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 ( 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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 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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
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