1# )
((resid 256 and name HG1 ) or ( resid 256 and name HG2 )) 3.50 3.20 0.50 !xf115,ccnoe115,b
assign ( resid 315 and name HG1# )
((resid 56 and name HG1 ) or ( resid 56 and name HG2 )) 3.50 3.20 0.50
assign ( resid 115 and name HG1# )
((resid 256 and name HB1 ) or ( resid 256 and name HB2 )) 5.00 3.20 0.50 !xf115,ccnoe115,b
assign ( resid 315 and name HG1# )
((resid 56 and name HB1 ) or ( resid 56 and name HB2 )) 5.00 3.20 0.50
assign ( resid 115 and name HG2# )
((resid 255 and name HA1 ) or ( resid 255 and name HA2 )) 5.00 3.20 0.50 !ccnoe115
assign ( resid 315 and name HG2# )
((resid 55 and name HA1 ) or ( resid 55 and name HA2 )) 5.00 3.20 0.50
assign ( resid 115 and name HG2# ) ( resid 257 and name HA ) 5.00 3.20 0.50 !ccnoe115
assign ( resid 315 and name HG2# ) ( resid 57 and name HA ) 5.00 3.20 0.50
assign ( resid 115 and name HG2# )
((resid 257 and name HB1 ) or ( resid 257 and name HB2 )) 3.50 3.20 0.50 !xf115,ccnoe115,b
assign ( resid 315 and name HG2# )
((resid 57 and name HB1 ) or ( resid 57 and name HB2 )) 3.50 3.20 0.50
assign ( resid 115 and name HG2# )
((resid 257 and name HG1 ) or ( resid 257 and name HG2 )) 5.00 3.20 0.50 !xf115,ccnoe115,b
assign ( resid 315 and name HG2# )
((resid 57 and name HG1 ) or ( resid 57 and name HG2 )) 5.00 3.20 0.50
Contact the webmaster for help, if required. Thursday, May 16, 2024 7:36:02 PM GMT (wattos1)